A0A077Z091_TRITR Loading...

General transcription factor 3C polypeptide 1

AlphaFold DB , UniProt , Accession A0A077Z091, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,651 aa.

						>A0A077Z091_TRITR|A0A077Z091
MLSTVVPKNHAMTSKDAHMVAICFDEVALEGLEGITLNSLWVRLLTRPGFEVHADGSLKQHLWSAIRPQKHLQFFVLDTARAALTKRKIDEDTFPAAIVKGEPGIYGSCCDFRTRKDVTKTLRLGDKYELYSTVVEDFDDRLVVVASQEWRTKAIIGPAISVQVFLRTCIHMLPVHYAMLERIARSRHHGVKTCGDTSLHKVFNVRAKDVFYLVERYVRMGVLYKRSCEMSVDGIGLRVGAFICLQRFSPKNMRDTPEMKRLLDYIRSRPDKCCSKSDLIEELKLDKWGLERAILRLQHRVKVRTEIQYTRKGNPLKKPRIPRDQMEIVCLNEKCAKRVVDQKKREKSEEIDSSSDEKPNWPQSNYFRALDYKIIQTVNSSGNEGITLKDINRYLRISRKVLARRLTRFEKDGYVKALMFTAGRVRMWKYYDPKAEPPSAELYDQLYKKTSVDFNSLPNFSLTDRSCKRLMAIIDFVNERRVVTNFETGQMIREREKEEGYDYCIDKNATATLLRTLASQKLVKVYQTILLDSRNKAVEFFCSPDVQSNDATLLARMRKAQLKSSPSNTLKAAVAPKQPASSRKVEKVVKKSYAKKRSSQGKFVRMQLLHEFIYYLVRDYAGESHPEIANRHPADKADGQEPIVYVDEISWRRYLPPLPPRNDLPSGWFHVDDLVPMLPLSIACQIVVPSEEVDCFTEYLCDRTKRHYMIGDLPCSSQNHYMSFSFVRQRLINICWKLSYLGLIACSNAESAGGQLKDEYYFVHESAQLMDTSTSAAAYMTISEPISQYPKHIHKFVSLNDVRIYWLHLRAIVLSTWLGRRSAKRPDDFPRPRDSYLKASLPRYNFDQVKLLGEPVGPRIGAAGLNPYMFAHRIPNWVVNTRNACELENLEQMKLFAITHSHVIAYRVARLNKNWQSSSFMALSKYKGTLGARARWRSANPEGALRIDRENYCKEAKIGASRLLAFLGAQLAKGKIAKRKSAFLHSHRRMYQRQGYTNTELRLLVLLKSACEVVSSIFPGWYDLSTLVEMIRRHLPAFLTRHGSSVTSKVTALLSNNRKFGRTVVSTKINQIVENYQGNSTRLSAAAKNQVFAEVFDIACNIYKPNEKEEGLSLNNFELIWPSSQAQTTSEKLTENTVRRWALSNVIVGSLASDNDPLQLRYPEKCPIAKQQHFTISDIAEETDGTVRSAGASSTVVAHPFSPRNQVNICGQFRNLFSHNFCPKFLRDALALGRLITSQPSERHNVLGDSAGFVCSVAALMNRRQASFEIVIPNDLLANEQDTADSPAEDDAGTSADRNRWSFIVGVNNGAQTSEQSSIASSQLSAVSKMTILSVRRKLDEEYQRVGTSQSVTGRVQHLRLNPCKVFAQFRNTEQHPSEGRGSTDPWQIAKRELVKRFASDTPDLRSVEKLYKGDVNVLKRIFTWVDQLGFEGMPTDEIPFSESSEESQAVHFLVENDLLVRVGISKERLVARGRLEPWILPAIGTFNLDAITEQVINALYRNDAEEGEEKEEPPRKKIALQENVVDSEAFVVLPRRWLRLDGSINRPLLRWFCEGIFTRILTLPGVLETDLCNHYCSFLTSCQVKELLKFLTDVGCIERTVTVYRPKKFTLFGCSLGEPVECVSYMPTLDCVTKFATVFEGIPLPEGVNV
					

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(Predicted Aligned Error values between residue pairs)

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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	26.4	Very low	30.1	Very low	217 Å²	217	147.5 Å²	147.5	100%	1.069	83%	0.827	S	S	*	*				0	6.2	0	-68	-168.6	176.1	0	0	114.9	S3	M1-S3 PolarHBondContact N-OG 2.8Å; M1-S3 VanDerWaalsContact N-OG 3.12Å
2	L	27.6	Very low	31.3	Very low	158 Å²	158	144 Å²	144	83%	0.827	80%	0.802	S	S	*	*			trans	-122.4	38.8	155.5	-98.5	172.3	0	0	0	109
3	S	28.3	Very low	33.4	Very low	96 Å²	96	138.5 Å²	138.5	67%	0.671	77%	0.774	S	S	*	*	S	Bend	trans	-134.4	17	-161.6	53	0	0	0	0	111.8	M1	M1-S3 PolarHBondContact N-OG 2.8Å; M1-S3 VanDerWaalsContact N-OG 3.12Å
4	T	28.9	Very low	35.3	Very low	111 Å²	111	136.6 Å²	136.6	68%	0.681	78%	0.775	S	S	*	*	S	Bend	trans	-149.7	135.4	-171.2	45.1	0	0	0	0	108.8
5	V	30.7	Very low	37.4	Very low	141 Å²	141	138.4 Å²	138.4	86%	0.855	77%	0.771	S	S	*	*			trans	70.2	71.7	179.7	-161	0	0	0	0	115.5
6	V	29.5	Very low	39.4	Very low	137 Å²	137	132.1 Å²	132.1	83%	0.83	74%	0.735	S	S	*	*			trans	-124.3	128.5	137.7	179.4	0	0	0	0	106.2
7	P	30.7	Very low	41.5	Very low	114 Å²	114	127.4 Å²	127.4	74%	0.74	72%	0.718	S	S	*	*			trans	-72.5	160.6	-178.7	30	-34.9	0	0	0	112.2	N9	P7-N9 PolarHBondContact O-N 2.9Å
8	K	28.2	Very low	43.6	Very low	204 Å²	204	126.4 Å²	126.4	89%	0.887	71%	0.706	S	S	*	*	S	Bend	trans	-60.7	115.3	-179.3	-60	173.7	-179.3	178.1	0	111.2
9	N	30.9	Very low	45.5	Very low	155 Å²	155	121.3 Å²	121.3	83%	0.829	68%	0.676	S	S	*	*	S	Bend	trans	-175	129.7	142	-93.8	-16.3	0	0	0	109.8	P7	P7-N9 PolarHBondContact O-N 2.9Å
10	H	38.2	Very low	47.4	Very low	186 Å²	186	116.2 Å²	116.2	86%	0.861	65%	0.648	S	S	*	*			trans	50	118.3	-171.2	-67.3	-72	0	0	0	116.7	M12	H10-M12 PolarHBondContact O-N 2.98Å
11	A	32	Very low	49.2	Very low	103 Å²	103	113.4 Å²	113.4	85%	0.851	64%	0.64	S	S	*	*			trans	-71.6	97.5	171.8	0	0	0	0	0	110.6	T13	A11-T13 PolarHBondContact O-N 3.34Å
12	M	44	Very low	52.1	Low	106 Å²	106	103.8 Å²	103.8	52%	0.522	59%	0.593	S	S	.	*			trans	-53.3	132.6	168	-72.9	-175.6	73.3	0	0	109.7	H10 D16 V20	H10-M12 PolarHBondContact O-N 2.98Å; M12-D16 HydrophobicContact CB-CB 4.35Å; M12-D16 HydrophobicContact CE-CB 3.69Å; M12-V20 HydrophobicContact CE-CG2 3.93Å
13	T	58.8	Low	54.9	Low	72 Å²	72	96.3 Å²	96.3	44%	0.442	55%	0.554	S	S	.	*			trans	-70	160.3	175.7	76.6	0	0	0	0	110.2	A11 K15 D16 A17	A11-T13 PolarHBondContact O-N 3.34Å; T13-K15 PolarHBondContact O-N 3.14Å; T13-K15 VanDerWaalsContact O-N 3.1Å; T13-K15 PolarHBondContact OG1-N 2.88Å; T13-D16 WeakPolarHBondContact CA-OD2 3.41Å; T13-D16 VanDerWaalsContact CB-OD2 3.24Å; T13-D16 WeakPolarHBondContact CB-OD2 3.46Å; T13-D16 WeakPolarHBondContact CG2-OD2 3.38Å; T13-D16 PolarHBondContact N-OD2 2.83Å; T13-D16 PolarHBondContact O-N 3.34Å; T13-D16 PolarHBondContact OG1-N 3.1Å; T13-D16 PolarHBondContact OG1-OD1 2.9Å; T13-D16 PolarHBondContact OG1-OD2 2.76Å; T13-A17 PolarHBondContact O-N 3.04Å; T13-A17 VanDerWaalsContact O-N 3.15Å
14	S	60.1	Low	57.9	Low	112 Å²	112	92.3 Å²	92.3	78%	0.783	52%	0.524	S	S	*	.	H	α-helix	trans	-54.1	-30.3	173.7	177.7	0	0	0	0	112.7	H18	S14-H18 WeakPolarHBondContact O-CB 3.43Å; S14-H18 PolarHBondContact O-N 3.5Å
15	K	67	Low	60.8	Low	164 Å²	164	88.1 Å²	88.1	71%	0.713	50%	0.498	S	S	*	.	H	α-helix	trans	-69.8	-43.9	175.2	-66.6	-179.7	178.7	176.7	0	111.9	T13 H18 M19	T13-K15 PolarHBondContact O-N 3.14Å; T13-K15 VanDerWaalsContact O-N 3.1Å; T13-K15 PolarHBondContact OG1-N 2.88Å; K15-H18 WeakPolarHBondContact O-CB 3.41Å; K15-H18 PolarHBondContact O-N 3.4Å; K15-M19 WeakPolarHBondContact O-CG 3.08Å; K15-M19 PolarHBondContact O-N 2.85Å
16	D	69.7	Low	63.7	Low	37 Å²	37	81.6 Å²	81.6	20%	0.198	46%	0.458	C	S	.	.	H	α-helix	trans	-66.9	-43.9	-176.6	-47.7	-43	0	0	0	111.1	M12 T13 H18 M19 V20	M12-D16 HydrophobicContact CB-CB 4.35Å; M12-D16 HydrophobicContact CE-CB 3.69Å; T13-D16 WeakPolarHBondContact CA-OD2 3.41Å; T13-D16 VanDerWaalsContact CB-OD2 3.24Å; T13-D16 WeakPolarHBondContact CB-OD2 3.46Å; T13-D16 WeakPolarHBondContact CG2-OD2 3.38Å; T13-D16 PolarHBondContact N-OD2 2.83Å; T13-D16 PolarHBondContact O-N 3.34Å; T13-D16 PolarHBondContact OG1-N 3.1Å; T13-D16 PolarHBondContact OG1-OD1 2.9Å; T13-D16 PolarHBondContact OG1-OD2 2.76Å; D16-H18 PolarHBondContact O-N 2.82Å; D16-M19 HydrophobicContact CB-CE 4.41Å; D16-M19 PolarHBondContact O-N 2.86Å; D16-M19 VanDerWaalsContact OD1-CE 3.28Å; D16-M19 WeakPolarHBondContact OD1-CE 3.13Å; D16-V20 WeakPolarHBondContact O-CG2 3.45Å; D16-V20 PolarHBondContact O-N 2.99Å
17	A	74.8	Confident	66.7	Low	53 Å²	53	75.1 Å²	75.1	44%	0.438	42%	0.419	S	S	.	.	H	α-helix	trans	-58.9	-37.3	174.1	0	0	0	0	0	111.9	T13 A21	T13-A17 PolarHBondContact O-N 3.04Å; T13-A17 VanDerWaalsContact O-N 3.15Å; A17-A21 VanDerWaalsContact O-CB 3.29Å; A17-A21 WeakPolarHBondContact O-CB 3.39Å; A17-A21 PolarHBondContact O-N 3.26Å
18	H	79.1	Confident	69.7	Low	110 Å²	110	69.8 Å²	69.8	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-72.1	-40.6	175.7	-175	-104.7	0	0	0	112.8	S14 K15 D16 A21 I22	S14-H18 WeakPolarHBondContact O-CB 3.43Å; S14-H18 PolarHBondContact O-N 3.5Å; K15-H18 WeakPolarHBondContact O-CB 3.41Å; K15-H18 PolarHBondContact O-N 3.4Å; D16-H18 PolarHBondContact O-N 2.82Å; H18-A21 PolarHBondContact O-N 2.82Å; H18-I22 WeakPolarHBondContact O-CG1 3.38Å; H18-I22 PolarHBondContact O-N 3.49Å
19	M	80.5	Confident	72.7	Confident	29 Å²	29	60.1 Å²	60.1	14%	0.143	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-46.1	174.4	-72.6	-169	-65.7	0	0	111.6	K15 D16 I22 C23 F50 V52	K15-M19 WeakPolarHBondContact O-CG 3.08Å; K15-M19 PolarHBondContact O-N 2.85Å; D16-M19 HydrophobicContact CB-CE 4.41Å; D16-M19 PolarHBondContact O-N 2.86Å; D16-M19 VanDerWaalsContact OD1-CE 3.28Å; D16-M19 WeakPolarHBondContact OD1-CE 3.13Å; M19-I22 PolarHBondContact O-N 2.86Å; M19-C23 PolarHBondContact O-N 3.49Å; M19-F50 HydrophobicContact CB-CE2 4.08Å; M19-F50 HydrophobicContact CG-CE2 4.15Å; M19-V52 HydrophobicContact SD-CB 4.46Å; M19-V52 HydrophobicContact SD-CG2 3.73Å
20	V	83.4	Confident	75.6	Confident	19 Å²	19	53 Å²	53	12%	0.115	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-45.2	174.4	173.9	0	0	0	0	110.3	M12 D16 I22 C23 F24 L62 A65	M12-V20 HydrophobicContact CE-CG2 3.93Å; D16-V20 WeakPolarHBondContact O-CG2 3.45Å; D16-V20 PolarHBondContact O-N 2.99Å; V20-I22 VanDerWaalsContact C-N 3.32Å; V20-I22 PolarHBondContact O-N 3.45Å; V20-C23 WeakPolarHBondContact O-CA 3.33Å; V20-C23 WeakPolarHBondContact O-CB 3.17Å; V20-C23 PolarHBondContact O-N 3.32Å; V20-F24 HydrophobicContact CG1-CD2 3.73Å; V20-F24 HydrophobicContact CG1-CE2 3.84Å; V20-F24 VanDerWaalsContact O-CD2 3.32Å; V20-F24 WeakPolarHBondContact O-CD2 3.47Å; V20-F24 PolarHBondContact O-N 2.87Å; V20-L62 HydrophobicContact CG2-CD2 4.12Å; V20-A65 HydrophobicContact CG1-CB 4.48Å; V20-A65 HydrophobicContact CG2-CB 3.85Å
21	A	84.7	Confident	78.1	Confident	58 Å²	58	44.2 Å²	44.2	48%	0.479	26%	0.264	S	S	.	.	H	α-helix	trans	-59	-38.4	177	0	0	0	0	0	113.6	A17 H18 D25	A17-A21 VanDerWaalsContact O-CB 3.29Å; A17-A21 WeakPolarHBondContact O-CB 3.39Å; A17-A21 PolarHBondContact O-N 3.26Å; H18-A21 PolarHBondContact O-N 2.82Å; A21-D25 WeakPolarHBondContact O-CB 3.39Å; A21-D25 PolarHBondContact O-N 3.19Å; A21-D25 VanDerWaalsContact O-N 3.09Å
22	I	86.1	Confident	81	Confident	14 Å²	14	39.5 Å²	39.5	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-42.9	172.8	-68.8	169.1	0	0	0	111	H18 M19 V20 F24 D25 E26 L44 R47 F50	H18-I22 WeakPolarHBondContact O-CG1 3.38Å; H18-I22 PolarHBondContact O-N 3.49Å; M19-I22 PolarHBondContact O-N 2.86Å; V20-I22 VanDerWaalsContact C-N 3.32Å; V20-I22 PolarHBondContact O-N 3.45Å; I22-F24 PolarHBondContact O-N 3.31Å; I22-D25 WeakPolarHBondContact O-CB 3.4Å; I22-D25 PolarHBondContact O-N 3.02Å; I22-E26 PolarHBondContact O-N 2.76Å; I22-L44 HydrophobicContact CG2-CD2 3.76Å; I22-R47 HydrophobicContact CG2-CG 3.78Å; I22-F50 HydrophobicContact CB-CD2 4.3Å; I22-F50 HydrophobicContact CD1-CD2 4.24Å; I22-F50 HydrophobicContact CG2-CD2 3.97Å
23	C	88.4	Confident	83.2	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-60.8	-44.4	178.1	-168.8	0	0	0	0	112.1	M19 V20 D25 E26 V27 L44	M19-C23 PolarHBondContact O-N 3.49Å; V20-C23 WeakPolarHBondContact O-CA 3.33Å; V20-C23 WeakPolarHBondContact O-CB 3.17Å; V20-C23 PolarHBondContact O-N 3.32Å; C23-D25 VanDerWaalsContact C-N 3.32Å; C23-D25 PolarHBondContact O-N 3.07Å; C23-E26 PolarHBondContact O-N 3.3Å; C23-V27 WeakPolarHBondContact O-CG2 3.01Å; C23-V27 PolarHBondContact O-N 3.1Å; C23-V27 VanDerWaalsContact O-N 3.1Å; C23-L44 HydrophobicContact CB-CD1 4.43Å
24	F	89.8	Confident	84.7	Confident	12 Å²	12	31.2 Å²	31.2	5%	0.053	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-36.6	176.1	-88.3	-102.6	0	0	0	112.8	V20 I22 A28 I66 Q69 L72	V20-F24 HydrophobicContact CG1-CD2 3.73Å; V20-F24 HydrophobicContact CG1-CE2 3.84Å; V20-F24 VanDerWaalsContact O-CD2 3.32Å; V20-F24 WeakPolarHBondContact O-CD2 3.47Å; V20-F24 PolarHBondContact O-N 2.87Å; I22-F24 PolarHBondContact O-N 3.31Å; F24-A28 VanDerWaalsContact O-CB 3.28Å; F24-A28 WeakPolarHBondContact O-CB 3.49Å; F24-A28 PolarHBondContact O-N 3.34Å; F24-I66 HydrophobicContact CE2-CG1 4.17Å; F24-Q69 HydrophobicContact CE1-CB 3.68Å; F24-Q69 HydrophobicContact CE1-CG 4.03Å; F24-Q69 HydrophobicContact CE2-CG 4.19Å; F24-Q69 HydrophobicContact CZ-CB 3.38Å; F24-Q69 HydrophobicContact CZ-CG 3.43Å; F24-Q69 VanDerWaalsContact CZ-CG 3.43Å; F24-L72 HydrophobicContact CD1-CD1 4.42Å; F24-L72 HydrophobicContact CD1-CD2 4.33Å; F24-L72 HydrophobicContact CD1-CG 4.42Å; F24-L72 HydrophobicContact CE1-CD1 3.54Å; F24-L72 HydrophobicContact CE1-CD2 3.99Å; F24-L72 HydrophobicContact CE1-CG 3.61Å; F24-L72 HydrophobicContact CE2-CD1 4.37Å; F24-L72 HydrophobicContact CZ-CD1 3.47Å; F24-L72 VanDerWaalsContact CZ-CD1 3.47Å; F24-L72 HydrophobicContact CZ-CG 4.05Å
25	D	90	Very high	86.2	Confident	24 Å²	24	25.9 Å²	25.9	13%	0.128	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-41.6	174.6	-174.2	66.6	0	0	0	112.2	A21 I22 C23 A28 L29 R47 R247	A21-D25 WeakPolarHBondContact O-CB 3.39Å; A21-D25 PolarHBondContact O-N 3.19Å; A21-D25 VanDerWaalsContact O-N 3.09Å; I22-D25 WeakPolarHBondContact O-CB 3.4Å; I22-D25 PolarHBondContact O-N 3.02Å; C23-D25 VanDerWaalsContact C-N 3.32Å; C23-D25 PolarHBondContact O-N 3.07Å; D25-A28 PolarHBondContact O-N 3.44Å; D25-L29 WeakPolarHBondContact O-CB 3.07Å; D25-L29 WeakPolarHBondContact O-CD1 3.5Å; D25-L29 WeakPolarHBondContact O-CG 3.32Å; D25-L29 PolarHBondContact O-N 3.18Å; D25-L29 WeakPolarHBondContact OD2-CD1 3.32Å; D25-R47 IonicContact OD2-CZ 3.21Å; D25-R47 VanDerWaalsContact OD2-CZ 3.25Å; D25-R47 IonicContact OD2-NH1 2.86Å; D25-R47 PolarHBondContact OD2-NH1 3.39Å; D25-R47 IonicContact OD2-NH2 2.84Å; D25-R47 PolarHBondContact OD2-NH2 2.92Å; D25-R247 IonicContact OD1-CZ 3.29Å; D25-R247 IonicContact OD1-NH1 3.78Å; D25-R247 PolarHBondContact OD1-NH1 2.95Å; D25-R247 IonicContact OD1-NH2 3.72Å; D25-R247 PolarHBondContact OD1-NH2 2.9Å; D25-R247 IonicContact OD2-CZ 2.99Å; D25-R247 IonicContact OD2-NH1 2.69Å; D25-R247 PolarHBondContact OD2-NH1 3.19Å; D25-R247 IonicContact OD2-NH2 2.8Å; D25-R247 PolarHBondContact OD2-NH2 3.15Å
26	E	91.2	Very high	87.4	Confident	4 Å²	4	18.2 Å²	18.2	2%	0.019	11%	0.109	C	C	.	.	H	α-helix	trans	-65.2	-41.9	175.8	-80.3	-61.2	142.2	0	0	113.1	I22 C23 A28 L29 L40 L44 R47 R187	I22-E26 PolarHBondContact O-N 2.76Å; C23-E26 PolarHBondContact O-N 3.3Å; E26-A28 VanDerWaalsContact C-N 3.32Å; E26-A28 PolarHBondContact O-N 2.94Å; E26-L29 PolarHBondContact O-N 3.49Å; E26-L40 HydrophobicContact CB-CD1 4.05Å; E26-L44 HydrophobicContact CG-CD2 4.3Å; E26-R47 WeakPolarHBondContact OE1-CD 3.21Å; E26-R47 IonicContact OE1-CZ 3.2Å; E26-R47 IonicContact OE1-NE 3.11Å; E26-R47 IonicContact OE1-NH1 2.85Å; E26-R47 PolarHBondContact OE1-NH1 3.4Å; E26-R187 PolarHBondContact O-NH2 3.22Å; E26-R187 IonicContact OE1-NE 3.88Å; E26-R187 IonicContact OE2-CZ 2.71Å; E26-R187 IonicContact OE2-NE 3.26Å; E26-R187 PolarHBondContact OE2-NE 3.38Å; E26-R187 IonicContact OE2-NH2 2.64Å; E26-R187 PolarHBondContact OE2-NH2 2.85Å
27	V	92.8	Very high	88.4	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-60.3	-43.2	172.6	179.4	0	0	0	0	110.6	C23 L29 I35 L40 L72 V144 A146	C23-V27 WeakPolarHBondContact O-CG2 3.01Å; C23-V27 PolarHBondContact O-N 3.1Å; C23-V27 VanDerWaalsContact O-N 3.1Å; V27-L29 VanDerWaalsContact C-N 3.34Å; V27-L29 PolarHBondContact O-N 3.1Å; V27-I35 HydrophobicContact CB-CG2 4.31Å; V27-I35 HydrophobicContact CG1-CG2 4.2Å; V27-I35 HydrophobicContact CG2-CG2 3.91Å; V27-L40 HydrophobicContact CG2-CD1 3.93Å; V27-L40 HydrophobicContact CG2-CD2 4.14Å; V27-L72 HydrophobicContact CG1-CD2 3.85Å; V27-V144 HydrophobicContact CG1-CB 4.22Å; V27-V144 HydrophobicContact CG1-CG1 3.92Å; V27-A146 HydrophobicContact CG1-CB 4.27Å
28	A	93.3	Very high	89	Confident	1 Å²	1	17 Å²	17	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-67.4	-30.4	179.5	0	0	0	0	0	113.8	F24 D25 E26 E30 G31 A146 W150 R151 A154	F24-A28 VanDerWaalsContact O-CB 3.28Å; F24-A28 WeakPolarHBondContact O-CB 3.49Å; F24-A28 PolarHBondContact O-N 3.34Å; D25-A28 PolarHBondContact O-N 3.44Å; E26-A28 VanDerWaalsContact C-N 3.32Å; E26-A28 PolarHBondContact O-N 2.94Å; A28-E30 VanDerWaalsContact C-N 3.35Å; A28-E30 PolarHBondContact O-N 3.45Å; A28-G31 PolarHBondContact O-N 2.68Å; A28-A146 HydrophobicContact CB-CB 4.04Å; A28-W150 HydrophobicContact CB-CB 4.41Å; A28-R151 WeakPolarHBondContact O-CG 3.29Å; A28-A154 HydrophobicContact CB-CB 3.78Å
29	L	92.3	Very high	89.5	Confident	1 Å²	1	12.4 Å²	12.4	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-79.1	-9.5	-178.1	-71.7	162.9	0	0	0	114.4	D25 E26 V27 G31 A154 A184 R187 L245 F248	D25-L29 WeakPolarHBondContact O-CB 3.07Å; D25-L29 WeakPolarHBondContact O-CD1 3.5Å; D25-L29 WeakPolarHBondContact O-CG 3.32Å; D25-L29 PolarHBondContact O-N 3.18Å; D25-L29 WeakPolarHBondContact OD2-CD1 3.32Å; E26-L29 PolarHBondContact O-N 3.49Å; V27-L29 VanDerWaalsContact C-N 3.34Å; V27-L29 PolarHBondContact O-N 3.1Å; L29-G31 VanDerWaalsContact C-N 3.25Å; L29-A154 HydrophobicContact CD2-CB 3.73Å; L29-A154 HydrophobicContact CG-CB 3.84Å; L29-A184 HydrophobicContact CD2-CB 4.02Å; L29-R187 VanDerWaalsContact CB-NH1 3.27Å; L29-R187 HydrophobicContact CD1-CG 4.4Å; L29-R187 PolarHBondContact O-NH1 3.28Å; L29-L245 HydrophobicContact CD2-CD1 4Å; L29-F248 HydrophobicContact CD1-CE2 3.77Å; L29-F248 HydrophobicContact CD1-CZ 3.51Å; L29-F248 HydrophobicContact CD2-CE2 3.95Å; L29-F248 HydrophobicContact CD2-CZ 4.42Å
30	E	91.7	Very high	89.9	Confident	7 Å²	7	11 Å²	11	3%	0.033	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.6	170.8	-67.9	-65	-134.2	0	0	114.3	A28 I35 R43 R185 R187	A28-E30 VanDerWaalsContact C-N 3.35Å; A28-E30 PolarHBondContact O-N 3.45Å; E30-I35 HydrophobicContact CB-CB 4.35Å; E30-I35 HydrophobicContact CG-CB 3.76Å; E30-I35 HydrophobicContact CG-CD1 3.69Å; E30-I35 HydrophobicContact CG-CG1 3.76Å; E30-R43 VanDerWaalsContact CD-CZ 3.45Å; E30-R43 VanDerWaalsContact CD-NH1 3.25Å; E30-R43 IonicContact OE1-CZ 3.3Å; E30-R43 IonicContact OE1-NE 2.72Å; E30-R43 PolarHBondContact OE1-NE 2.78Å; E30-R43 IonicContact OE1-NH1 3.21Å; E30-R43 PolarHBondContact OE1-NH1 2.85Å; E30-R43 IonicContact OE1-NH2 2.76Å; E30-R43 PolarHBondContact OE1-NH2 3.13Å; E30-R43 VanDerWaalsContact OE1-NH2 3.14Å; E30-R43 IonicContact OE2-CZ 2.76Å; E30-R43 VanDerWaalsContact OE2-CZ 3.3Å; E30-R43 IonicContact OE2-NH1 2.8Å; E30-R43 PolarHBondContact OE2-NH1 3.23Å; E30-R43 IonicContact OE2-NH2 2.82Å; E30-R185 WeakPolarHBondContact O-CD 3.39Å; E30-R187 IonicContact OE2-CZ 3.84Å; E30-R187 IonicContact OE2-NH1 2.69Å; E30-R187 PolarHBondContact OE2-NH1 3.04Å; E30-R187 VanDerWaalsContact OE2-NH1 3.13Å; E30-R187 IonicContact OE2-NH2 3.15Å
31	G	91	Very high	90.2	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.01	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	72.4	-155.7	178.4	0	0	0	0	0	112.7	A28 L29 E33 G34 R151 E181	A28-G31 PolarHBondContact O-N 2.68Å; L29-G31 VanDerWaalsContact C-N 3.25Å; G31-E33 PolarHBondContact O-N 3.05Å; G31-G34 PolarHBondContact O-N 2.69Å; G31-G34 VanDerWaalsContact O-N 3.15Å; G31-R151 VanDerWaalsContact O-CD 3.31Å; G31-R151 WeakPolarHBondContact O-CD 3.32Å; G31-E181 WeakPolarHBondContact CA-OE1 3.31Å
32	L	92.3	Very high	90.4	Very high	4 Å²	4	8.7 Å²	8.7	2%	0.021	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-69.5	-17.5	-174.4	-171.8	57.6	0	0	0	114.2	G34 V99 I105 C109 F112 R115 E181	L32-G34 VanDerWaalsContact C-N 3.27Å; L32-G34 PolarHBondContact O-N 2.72Å; L32-V99 HydrophobicContact CD2-CB 4.05Å; L32-V99 HydrophobicContact CD2-CG2 3.62Å; L32-I105 HydrophobicContact CD1-CG2 3.84Å; L32-I105 HydrophobicContact CD2-CG2 3.63Å; L32-I105 HydrophobicContact CG-CG2 4.42Å; L32-C109 HydrophobicContact CB-CB 4.39Å; L32-C109 HydrophobicContact CD2-CB 4.45Å; L32-C109 HydrophobicContact CG-CB 4.01Å; L32-F112 HydrophobicContact CD1-CD2 4.23Å; L32-F112 HydrophobicContact CD1-CE2 4.11Å; L32-F112 HydrophobicContact CD2-CD2 4.03Å; L32-F112 HydrophobicContact CD2-CE2 4.24Å; L32-F112 HydrophobicContact CG-CD2 4.16Å; L32-F112 HydrophobicContact CG-CE2 4.46Å; L32-R115 PolarHBondContact O-NH1 3.16Å; L32-E181 PolarHBondContact N-OE1 3.47Å; L32-E181 PolarHBondContact N-OE2 2.97Å
33	E	90	Very high	90.4	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.005	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-62.4	-33.2	169.9	-64.7	-62	177.9	0	0	112.7	G31 R81 F94 S108 C109 V143 R185	G31-E33 PolarHBondContact O-N 3.05Å; E33-R81 PolarHBondContact O-NH1 2.99Å; E33-R81 PolarHBondContact O-NH2 3.37Å; E33-R81 IonicContact OE2-CZ 3.89Å; E33-R81 IonicContact OE2-NH2 3.57Å; E33-R81 PolarHBondContact OE2-NH2 3.28Å; E33-F94 HydrophobicContact CG-CD1 4.07Å; E33-F94 HydrophobicContact CG-CD2 4.47Å; E33-F94 HydrophobicContact CG-CE1 4.41Å; E33-F94 HydrophobicContact CG-CG 4.12Å; E33-S108 PolarHBondContact N-O 3.43Å; E33-C109 WeakPolarHBondContact OE1-CA 3.48Å; E33-C109 WeakPolarHBondContact OE2-CA 3.4Å; E33-C109 PolarHBondContact OE2-SG 2.86Å; E33-V143 WeakPolarHBondContact O-CG1 3.47Å; E33-R185 IonicContact OE1-NH1 2.77Å
34	G	90.8	Very high	90.4	Very high	2 Å²	2	8.9 Å²	8.9	2%	0.021	5%	0.047	C	C	.	.			trans	67.6	174.7	-167.9	0	0	0	0	0	114.9	G31 L32 R81 V144	G31-G34 PolarHBondContact O-N 2.69Å; G31-G34 VanDerWaalsContact O-N 3.15Å; L32-G34 VanDerWaalsContact C-N 3.27Å; L32-G34 PolarHBondContact O-N 2.72Å; G34-R81 PolarHBondContact O-NH1 3.02Å; G34-V144 CarbonylContact C-O 3.58Å; G34-V144 WeakPolarHBondContact CA-O 3.4Å
35	I	91.8	Very high	90	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	142.5	-176.8	-154.3	162.4	0	0	0	110.7	V27 E30 L40 V143 V144	V27-I35 HydrophobicContact CB-CG2 4.31Å; V27-I35 HydrophobicContact CG1-CG2 4.2Å; V27-I35 HydrophobicContact CG2-CG2 3.91Å; E30-I35 HydrophobicContact CB-CB 4.35Å; E30-I35 HydrophobicContact CG-CB 3.76Å; E30-I35 HydrophobicContact CG-CD1 3.69Å; E30-I35 HydrophobicContact CG-CG1 3.76Å; I35-L40 HydrophobicContact CD1-CB 3.89Å; I35-L40 HydrophobicContact CD1-CD1 4.07Å; I35-L40 HydrophobicContact CG1-CB 4.13Å; I35-L40 HydrophobicContact CG2-CB 4.1Å; I35-V143 WeakPolarHBondContact O-CA 3.46Å; I35-V144 HydrophobicContact CG2-CB 4.27Å; I35-V144 PolarHBondContact N-O 2.86Å; I35-V144 PolarHBondContact O-N 3.45Å
36	T	92	Very high	89.3	Confident	2 Å²	2	12.8 Å²	12.8	1%	0.012	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	159.7	165.5	69.3	0	0	0	0	110.7	N38 S39 L40 R81 D140 L142 V143	T36-N38 VanDerWaalsContact C-N 3.33Å; T36-N38 PolarHBondContact O-N 2.96Å; T36-S39 PolarHBondContact O-N 2.79Å; T36-S39 WeakPolarHBondContact OG1-CB 3.39Å; T36-S39 PolarHBondContact OG1-N 3.01Å; T36-S39 PolarHBondContact OG1-OG 2.87Å; T36-L40 WeakPolarHBondContact O-CB 3.44Å; T36-L40 PolarHBondContact O-N 3.41Å; T36-R81 HydrophobicContact CG2-CB 4.08Å; T36-D140 WeakPolarHBondContact CB-OD1 3.48Å; T36-D140 WeakPolarHBondContact CG2-OD1 2.98Å; T36-D140 PolarHBondContact OG1-OD1 3.17Å; T36-L142 WeakPolarHBondContact CA-O 3.42Å; T36-V143 HydrophobicContact CG2-CG2 4.19Å
37	L	89.8	Confident	88.7	Confident	7 Å²	7	14.2 Å²	14.2	4%	0.037	8%	0.075	C	C	.	.	H	α-helix	trans	-58.2	-45.5	178.9	-67.5	174.3	0	0	0	111.6	S39 L40 W41 W63 Y131 V134 V135 L142 V144	L37-S39 PolarHBondContact O-N 3.44Å; L37-L40 WeakPolarHBondContact O-CB 3.25Å; L37-L40 PolarHBondContact O-N 2.99Å; L37-W41 HydrophobicContact CD2-CZ2 4.4Å; L37-W41 VanDerWaalsContact O-CG 3.26Å; L37-W41 PolarHBondContact O-N 2.83Å; L37-W41 VanDerWaalsContact O-N 3.09Å; L37-W41 PolarHBondContact O-NE1 3.4Å; L37-W63 HydrophobicContact CD2-CE3 4.13Å; L37-W63 HydrophobicContact CD2-CZ3 4.03Å; L37-Y131 HydrophobicContact CD1-CE2 4Å; L37-V134 HydrophobicContact CD1-CG1 4.01Å; L37-V135 HydrophobicContact CD1-CG2 4.5Å; L37-L142 HydrophobicContact CD1-CD2 4.03Å; L37-V144 HydrophobicContact CD2-CG2 4.48Å
38	N	89	Confident	87.6	Confident	58 Å²	58	16.5 Å²	16.5	31%	0.31	9%	0.09	S	C	.	.	H	α-helix	trans	-55.3	-49.4	174.2	-170.2	9.1	0	0	0	111.9	T36 L40 W41 V42 A83 D140	T36-N38 VanDerWaalsContact C-N 3.33Å; T36-N38 PolarHBondContact O-N 2.96Å; N38-L40 VanDerWaalsContact C-N 3.33Å; N38-L40 PolarHBondContact O-N 3.47Å; N38-W41 PolarHBondContact O-N 3.08Å; N38-V42 WeakPolarHBondContact O-CG2 3.46Å; N38-V42 PolarHBondContact O-N 3.37Å; N38-V42 VanDerWaalsContact O-N 3.07Å; N38-A83 VanDerWaalsContact ND2-CB 3.29Å; N38-A83 WeakPolarHBondContact ND2-CB 3.28Å; N38-D140 VanDerWaalsContact CB-OD1 3.29Å; N38-D140 WeakPolarHBondContact CB-OD1 3.32Å; N38-D140 WeakPolarHBondContact CB-OD2 3.15Å; N38-D140 PolarHBondContact ND2-OD2 3.37Å
39	S	88.8	Confident	86.4	Confident	13 Å²	13	18.3 Å²	18.3	9%	0.091	11%	0.11	C	C	.	.	H	α-helix	trans	-62.2	-38	178.8	-58.8	0	0	0	0	112.8	T36 L37 V42 R43 L84	T36-S39 PolarHBondContact O-N 2.79Å; T36-S39 WeakPolarHBondContact OG1-CB 3.39Å; T36-S39 PolarHBondContact OG1-N 3.01Å; T36-S39 PolarHBondContact OG1-OG 2.87Å; L37-S39 PolarHBondContact O-N 3.44Å; S39-V42 PolarHBondContact O-N 3.18Å; S39-R43 WeakPolarHBondContact O-CG 3.35Å; S39-R43 PolarHBondContact O-N 3.13Å; S39-L84 WeakPolarHBondContact OG-CB 3.46Å
40	L	89.8	Confident	85.6	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-48.3	177.1	177.5	60.8	0	0	0	111.5	E26 V27 I35 T36 L37 N38 V42 R43 L44 I66	E26-L40 HydrophobicContact CB-CD1 4.05Å; V27-L40 HydrophobicContact CG2-CD1 3.93Å; V27-L40 HydrophobicContact CG2-CD2 4.14Å; I35-L40 HydrophobicContact CD1-CB 3.89Å; I35-L40 HydrophobicContact CD1-CD1 4.07Å; I35-L40 HydrophobicContact CG1-CB 4.13Å; I35-L40 HydrophobicContact CG2-CB 4.1Å; T36-L40 WeakPolarHBondContact O-CB 3.44Å; T36-L40 PolarHBondContact O-N 3.41Å; L37-L40 WeakPolarHBondContact O-CB 3.25Å; L37-L40 PolarHBondContact O-N 2.99Å; N38-L40 VanDerWaalsContact C-N 3.33Å; N38-L40 PolarHBondContact O-N 3.47Å; L40-V42 VanDerWaalsContact C-N 3.32Å; L40-V42 PolarHBondContact O-N 3.35Å; L40-R43 PolarHBondContact O-N 3.47Å; L40-L44 HydrophobicContact CD1-CD1 4.04Å; L40-L44 HydrophobicContact CD1-CG 4.25Å; L40-L44 HydrophobicContact CG-CD1 4.07Å; L40-L44 WeakPolarHBondContact O-CB 3.39Å; L40-L44 WeakPolarHBondContact O-CG 3.23Å; L40-L44 PolarHBondContact O-N 2.75Å; L40-I66 HydrophobicContact CD2-CD1 4.07Å
41	W	89.5	Confident	84.4	Confident	10 Å²	10	25.1 Å²	25.1	4%	0.038	14%	0.141	C	C	.	.	H	α-helix	trans	-62.1	-40.1	177.4	-52.1	137.5	0	0	0	111.9	L37 N38 L44 L45 K59 L62 I66 Y131	L37-W41 HydrophobicContact CD2-CZ2 4.4Å; L37-W41 VanDerWaalsContact O-CG 3.26Å; L37-W41 PolarHBondContact O-N 2.83Å; L37-W41 VanDerWaalsContact O-N 3.09Å; L37-W41 PolarHBondContact O-NE1 3.4Å; N38-W41 PolarHBondContact O-N 3.08Å; W41-L44 HydrophobicContact CE3-CD1 3.87Å; W41-L44 HydrophobicContact CZ3-CD1 3.95Å; W41-L45 WeakPolarHBondContact O-CB 3.44Å; W41-L45 VanDerWaalsContact O-CG 3.22Å; W41-L45 WeakPolarHBondContact O-CG 3.32Å; W41-L45 PolarHBondContact O-N 3.38Å; W41-K59 HydrophobicContact CD2-CD 4.46Å; W41-K59 HydrophobicContact CD2-CG 3.95Å; W41-K59 HydrophobicContact CE3-CG 4.34Å; W41-K59 HydrophobicContact CG-CD 4.46Å; W41-K59 HydrophobicContact CG-CG 4.42Å; W41-K59 HydrophobicContact CH2-CG 4.39Å; W41-K59 HydrophobicContact CZ2-CB 4.17Å; W41-K59 HydrophobicContact CZ2-CG 3.96Å; W41-L62 HydrophobicContact CH2-CB 4.02Å; W41-L62 HydrophobicContact CH2-CD1 4.5Å; W41-L62 HydrophobicContact CZ3-CB 4.14Å; W41-L62 HydrophobicContact CZ3-CD1 3.81Å; W41-I66 HydrophobicContact CH2-CD1 4.39Å; W41-Y131 AromaticContact CE2-CE2 3.98Å; W41-Y131 HydrophobicContact CZ2-CD2 4.34Å; W41-Y131 AromaticContact CZ2-CE2 3.67Å; W41-Y131 HydrophobicContact CZ2-CE2 3.67Å; W41-Y131 AromaticContact NE1-CE2 3.66Å; W41-Y131 AromaticContact NE1-CZ 3.54Å; W41-Y131 PolarHBondContact NE1-OH 3.44Å
42	V	87.5	Confident	83.3	Confident	17 Å²	17	28.3 Å²	28.3	10%	0.103	16%	0.16	C	C	.	.	H	α-helix	trans	-68.7	-35.3	178.2	170.8	0	0	0	0	112.5	N38 S39 L40 T46 L84 K86 I89	N38-V42 WeakPolarHBondContact O-CG2 3.46Å; N38-V42 PolarHBondContact O-N 3.37Å; N38-V42 VanDerWaalsContact O-N 3.07Å; S39-V42 PolarHBondContact O-N 3.18Å; L40-V42 VanDerWaalsContact C-N 3.32Å; L40-V42 PolarHBondContact O-N 3.35Å; V42-T46 PolarHBondContact O-OG1 2.78Å; V42-L84 HydrophobicContact CG1-CD2 4.45Å; V42-L84 HydrophobicContact CG1-CG 4.37Å; V42-L84 WeakPolarHBondContact CG2-O 3.29Å; V42-K86 HydrophobicContact CG1-CG 4.06Å; V42-I89 HydrophobicContact CG1-CD1 4.4Å
43	R	87.2	Confident	82.2	Confident	19 Å²	19	35.2 Å²	35.2	7%	0.072	19%	0.192	C	C	.	.	H	α-helix	trans	-73	-41.7	174.1	-68.5	-164.3	-176.1	-156.8	-0.7	112.6	E30 S39 L40 L45 T46 R47 L84 I89 R185	E30-R43 VanDerWaalsContact CD-CZ 3.45Å; E30-R43 VanDerWaalsContact CD-NH1 3.25Å; E30-R43 IonicContact OE1-CZ 3.3Å; E30-R43 IonicContact OE1-NE 2.72Å; E30-R43 PolarHBondContact OE1-NE 2.78Å; E30-R43 IonicContact OE1-NH1 3.21Å; E30-R43 PolarHBondContact OE1-NH1 2.85Å; E30-R43 IonicContact OE1-NH2 2.76Å; E30-R43 PolarHBondContact OE1-NH2 3.13Å; E30-R43 VanDerWaalsContact OE1-NH2 3.14Å; E30-R43 IonicContact OE2-CZ 2.76Å; E30-R43 VanDerWaalsContact OE2-CZ 3.3Å; E30-R43 IonicContact OE2-NH1 2.8Å; E30-R43 PolarHBondContact OE2-NH1 3.23Å; E30-R43 IonicContact OE2-NH2 2.82Å; S39-R43 WeakPolarHBondContact O-CG 3.35Å; S39-R43 PolarHBondContact O-N 3.13Å; L40-R43 PolarHBondContact O-N 3.47Å; R43-L45 VanDerWaalsContact C-N 3.33Å; R43-L45 PolarHBondContact O-N 2.89Å; R43-T46 CarbonylContact O-C 3.52Å; R43-T46 PolarHBondContact O-N 3.45Å; R43-T46 PolarHBondContact O-OG1 3.07Å; R43-R47 PolarHBondContact O-N 2.99Å; R43-R47 VanDerWaalsContact O-N 3.13Å; R43-L84 HydrophobicContact CG-CD2 3.93Å; R43-I89 HydrophobicContact CG-CD1 4.25Å; R43-R185 PolarHBondContact NH1-O 2.84Å
44	L	87	Confident	80.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.4	-44.6	173.4	-73.8	171.6	0	0	0	112	I22 C23 E26 L40 W41 T46 R47 F50 L62	I22-L44 HydrophobicContact CG2-CD2 3.76Å; C23-L44 HydrophobicContact CB-CD1 4.43Å; E26-L44 HydrophobicContact CG-CD2 4.3Å; L40-L44 HydrophobicContact CD1-CD1 4.04Å; L40-L44 HydrophobicContact CD1-CG 4.25Å; L40-L44 HydrophobicContact CG-CD1 4.07Å; L40-L44 WeakPolarHBondContact O-CB 3.39Å; L40-L44 WeakPolarHBondContact O-CG 3.23Å; L40-L44 PolarHBondContact O-N 2.75Å; W41-L44 HydrophobicContact CE3-CD1 3.87Å; W41-L44 HydrophobicContact CZ3-CD1 3.95Å; L44-T46 PolarHBondContact O-N 3Å; L44-R47 PolarHBondContact O-N 3.16Å; L44-R47 VanDerWaalsContact O-N 3.12Å; L44-F50 HydrophobicContact CB-CD1 4.14Å; L44-F50 HydrophobicContact CB-CE1 4.13Å; L44-F50 HydrophobicContact CB-CZ 4.49Å; L44-F50 HydrophobicContact CD1-CZ 4.43Å; L44-F50 HydrophobicContact CD2-CD2 3.9Å; L44-F50 HydrophobicContact CD2-CE2 3.97Å; L44-F50 HydrophobicContact CD2-CG 4.21Å; L44-F50 HydrophobicContact CD2-CZ 4.36Å; L44-L62 HydrophobicContact CD1-CD1 4.43Å
45	L	81.8	Confident	80	Confident	58 Å²	58	39.9 Å²	39.9	30%	0.304	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	2.5	174.1	-73	171	0	0	0	115.4	W41 R43	W41-L45 WeakPolarHBondContact O-CB 3.44Å; W41-L45 VanDerWaalsContact O-CG 3.22Å; W41-L45 WeakPolarHBondContact O-CG 3.32Å; W41-L45 PolarHBondContact O-N 3.38Å; R43-L45 VanDerWaalsContact C-N 3.33Å; R43-L45 PolarHBondContact O-N 2.89Å
46	T	76.3	Confident	79.4	Confident	61 Å²	61	42.4 Å²	42.4	37%	0.374	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.2	1.6	175.4	61.4	0	0	0	0	113.5	V42 R43 L44 P48 I89	V42-T46 PolarHBondContact O-OG1 2.78Å; R43-T46 CarbonylContact O-C 3.52Å; R43-T46 PolarHBondContact O-N 3.45Å; R43-T46 PolarHBondContact O-OG1 3.07Å; L44-T46 PolarHBondContact O-N 3Å; T46-P48 WeakPolarHBondContact O-CD 3.35Å; T46-I89 HydrophobicContact CG2-CD1 3.8Å; T46-I89 WeakPolarHBondContact OG1-CD1 3.39Å
47	R	77.3	Confident	78.8	Confident	33 Å²	33	46.7 Å²	46.7	13%	0.125	28%	0.275	C	S	.	.	S	Bend	trans	-82.9	120.8	-175.2	-179.5	62.9	-177.8	-114.5	-11.5	110.6	I22 D25 E26 R43 L44 G49 F50	I22-R47 HydrophobicContact CG2-CG 3.78Å; D25-R47 IonicContact OD2-CZ 3.21Å; D25-R47 VanDerWaalsContact OD2-CZ 3.25Å; D25-R47 IonicContact OD2-NH1 2.86Å; D25-R47 PolarHBondContact OD2-NH1 3.39Å; D25-R47 IonicContact OD2-NH2 2.84Å; D25-R47 PolarHBondContact OD2-NH2 2.92Å; E26-R47 WeakPolarHBondContact OE1-CD 3.21Å; E26-R47 IonicContact OE1-CZ 3.2Å; E26-R47 IonicContact OE1-NE 3.11Å; E26-R47 IonicContact OE1-NH1 2.85Å; E26-R47 PolarHBondContact OE1-NH1 3.4Å; R43-R47 PolarHBondContact O-N 2.99Å; R43-R47 VanDerWaalsContact O-N 3.13Å; L44-R47 PolarHBondContact O-N 3.16Å; L44-R47 VanDerWaalsContact O-N 3.12Å; R47-G49 PolarHBondContact O-N 2.92Å; R47-F50 HydrophobicContact CB-CB 4.18Å; R47-F50 HydrophobicContact CG-CB 4.49Å; R47-F50 PolarHBondContact O-N 3.45Å
48	P	70	Confident	78.5	Confident	49 Å²	49	47.3 Å²	47.3	32%	0.318	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	128.1	175.2	-24.7	35.1	0	0	0	111.3	T46 M253	T46-P48 WeakPolarHBondContact O-CD 3.35Å; P48-M253 HydrophobicContact CG-CE 3.75Å; P48-M253 HydrophobicContact CG-CG 4.09Å
49	G	69.4	Low	78.4	Confident	40 Å²	40	47.1 Å²	47.1	41%	0.412	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	92	-3.5	-176.2	0	0	0	0	0	115.3	R47	R47-G49 PolarHBondContact O-N 2.92Å
50	F	75.4	Confident	78.4	Confident	18 Å²	18	48.8 Å²	48.8	8%	0.079	28%	0.281	C	S	.	.			trans	-102.8	95.8	168.3	-161.2	-86.3	0	0	0	109	M19 I22 L44 R47 V52 L58 L62	M19-F50 HydrophobicContact CB-CE2 4.08Å; M19-F50 HydrophobicContact CG-CE2 4.15Å; I22-F50 HydrophobicContact CB-CD2 4.3Å; I22-F50 HydrophobicContact CD1-CD2 4.24Å; I22-F50 HydrophobicContact CG2-CD2 3.97Å; L44-F50 HydrophobicContact CB-CD1 4.14Å; L44-F50 HydrophobicContact CB-CE1 4.13Å; L44-F50 HydrophobicContact CB-CZ 4.49Å; L44-F50 HydrophobicContact CD1-CZ 4.43Å; L44-F50 HydrophobicContact CD2-CD2 3.9Å; L44-F50 HydrophobicContact CD2-CE2 3.97Å; L44-F50 HydrophobicContact CD2-CG 4.21Å; L44-F50 HydrophobicContact CD2-CZ 4.36Å; R47-F50 HydrophobicContact CB-CB 4.18Å; R47-F50 HydrophobicContact CG-CB 4.49Å; R47-F50 PolarHBondContact O-N 3.45Å; F50-V52 WeakPolarHBondContact CE1-O 3.49Å; F50-L58 HydrophobicContact CE1-CD2 4.35Å; F50-L58 HydrophobicContact CZ-CD2 4.15Å; F50-L62 HydrophobicContact CZ-CD1 4.26Å
51	E	65.5	Low	78.2	Confident	133 Å²	133	52.8 Å²	52.8	62%	0.621	30%	0.299	S	S	*	.			trans	-99.3	-3.5	-170.2	-61.5	-174	174.5	0	0	114	R254	E51-R254 IonicContact OE1-CZ 2.73Å; E51-R254 IonicContact OE1-NH1 3.68Å; E51-R254 PolarHBondContact OE1-NH1 3.5Å; E51-R254 IonicContact OE1-NH2 2.89Å; E51-R254 PolarHBondContact OE1-NH2 2.85Å
52	V	69	Low	78.1	Confident	68 Å²	68	52.4 Å²	52.4	41%	0.412	30%	0.298	S	S	.	.	S	Bend	trans	-90.9	136.2	-177.3	-163.5	0	0	0	0	110.4	M19 F50 L58	M19-V52 HydrophobicContact SD-CB 4.46Å; M19-V52 HydrophobicContact SD-CG2 3.73Å; F50-V52 WeakPolarHBondContact CE1-O 3.49Å; V52-L58 HydrophobicContact CB-CD2 3.97Å; V52-L58 HydrophobicContact CG1-CD2 3.7Å
53	H	67.4	Low	78.3	Confident	148 Å²	148	51.6 Å²	51.6	69%	0.685	29%	0.293	S	S	*	.			trans	-70.8	132	171.4	-91.1	-107.1	0	0	0	110.6	D55 L58	H53-D55 VanDerWaalsContact C-N 3.25Å; H53-D55 PolarHBondContact O-N 3.34Å; H53-L58 WeakPolarHBondContact O-CD2 3.37Å
54	A	63.6	Low	78.3	Confident	14 Å²	14	53 Å²	53	12%	0.116	31%	0.306	C	S	.	.			trans	-77.9	73.8	174.2	0	0	0	0	0	111.3	K59	A54-K59 HydrophobicContact CB-CG 4.41Å; A54-K59 WeakPolarHBondContact O-CE 3.48Å
55	D	72.7	Confident	78.3	Confident	87 Å²	87	54 Å²	54	47%	0.465	31%	0.314	S	S	.	.			trans	-70.2	-179.4	167.1	63	22.1	0	0	0	111.9	H53 S57 L58 K59	H53-D55 VanDerWaalsContact C-N 3.25Å; H53-D55 PolarHBondContact O-N 3.34Å; D55-S57 VanDerWaalsContact C-N 3.33Å; D55-S57 PolarHBondContact O-N 2.93Å; D55-S57 PolarHBondContact OD1-N 2.92Å; D55-L58 VanDerWaalsContact OD1-CB 3.32Å; D55-L58 WeakPolarHBondContact OD1-CB 3.18Å; D55-L58 PolarHBondContact OD1-N 3.07Å; D55-K59 WeakPolarHBondContact O-CB 3.42Å; D55-K59 WeakPolarHBondContact O-CG 3.47Å; D55-K59 PolarHBondContact O-N 3.27Å; D55-K59 VanDerWaalsContact O-N 3.07Å
56	G	77.6	Confident	78.6	Confident	54 Å²	54	51.3 Å²	51.3	56%	0.557	30%	0.3	S	S	*	.	H	α-helix	trans	-61.8	-40.9	179.9	0	0	0	0	0	112.7	K59 Q60	G56-K59 PolarHBondContact O-N 3.03Å; G56-Q60 WeakPolarHBondContact O-CB 3.39Å; G56-Q60 PolarHBondContact O-N 3.01Å
57	S	79.4	Confident	79.2	Confident	93 Å²	93	49.5 Å²	49.5	65%	0.65	29%	0.287	S	S	*	.	H	α-helix	trans	-68	-43.5	-178	-57.4	0	0	0	0	112.5	D55 Q60 H61	D55-S57 VanDerWaalsContact C-N 3.33Å; D55-S57 PolarHBondContact O-N 2.93Å; D55-S57 PolarHBondContact OD1-N 2.92Å; S57-Q60 PolarHBondContact O-N 3.37Å; S57-H61 WeakPolarHBondContact O-CB 3.47Å; S57-H61 PolarHBondContact O-N 3.47Å
58	L	83.1	Confident	79.8	Confident	19 Å²	19	51.7 Å²	51.7	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-69.1	-35.4	175.2	-171.2	67.5	0	0	0	111.5	F50 V52 H53 D55 H61 L62	F50-L58 HydrophobicContact CE1-CD2 4.35Å; F50-L58 HydrophobicContact CZ-CD2 4.15Å; V52-L58 HydrophobicContact CB-CD2 3.97Å; V52-L58 HydrophobicContact CG1-CD2 3.7Å; H53-L58 WeakPolarHBondContact O-CD2 3.37Å; D55-L58 VanDerWaalsContact OD1-CB 3.32Å; D55-L58 WeakPolarHBondContact OD1-CB 3.18Å; D55-L58 PolarHBondContact OD1-N 3.07Å; L58-H61 PolarHBondContact O-N 3.17Å; L58-L62 HydrophobicContact CD1-CD1 4.37Å; L58-L62 HydrophobicContact CD1-CG 4.29Å; L58-L62 HydrophobicContact CD2-CD1 4.37Å; L58-L62 HydrophobicContact CG-CD1 3.93Å; L58-L62 HydrophobicContact CG-CG 4.25Å; L58-L62 VanDerWaalsContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CB 3.24Å; L58-L62 VanDerWaalsContact O-CG 3.28Å; L58-L62 WeakPolarHBondContact O-CG 3.24Å; L58-L62 PolarHBondContact O-N 2.96Å
59	K	88	Confident	80.6	Confident	55 Å²	55	53.3 Å²	53.3	24%	0.239	31%	0.308	C	S	.	.	H	α-helix	trans	-62.8	-44.3	172.3	-75	171.7	-179.1	166.2	0	111.7	W41 A54 D55 G56 W63 Y131	W41-K59 HydrophobicContact CD2-CD 4.46Å; W41-K59 HydrophobicContact CD2-CG 3.95Å; W41-K59 HydrophobicContact CE3-CG 4.34Å; W41-K59 HydrophobicContact CG-CD 4.46Å; W41-K59 HydrophobicContact CG-CG 4.42Å; W41-K59 HydrophobicContact CH2-CG 4.39Å; W41-K59 HydrophobicContact CZ2-CB 4.17Å; W41-K59 HydrophobicContact CZ2-CG 3.96Å; A54-K59 HydrophobicContact CB-CG 4.41Å; A54-K59 WeakPolarHBondContact O-CE 3.48Å; D55-K59 WeakPolarHBondContact O-CB 3.42Å; D55-K59 WeakPolarHBondContact O-CG 3.47Å; D55-K59 PolarHBondContact O-N 3.27Å; D55-K59 VanDerWaalsContact O-N 3.07Å; G56-K59 PolarHBondContact O-N 3.03Å; K59-W63 WeakPolarHBondContact O-CB 3.37Å; K59-W63 PolarHBondContact O-N 2.99Å; K59-Y131 HydrophobicContact CB-CD1 4.25Å; K59-Y131 HydrophobicContact CB-CD2 4.45Å; K59-Y131 HydrophobicContact CB-CE1 4.26Å; K59-Y131 HydrophobicContact CB-CE2 4.42Å; K59-Y131 HydrophobicContact CB-CG 4.38Å; K59-Y131 HydrophobicContact CD-CE1 4.06Å
60	Q	88.9	Confident	81.6	Confident	48 Å²	48	60.4 Å²	60.4	22%	0.224	33%	0.328	C	S	.	.	H	α-helix	trans	-62	-48.1	174	-179.6	58.9	51	0	0	111.3	G56 S57 L62 W63 S64 E129	G56-Q60 WeakPolarHBondContact O-CB 3.39Å; G56-Q60 PolarHBondContact O-N 3.01Å; S57-Q60 PolarHBondContact O-N 3.37Å; Q60-L62 PolarHBondContact O-N 3.25Å; Q60-W63 WeakPolarHBondContact O-CB 3.33Å; Q60-W63 PolarHBondContact O-N 3.35Å; Q60-S64 PolarHBondContact NE2-OG 2.95Å; Q60-S64 PolarHBondContact O-N 2.75Å; Q60-S64 PolarHBondContact O-OG 3.46Å; Q60-E129 PolarHBondContact NE2-O 3.43Å
61	H	85.7	Confident	82.2	Confident	85 Å²	85	63 Å²	63	39%	0.394	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-46.8	178.7	179.3	84.9	0	0	0	112.3	S57 L58 W63 S64 A65	S57-H61 WeakPolarHBondContact O-CB 3.47Å; S57-H61 PolarHBondContact O-N 3.47Å; L58-H61 PolarHBondContact O-N 3.17Å; H61-W63 VanDerWaalsContact C-N 3.34Å; H61-W63 PolarHBondContact O-N 3.34Å; H61-S64 PolarHBondContact O-N 3.02Å; H61-A65 PolarHBondContact O-N 3.41Å
62	L	87.6	Confident	83.5	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-66.6	-35	175.4	-69.4	174.3	0	0	0	111.5	V20 W41 L44 F50 L58 Q60 A65 I66	V20-L62 HydrophobicContact CG2-CD2 4.12Å; W41-L62 HydrophobicContact CH2-CB 4.02Å; W41-L62 HydrophobicContact CH2-CD1 4.5Å; W41-L62 HydrophobicContact CZ3-CB 4.14Å; W41-L62 HydrophobicContact CZ3-CD1 3.81Å; L44-L62 HydrophobicContact CD1-CD1 4.43Å; F50-L62 HydrophobicContact CZ-CD1 4.26Å; L58-L62 HydrophobicContact CD1-CD1 4.37Å; L58-L62 HydrophobicContact CD1-CG 4.29Å; L58-L62 HydrophobicContact CD2-CD1 4.37Å; L58-L62 HydrophobicContact CG-CD1 3.93Å; L58-L62 HydrophobicContact CG-CG 4.25Å; L58-L62 VanDerWaalsContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CB 3.24Å; L58-L62 VanDerWaalsContact O-CG 3.28Å; L58-L62 WeakPolarHBondContact O-CG 3.24Å; L58-L62 PolarHBondContact O-N 2.96Å; Q60-L62 PolarHBondContact O-N 3.25Å; L62-A65 CarbonylContact O-C 3.57Å; L62-A65 PolarHBondContact O-N 2.9Å; L62-I66 HydrophobicContact CB-CD1 4.37Å; L62-I66 VanDerWaalsContact O-CB 3.29Å; L62-I66 WeakPolarHBondContact O-CB 3.35Å; L62-I66 VanDerWaalsContact O-CD1 3.24Å; L62-I66 WeakPolarHBondContact O-CD1 3.46Å; L62-I66 WeakPolarHBondContact O-CG1 3.24Å; L62-I66 PolarHBondContact O-N 3.27Å
63	W	90.4	Very high	84.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.6	-47.2	173.6	-179.7	-115	0	0	0	112.1	L37 K59 Q60 H61 A65 I66 R67 F74 L122 Y128 Y131 V134 L142	L37-W63 HydrophobicContact CD2-CE3 4.13Å; L37-W63 HydrophobicContact CD2-CZ3 4.03Å; K59-W63 WeakPolarHBondContact O-CB 3.37Å; K59-W63 PolarHBondContact O-N 2.99Å; Q60-W63 WeakPolarHBondContact O-CB 3.33Å; Q60-W63 PolarHBondContact O-N 3.35Å; H61-W63 VanDerWaalsContact C-N 3.34Å; H61-W63 PolarHBondContact O-N 3.34Å; W63-A65 PolarHBondContact O-N 3.29Å; W63-I66 HydrophobicContact CE3-CB 4.47Å; W63-I66 HydrophobicContact CE3-CG2 4.16Å; W63-I66 HydrophobicContact CZ3-CG2 4.1Å; W63-I66 PolarHBondContact O-N 2.94Å; W63-R67 HydrophobicContact CZ2-CB 4.31Å; W63-R67 HydrophobicContact CZ2-CG 4.49Å; W63-R67 WeakPolarHBondContact O-CB 3.48Å; W63-R67 PolarHBondContact O-N 3.46Å; W63-F74 HydrophobicContact CH2-CD1 4.17Å; W63-F74 AromaticContact CH2-CE1 3.68Å; W63-F74 HydrophobicContact CH2-CE1 3.68Å; W63-F74 HydrophobicContact CH2-CZ 4.28Å; W63-F74 HydrophobicContact CZ3-CD1 4.46Å; W63-F74 AromaticContact CZ3-CE1 3.72Å; W63-F74 HydrophobicContact CZ3-CE1 3.72Å; W63-F74 HydrophobicContact CZ3-CZ 4.42Å; W63-L122 HydrophobicContact CZ2-CD2 4.5Å; W63-Y128 PolarHBondContact NE1-O 3.47Å; W63-Y131 HydrophobicContact CB-CD2 4.06Å; W63-Y131 HydrophobicContact CG-CD2 4.23Å; W63-V134 HydrophobicContact CH2-CG1 4.05Å; W63-V134 HydrophobicContact CZ2-CB 4.35Å; W63-V134 HydrophobicContact CZ2-CG1 3.91Å; W63-V134 HydrophobicContact CZ2-CG2 3.73Å; W63-L142 HydrophobicContact CH2-CD2 4.45Å
64	S	88.1	Confident	86	Confident	48 Å²	48	50.4 Å²	50.4	34%	0.336	28%	0.277	S	S	.	.	H	α-helix	trans	-58.8	-31.1	172.4	-64.2	0	0	0	0	112.4	Q60 H61 P68	Q60-S64 PolarHBondContact NE2-OG 2.95Å; Q60-S64 PolarHBondContact O-N 2.75Å; Q60-S64 PolarHBondContact O-OG 3.46Å; H61-S64 PolarHBondContact O-N 3.02Å; S64-P68 WeakPolarHBondContact O-CD 3.26Å; S64-P68 WeakPolarHBondContact O-CG 3.17Å
65	A	86.2	Confident	87.5	Confident	22 Å²	22	50.7 Å²	50.7	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-78	-29	171.9	0	0	0	0	0	114.1	V20 H61 L62 W63 Q69	V20-A65 HydrophobicContact CG1-CB 4.48Å; V20-A65 HydrophobicContact CG2-CB 3.85Å; H61-A65 PolarHBondContact O-N 3.41Å; L62-A65 CarbonylContact O-C 3.57Å; L62-A65 PolarHBondContact O-N 2.9Å; W63-A65 PolarHBondContact O-N 3.29Å; A65-Q69 WeakPolarHBondContact O-CG 3.43Å
66	I	88.4	Confident	88.5	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-83.7	-47.8	-177.2	-74.5	161.3	0	0	0	112.1	F24 L40 W41 L62 W63 Q69 L72 F74	F24-I66 HydrophobicContact CE2-CG1 4.17Å; L40-I66 HydrophobicContact CD2-CD1 4.07Å; W41-I66 HydrophobicContact CH2-CD1 4.39Å; L62-I66 HydrophobicContact CB-CD1 4.37Å; L62-I66 VanDerWaalsContact O-CB 3.29Å; L62-I66 WeakPolarHBondContact O-CB 3.35Å; L62-I66 VanDerWaalsContact O-CD1 3.24Å; L62-I66 WeakPolarHBondContact O-CD1 3.46Å; L62-I66 WeakPolarHBondContact O-CG1 3.24Å; L62-I66 PolarHBondContact O-N 3.27Å; W63-I66 HydrophobicContact CE3-CB 4.47Å; W63-I66 HydrophobicContact CE3-CG2 4.16Å; W63-I66 HydrophobicContact CZ3-CG2 4.1Å; W63-I66 PolarHBondContact O-N 2.94Å; I66-Q69 PolarHBondContact O-N 3.26Å; I66-L72 HydrophobicContact CG2-CD1 3.81Å; I66-F74 HydrophobicContact CG2-CE1 4.07Å; I66-F74 HydrophobicContact CG2-CZ 4.02Å
67	R	89.9	Confident	89.2	Confident	23 Å²	23	45.2 Å²	45.2	9%	0.087	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-52.3	-177	177.8	-179.2	176	-129.3	9.1	113.6	W63 Q69 L122 R123 G125 E129	W63-R67 HydrophobicContact CZ2-CB 4.31Å; W63-R67 HydrophobicContact CZ2-CG 4.49Å; W63-R67 WeakPolarHBondContact O-CB 3.48Å; W63-R67 PolarHBondContact O-N 3.46Å; R67-Q69 VanDerWaalsContact C-N 3.34Å; R67-Q69 PolarHBondContact O-N 2.74Å; R67-L122 PolarHBondContact NE-O 2.86Å; R67-R123 WeakPolarHBondContact O-CG 3.41Å; R67-R123 PolarHBondContact O-NE 2.91Å; R67-G125 PolarHBondContact NH2-O 2.89Å; R67-E129 IonicContact CZ-OE2 3.19Å; R67-E129 VanDerWaalsContact NH1-CD 3.28Å; R67-E129 IonicContact NH1-OE1 2.73Å; R67-E129 IonicContact NH1-OE2 3.34Å; R67-E129 PolarHBondContact NH1-OE2 2.89Å
68	P	89	Confident	89.6	Confident	79 Å²	79	45.1 Å²	45.1	51%	0.513	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-11.3	-175.3	31.6	-37.3	0	0	0	114.7	S64 K70	S64-P68 WeakPolarHBondContact O-CD 3.26Å; S64-P68 WeakPolarHBondContact O-CG 3.17Å; P68-K70 PolarHBondContact O-N 2.93Å
69	Q	88.1	Confident	89.8	Confident	82 Å²	82	49.1 Å²	49.1	38%	0.383	25%	0.252	S	S	.	.			trans	-76.6	110.2	-165.1	-78.2	-77.4	-0.1	0	0	113.4	F24 A65 I66 R67 H71 L72 R123	F24-Q69 HydrophobicContact CE1-CB 3.68Å; F24-Q69 HydrophobicContact CE1-CG 4.03Å; F24-Q69 HydrophobicContact CE2-CG 4.19Å; F24-Q69 HydrophobicContact CZ-CB 3.38Å; F24-Q69 HydrophobicContact CZ-CG 3.43Å; F24-Q69 VanDerWaalsContact CZ-CG 3.43Å; A65-Q69 WeakPolarHBondContact O-CG 3.43Å; I66-Q69 PolarHBondContact O-N 3.26Å; R67-Q69 VanDerWaalsContact C-N 3.34Å; R67-Q69 PolarHBondContact O-N 2.74Å; Q69-H71 PolarHBondContact O-N 3.11Å; Q69-L72 PolarHBondContact O-N 2.91Å; Q69-R123 PolarHBondContact O-NH2 2.81Å
70	K	88.6	Confident	89.8	Confident	189 Å²	189	49.4 Å²	49.4	82%	0.822	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-25.5	-170.8	-62.5	179.9	-179.4	178.8	0	115.2	P68 L72	P68-K70 PolarHBondContact O-N 2.93Å; K70-L72 VanDerWaalsContact C-N 3.32Å
71	H	89.6	Confident	89.7	Confident	74 Å²	74	48.6 Å²	48.6	34%	0.343	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-3	180	-59.8	-64.9	0	0	0	114.9	Q69 S147 W150	Q69-H71 PolarHBondContact O-N 3.11Å; H71-S147 PolarHBondContact O-N 3.27Å; H71-W150 HydrophobicContact CB-CG 4.48Å; H71-W150 AromaticContact CD2-CE2 3.95Å; H71-W150 AromaticContact CD2-NE1 3.25Å; H71-W150 PolarHBondContact CD2-NE1 3.38Å; H71-W150 AromaticContact CE1-NE1 3.73Å; H71-W150 AromaticContact CG-CD1 3.62Å; H71-W150 AromaticContact CG-NE1 3.23Å; H71-W150 AromaticContact ND1-CD1 3.85Å; H71-W150 AromaticContact ND1-NE1 3.54Å; H71-W150 AromaticContact NE2-NE1 3.56Å
72	L	92.7	Very high	89.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	148.3	173.9	-57.2	-177.6	0	0	0	111.4	F24 V27 I66 Q69 K70 R123 V144 V145 A146	F24-L72 HydrophobicContact CD1-CD1 4.42Å; F24-L72 HydrophobicContact CD1-CD2 4.33Å; F24-L72 HydrophobicContact CD1-CG 4.42Å; F24-L72 HydrophobicContact CE1-CD1 3.54Å; F24-L72 HydrophobicContact CE1-CD2 3.99Å; F24-L72 HydrophobicContact CE1-CG 3.61Å; F24-L72 HydrophobicContact CE2-CD1 4.37Å; F24-L72 HydrophobicContact CZ-CD1 3.47Å; F24-L72 VanDerWaalsContact CZ-CD1 3.47Å; F24-L72 HydrophobicContact CZ-CG 4.05Å; V27-L72 HydrophobicContact CG1-CD2 3.85Å; I66-L72 HydrophobicContact CG2-CD1 3.81Å; Q69-L72 PolarHBondContact O-N 2.91Å; K70-L72 VanDerWaalsContact C-N 3.32Å; L72-R123 PolarHBondContact O-NH2 3.4Å; L72-V144 HydrophobicContact CB-CG1 4.15Å; L72-V144 HydrophobicContact CD1-CG1 3.93Å; L72-V144 HydrophobicContact CD2-CG1 4.41Å; L72-V144 HydrophobicContact CG-CG1 4.39Å; L72-V145 WeakPolarHBondContact CA-O 3.45Å; L72-A146 HydrophobicContact CD2-CB 3.83Å
73	Q	93.3	Very high	89.3	Confident	83 Å²	83	51.6 Å²	51.6	39%	0.388	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.3	169.4	-66.9	179.5	-88.7	0	0	109.4	F75 T119 V145	Q73-F75 HydrophobicContact CB-CD2 4.37Å; Q73-F75 HydrophobicContact CB-CE2 3.55Å; Q73-F75 HydrophobicContact CB-CZ 3.98Å; Q73-T119 WeakPolarHBondContact CA-OG1 3.25Å; Q73-V145 PolarHBondContact N-O 3.07Å; Q73-V145 PolarHBondContact O-N 3.22Å
74	F	94.8	Very high	88.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.6	-175.7	-58.7	-86.9	0	0	0	109.5	W63 I66 V118 T119 L122 L142 V144	W63-F74 HydrophobicContact CH2-CD1 4.17Å; W63-F74 AromaticContact CH2-CE1 3.68Å; W63-F74 HydrophobicContact CH2-CE1 3.68Å; W63-F74 HydrophobicContact CH2-CZ 4.28Å; W63-F74 HydrophobicContact CZ3-CD1 4.46Å; W63-F74 AromaticContact CZ3-CE1 3.72Å; W63-F74 HydrophobicContact CZ3-CE1 3.72Å; W63-F74 HydrophobicContact CZ3-CZ 4.42Å; I66-F74 HydrophobicContact CG2-CE1 4.07Å; I66-F74 HydrophobicContact CG2-CZ 4.02Å; F74-V118 HydrophobicContact CB-CG2 4Å; F74-V118 WeakPolarHBondContact O-CG2 3.44Å; F74-V118 PolarHBondContact O-N 3.31Å; F74-T119 HydrophobicContact CD2-CG2 4.19Å; F74-T119 PolarHBondContact N-OG1 3.3Å; F74-T119 PolarHBondContact O-N 2.91Å; F74-T119 PolarHBondContact O-OG1 2.93Å; F74-L122 HydrophobicContact CB-CD1 3.54Å; F74-L122 HydrophobicContact CD1-CD1 3.96Å; F74-L122 HydrophobicContact CD2-CD1 4.4Å; F74-L122 HydrophobicContact CG-CD1 3.73Å; F74-L142 HydrophobicContact CB-CD1 4.25Å; F74-V144 HydrophobicContact CD1-CB 4.48Å; F74-V144 HydrophobicContact CD1-CG1 4.17Å; F74-V144 HydrophobicContact CD1-CG2 3.93Å; F74-V144 HydrophobicContact CE1-CB 4.49Å; F74-V144 HydrophobicContact CE1-CG1 3.87Å; F74-V144 HydrophobicContact CE1-CG2 3.92Å
75	F	94.9	Very high	88.5	Confident	20 Å²	20	53.5 Å²	53.5	9%	0.088	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141.3	-179.1	-60.2	-88.3	0	0	0	110.9	Q73 R115 K116 D117 V143 V145	Q73-F75 HydrophobicContact CB-CD2 4.37Å; Q73-F75 HydrophobicContact CB-CE2 3.55Å; Q73-F75 HydrophobicContact CB-CZ 3.98Å; F75-R115 HydrophobicContact CB-CB 4.09Å; F75-R115 HydrophobicContact CB-CG 4.08Å; F75-R115 HydrophobicContact CD1-CG 3.83Å; F75-R115 HydrophobicContact CG-CG 4.09Å; F75-K116 CarbonylContact C-O 3.57Å; F75-K116 VanDerWaalsContact CA-O 3.24Å; F75-K116 WeakPolarHBondContact CA-O 3.28Å; F75-D117 HydrophobicContact CD1-CB 3.95Å; F75-D117 HydrophobicContact CE1-CB 3.77Å; F75-V143 PolarHBondContact N-O 3.49Å; F75-V143 PolarHBondContact O-N 3.41Å; F75-V145 HydrophobicContact CD2-CB 4.22Å; F75-V145 HydrophobicContact CD2-CG2 3.64Å; F75-V145 HydrophobicContact CE2-CB 3.99Å; F75-V145 HydrophobicContact CE2-CG2 3.85Å
76	V	94.4	Very high	87.9	Confident	21 Å²	21	58.3 Å²	58.3	13%	0.127	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.2	170	176.4	0	0	0	0	109.3	R115 K116 V118 F138 R141 L142	V76-R115 CarbonylContact O-C 3.58Å; V76-R115 WeakPolarHBondContact O-CA 3.07Å; V76-K116 PolarHBondContact N-O 3.45Å; V76-K116 PolarHBondContact O-N 3.17Å; V76-V118 HydrophobicContact CB-CG1 4.36Å; V76-V118 HydrophobicContact CG2-CB 4.36Å; V76-V118 HydrophobicContact CG2-CG1 3.67Å; V76-V118 HydrophobicContact CG2-CG2 3.77Å; V76-F138 HydrophobicContact CG1-CD1 4.49Å; V76-F138 HydrophobicContact CG2-CD1 3.45Å; V76-F138 VanDerWaalsContact CG2-CD1 3.45Å; V76-F138 HydrophobicContact CG2-CE1 3.66Å; V76-F138 HydrophobicContact CG2-CG 4.37Å; V76-R141 HydrophobicContact CG1-CB 4.28Å; V76-L142 HydrophobicContact CG2-CD1 4.41Å
77	L	92	Very high	86.8	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.026	37%	0.366	C	S	.	.			trans	-91.1	149.5	172.7	-54.2	-176.5	0	0	0	111.3	T79 R81 D111 R115 R141 V143	L77-T79 WeakPolarHBondContact CB-O 3.47Å; L77-T79 PolarHBondContact O-N 3.11Å; L77-R81 HydrophobicContact CD1-CG 3.69Å; L77-R81 VanDerWaalsContact CD1-NE 3.27Å; L77-D111 HydrophobicContact CD2-CB 3.71Å; L77-R115 HydrophobicContact CD2-CB 3.62Å; L77-R141 PolarHBondContact N-O 3.19Å; L77-V143 HydrophobicContact CD1-CG2 3.69Å; L77-V143 HydrophobicContact CD2-CG2 4.27Å; L77-V143 HydrophobicContact CG-CG2 3.82Å
78	D	88.4	Confident	85.8	Confident	91 Å²	91	73.7 Å²	73.7	49%	0.487	39%	0.386	S	S	.	.	S	Bend	trans	-67.6	-25.2	173.2	-61.6	-50	0	0	0	112.5	K116	D78-K116 IonicContact OD1-NZ 2.65Å; D78-K116 PolarHBondContact OD1-NZ 2.63Å
79	T	87.7	Confident	85.1	Confident	102 Å²	102	71 Å²	71	63%	0.626	37%	0.366	S	S	*	.	S	Bend	trans	-125	140.5	174.7	52.6	0	0	0	0	111	L77	L77-T79 WeakPolarHBondContact CB-O 3.47Å; L77-T79 PolarHBondContact O-N 3.11Å
80	A	87.1	Confident	84.2	Confident	61 Å²	61	69.7 Å²	69.7	50%	0.504	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-68.4	142.4	176.2	0	0	0	0	0	111	R141	A80-R141 HydrophobicContact CB-CG 3.77Å
81	R	86.7	Confident	83.4	Confident	31 Å²	31	65.8 Å²	65.8	12%	0.117	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-77.8	150.8	174.5	-79.1	174.5	173.6	-174.2	-1.7	110.8	E33 G34 T36 L77 A83 D111 D140	E33-R81 PolarHBondContact O-NH1 2.99Å; E33-R81 PolarHBondContact O-NH2 3.37Å; E33-R81 IonicContact OE2-CZ 3.89Å; E33-R81 IonicContact OE2-NH2 3.57Å; E33-R81 PolarHBondContact OE2-NH2 3.28Å; G34-R81 PolarHBondContact O-NH1 3.02Å; T36-R81 HydrophobicContact CG2-CB 4.08Å; L77-R81 HydrophobicContact CD1-CG 3.69Å; L77-R81 VanDerWaalsContact CD1-NE 3.27Å; R81-A83 PolarHBondContact O-N 3.12Å; R81-D111 IonicContact CZ-OD2 3.56Å; R81-D111 IonicContact NE-OD2 3.9Å; R81-D111 IonicContact NH2-OD2 2.83Å; R81-D111 PolarHBondContact NH2-OD2 2.94Å; R81-D140 PolarHBondContact N-O 2.83Å
82	A	83.7	Confident	82.8	Confident	96 Å²	96	64.3 Å²	64.3	79%	0.793	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-67.4	117.6	176.8	0	0	0	0	0	110.5	L84	A82-L84 PolarHBondContact O-N 3.28Å
83	A	80.6	Confident	82	Confident	53 Å²	53	69.2 Å²	69.2	44%	0.438	37%	0.372	S	S	.	.			trans	-42.8	118	178.8	0	0	0	0	0	113.2	N38 R81 T85	N38-A83 VanDerWaalsContact ND2-CB 3.29Å; N38-A83 WeakPolarHBondContact ND2-CB 3.28Å; R81-A83 PolarHBondContact O-N 3.12Å; A83-T85 PolarHBondContact O-N 2.78Å; A83-T85 VanDerWaalsContact O-N 3.16Å
84	L	82.4	Confident	81.5	Confident	21 Å²	21	67.3 Å²	67.3	11%	0.11	36%	0.362	C	S	.	.			trans	-71.7	109.7	178.8	-175.4	69.1	0	0	0	109.9	S39 V42 R43 A82	S39-L84 WeakPolarHBondContact OG-CB 3.46Å; V42-L84 HydrophobicContact CG1-CD2 4.45Å; V42-L84 HydrophobicContact CG1-CG 4.37Å; V42-L84 WeakPolarHBondContact CG2-O 3.29Å; R43-L84 HydrophobicContact CG-CD2 3.93Å; A82-L84 PolarHBondContact O-N 3.28Å
85	T	80.4	Confident	80.9	Confident	67 Å²	67	70.9 Å²	70.9	41%	0.411	39%	0.386	S	S	.	.			trans	-94.5	155.7	174.3	64.2	0	0	0	0	111.4	A83 R87 K88 I89	A83-T85 PolarHBondContact O-N 2.78Å; A83-T85 VanDerWaalsContact O-N 3.16Å; T85-R87 PolarHBondContact O-N 3.02Å; T85-K88 PolarHBondContact O-N 3.11Å; T85-I89 PolarHBondContact O-N 3.01Å
86	K	73	Confident	80.3	Confident	124 Å²	124	71.6 Å²	71.6	54%	0.539	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-21	174.9	-65.3	-171.2	-180	-172.1	0	113.6	V42	V42-K86 HydrophobicContact CG1-CG 4.06Å
87	R	65.6	Low	80	Confident	235 Å²	235	72.2 Å²	72.2	89%	0.887	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-14.4	176.8	-64	-176.1	-176	170.2	2.4	114.7	T85	T85-R87 PolarHBondContact O-N 3.02Å
88	K	69.3	Low	79.7	Confident	113 Å²	113	73.9 Å²	73.9	49%	0.491	41%	0.411	S	S	.	.	S	Bend	trans	-120.9	15.2	-177.4	-65.6	-168.5	172.1	-172.7	0	113.4	T85 D90 E91	T85-K88 PolarHBondContact O-N 3.11Å; K88-D90 PolarHBondContact O-N 3.43Å; K88-D90 VanDerWaalsContact O-N 3.13Å; K88-E91 PolarHBondContact O-N 2.64Å; K88-E91 VanDerWaalsContact O-N 3.09Å
89	I	74.7	Confident	79.6	Confident	21 Å²	21	70.3 Å²	70.3	11%	0.108	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-10.5	-171.9	-163.8	165	0	0	0	114.3	V42 R43 T46 T85	V42-I89 HydrophobicContact CG1-CD1 4.4Å; R43-I89 HydrophobicContact CG-CD1 4.25Å; T46-I89 HydrophobicContact CG2-CD1 3.8Å; T46-I89 WeakPolarHBondContact OG1-CD1 3.39Å; T85-I89 PolarHBondContact O-N 3.01Å
90	D	68.8	Low	79.2	Confident	56 Å²	56	72.8 Å²	72.8	30%	0.299	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-5.8	175	62.4	-37.6	0	0	0	114.1	K88 D92 H189 R292	K88-D90 PolarHBondContact O-N 3.43Å; K88-D90 VanDerWaalsContact O-N 3.13Å; D90-D92 PolarHBondContact O-N 2.97Å; D90-H189 HydrophobicContact CB-CB 3.72Å; D90-R292 VanDerWaalsContact CB-NH1 3.34Å; D90-R292 IonicContact OD2-CZ 3.15Å; D90-R292 IonicContact OD2-NH1 3.89Å; D90-R292 PolarHBondContact OD2-NH1 3.39Å; D90-R292 IonicContact OD2-NH2 3.78Å; D90-R292 PolarHBondContact OD2-NH2 3.42Å
91	E	70.8	Confident	78.5	Confident	106 Å²	106	73.6 Å²	73.6	50%	0.495	41%	0.408	S	S	.	.			trans	-88.1	99.4	176.1	-63.4	-163.9	131.4	0	0	111	K88 T93	K88-E91 PolarHBondContact O-N 2.64Å; K88-E91 VanDerWaalsContact O-N 3.09Å; E91-T93 HydrophobicContact CB-CG2 4.29Å; E91-T93 PolarHBondContact O-N 3.37Å; E91-T93 VanDerWaalsContact O-N 3.07Å
92	D	77	Confident	78.3	Confident	43 Å²	43	75.5 Å²	75.5	23%	0.23	42%	0.419	C	S	.	.			trans	-76	93	166.2	-174.5	-21.3	0	0	0	109.4	D90 F94 R182 R185	D90-D92 PolarHBondContact O-N 2.97Å; D92-F94 PolarHBondContact OD1-N 3.29Å; D92-R182 VanDerWaalsContact CG-CZ 3.46Å; D92-R182 VanDerWaalsContact CG-NE 3.31Å; D92-R182 PolarHBondContact O-NH2 2.98Å; D92-R182 IonicContact OD1-CZ 3.89Å; D92-R182 IonicContact OD1-NE 2.72Å; D92-R182 IonicContact OD1-NH1 2.96Å; D92-R182 IonicContact OD1-NH2 3.62Å; D92-R182 PolarHBondContact OD1-NH2 3.15Å; D92-R182 VanDerWaalsContact OD1-NH2 3.13Å; D92-R182 VanDerWaalsContact OD2-CD 3.28Å; D92-R182 WeakPolarHBondContact OD2-CD 3.47Å; D92-R182 VanDerWaalsContact OD2-CG 3.3Å; D92-R182 WeakPolarHBondContact OD2-CG 3.06Å; D92-R182 IonicContact OD2-CZ 2.94Å; D92-R182 IonicContact OD2-NE 3.09Å; D92-R182 PolarHBondContact OD2-NE 3.24Å; D92-R182 IonicContact OD2-NH2 3.35Å; D92-R185 IonicContact OD1-CZ 3.53Å; D92-R185 IonicContact OD1-NE 3.95Å; D92-R185 IonicContact OD1-NH2 3.93Å; D92-R185 PolarHBondContact OD1-NH2 2.91Å; D92-R185 IonicContact OD2-CZ 2.68Å; D92-R185 VanDerWaalsContact OD2-CZ 3.24Å; D92-R185 IonicContact OD2-NE 2.76Å; D92-R185 PolarHBondContact OD2-NE 3.3Å; D92-R185 IonicContact OD2-NH2 3.19Å; D92-R185 PolarHBondContact OD2-NH2 3.44Å
93	T	75.7	Confident	77.9	Confident	105 Å²	105	76.7 Å²	76.7	64%	0.644	42%	0.418	S	S	*	.			trans	-79.7	-13.9	-177.7	51.9	0	0	0	0	114.3	E91	E91-T93 HydrophobicContact CB-CG2 4.29Å; E91-T93 PolarHBondContact O-N 3.37Å; E91-T93 VanDerWaalsContact O-N 3.07Å
94	F	82.5	Confident	77.7	Confident	42 Å²	42	76.1 Å²	76.1	18%	0.184	42%	0.417	C	S	.	.			trans	-70.8	140	-171.6	-63.6	-82.6	0	0	0	112.4	E33 D92 R182	E33-F94 HydrophobicContact CG-CD1 4.07Å; E33-F94 HydrophobicContact CG-CD2 4.47Å; E33-F94 HydrophobicContact CG-CE1 4.41Å; E33-F94 HydrophobicContact CG-CG 4.12Å; D92-F94 PolarHBondContact OD1-N 3.29Å; F94-R182 PolarHBondContact O-NH1 3.07Å; F94-R182 PolarHBondContact O-NH2 3.38Å
95	P	82.2	Confident	77.9	Confident	76 Å²	76	77.9 Å²	77.9	49%	0.494	43%	0.427	S	S	.	.			trans	-71.4	156.6	173.2	31	-35.2	0	0	0	112	A97 S108 C110	P95-A97 VanDerWaalsContact C-N 3.29Å; P95-A97 PolarHBondContact O-N 2.8Å; P95-S108 PolarHBondContact O-OG 3.33Å; P95-C110 HydrophobicContact CG-CB 3.97Å
96	A	83.1	Confident	78.2	Confident	34 Å²	34	77.5 Å²	77.5	28%	0.281	42%	0.418	S	S	.	.			trans	-83.9	61.8	-176.3	0	0	0	0	0	113.4	I98 V202 F203	A96-I98 PolarHBondContact O-N 3.45Å; A96-V202 HydrophobicContact CB-CG1 3.98Å; A96-V202 WeakPolarHBondContact CB-O 3.5Å; A96-F203 HydrophobicContact CB-CD1 3.78Å; A96-F203 HydrophobicContact CB-CE1 3.86Å; A96-F203 HydrophobicContact CB-CG 4.44Å
97	A	87.6	Confident	78.9	Confident	35 Å²	35	71.6 Å²	71.6	29%	0.289	39%	0.393	S	S	.	.			trans	-84.2	82.7	178.6	0	0	0	0	0	112	P95 V99 S108 C109 C110	P95-A97 VanDerWaalsContact C-N 3.29Å; P95-A97 PolarHBondContact O-N 2.8Å; A97-V99 PolarHBondContact O-N 2.81Å; A97-S108 PolarHBondContact N-OG 3.05Å; A97-S108 CarbonylContact O-C 3.58Å; A97-S108 WeakPolarHBondContact O-CA 3.28Å; A97-S108 PolarHBondContact O-OG 3.36Å; A97-C109 PolarHBondContact O-N 2.66Å; A97-C110 HydrophobicContact CB-CB 3.96Å
98	I	86.8	Confident	80	Confident	40 Å²	40	60.5 Å²	60.5	21%	0.205	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-68.8	119.4	179.8	-51.4	162.6	0	0	0	110.2	A96 P174 V175 A178 F203	A96-I98 PolarHBondContact O-N 3.45Å; I98-P174 HydrophobicContact CG2-CB 4.07Å; I98-V175 HydrophobicContact CD1-CB 3.79Å; I98-V175 HydrophobicContact CD1-CG2 3.62Å; I98-A178 HydrophobicContact CG1-CB 4.26Å; I98-F203 HydrophobicContact CD1-CD1 4.25Å; I98-F203 HydrophobicContact CG1-CD1 4.3Å; I98-F203 HydrophobicContact CG1-CE1 4.47Å
99	V	86.6	Confident	81.1	Confident	15 Å²	15	55.3 Å²	55.3	9%	0.091	33%	0.329	C	S	.	.			trans	-68.8	137.4	176	178.7	0	0	0	0	110.3	L32 A97 E102 G107 F112	L32-V99 HydrophobicContact CD2-CB 4.05Å; L32-V99 HydrophobicContact CD2-CG2 3.62Å; A97-V99 PolarHBondContact O-N 2.81Å; V99-E102 HydrophobicContact CG1-CB 4.35Å; V99-E102 HydrophobicContact CG1-CG 3.7Å; V99-G107 PolarHBondContact N-O 3.25Å; V99-F112 HydrophobicContact CG1-CD1 3.9Å; V99-F112 HydrophobicContact CG1-CD2 4.45Å; V99-F112 HydrophobicContact CG1-CE1 3.9Å; V99-F112 HydrophobicContact CG1-CE2 4.44Å; V99-F112 HydrophobicContact CG1-CG 4.2Å; V99-F112 HydrophobicContact CG1-CZ 4.18Å; V99-F112 HydrophobicContact CG2-CB 3.81Å; V99-F112 HydrophobicContact CG2-CD1 4.09Å; V99-F112 HydrophobicContact CG2-CD2 3.9Å; V99-F112 HydrophobicContact CG2-CG 3.63Å
100	K	78.9	Confident	81.8	Confident	155 Å²	155	57 Å²	57	67%	0.674	34%	0.342	S	S	*	.			trans	-143	139.8	-176	-63.5	171.7	-170.6	167.7	0	109.9
101	G	72.6	Confident	82.8	Confident	77 Å²	77	55.8 Å²	55.8	79%	0.794	34%	0.336	S	S	*	.	S	Bend	trans	106	-37.2	179.4	0	0	0	0	0	112.7	P103	G101-P103 WeakPolarHBondContact O-CD 3.36Å
102	E	81.2	Confident	83.7	Confident	71 Å²	71	52.5 Å²	52.5	33%	0.332	32%	0.319	S	S	.	.			trans	-73.1	120.3	-176	-46.3	-49.2	145.2	0	0	112.4	V99 I105 F112 R113	V99-E102 HydrophobicContact CG1-CB 4.35Å; V99-E102 HydrophobicContact CG1-CG 3.7Å; E102-I105 HydrophobicContact CB-CB 3.99Å; E102-I105 HydrophobicContact CB-CD1 4.22Å; E102-I105 HydrophobicContact CB-CG1 4.41Å; E102-F112 HydrophobicContact CG-CE1 3.62Å; E102-F112 HydrophobicContact CG-CZ 3.88Å; E102-R113 IonicContact OE1-NH2 3.77Å
103	P	76.3	Confident	84.2	Confident	121 Å²	121	59.9 Å²	59.9	79%	0.786	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	136.6	177.3	28.7	-33.5	0	0	0	111.1	G101 I105	G101-P103 WeakPolarHBondContact O-CD 3.36Å; P103-I105 PolarHBondContact O-N 3.16Å; P103-I105 VanDerWaalsContact O-N 3.15Å
104	G	77.2	Confident	84.9	Confident	41 Å²	41	58.5 Å²	58.5	42%	0.423	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-10.7	178.4	0	0	0	0	0	115.9	Q148	G104-Q148 WeakPolarHBondContact O-CG 3.25Å
105	I	86.1	Confident	85.4	Confident	59 Å²	59	57.7 Å²	57.7	30%	0.303	33%	0.331	S	S	.	.			trans	-100.2	119	179.1	-59.7	179.6	0	0	0	109.9	L32 E102 P103 F112	L32-I105 HydrophobicContact CD1-CG2 3.84Å; L32-I105 HydrophobicContact CD2-CG2 3.63Å; L32-I105 HydrophobicContact CG-CG2 4.42Å; E102-I105 HydrophobicContact CB-CB 3.99Å; E102-I105 HydrophobicContact CB-CD1 4.22Å; E102-I105 HydrophobicContact CB-CG1 4.41Å; P103-I105 PolarHBondContact O-N 3.16Å; P103-I105 VanDerWaalsContact O-N 3.15Å; I105-F112 HydrophobicContact CD1-CE2 4.25Å; I105-F112 HydrophobicContact CD1-CZ 3.88Å; I105-F112 HydrophobicContact CG2-CE2 3.92Å; I105-F112 HydrophobicContact CG2-CZ 4.21Å
106	Y	86.8	Confident	85.9	Confident	58 Å²	58	59.9 Å²	59.9	23%	0.227	33%	0.333	C	S	.	.			trans	-123.9	134	176.7	-53.2	-72.2	0	0	0	110.5	Q148 R151 I170 Y177	Y106-Q148 HydrophobicContact CD2-CG 4.28Å; Y106-Q148 PolarHBondContact O-OE1 3.29Å; Y106-R151 PolarHBondContact O-NH1 3.15Å; Y106-I170 HydrophobicContact CD1-CG2 3.67Å; Y106-I170 HydrophobicContact CD2-CD1 3.83Å; Y106-I170 HydrophobicContact CD2-CG2 3.95Å; Y106-I170 HydrophobicContact CE1-CG2 3.52Å; Y106-I170 HydrophobicContact CE2-CD1 4.22Å; Y106-I170 HydrophobicContact CE2-CG2 3.8Å; Y106-I170 HydrophobicContact CG-CD1 4.27Å; Y106-I170 HydrophobicContact CG-CG2 3.89Å; Y106-Y177 WeakPolarHBondContact O-CD1 3.46Å; Y106-Y177 VanDerWaalsContact O-CE1 3.3Å; Y106-Y177 WeakPolarHBondContact O-CE1 3.25Å
107	G	87.4	Confident	86.4	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.01	34%	0.342	C	S	.	.	S	Bend	trans	156.7	-169.6	173.2	0	0	0	0	0	115.3	V99 E181	V99-G107 PolarHBondContact N-O 3.25Å; G107-E181 WeakPolarHBondContact CA-OE2 3.46Å
108	S	89.4	Confident	86.7	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.007	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-113.5	129.3	168.5	-172.5	0	0	0	0	109.7	E33 P95 A97 E181	E33-S108 PolarHBondContact N-O 3.43Å; P95-S108 PolarHBondContact O-OG 3.33Å; A97-S108 PolarHBondContact N-OG 3.05Å; A97-S108 CarbonylContact O-C 3.58Å; A97-S108 WeakPolarHBondContact O-CA 3.28Å; A97-S108 PolarHBondContact O-OG 3.36Å; S108-E181 PolarHBondContact N-OE2 3.1Å; S108-E181 VanDerWaalsContact N-OE2 3.09Å
109	C	91.2	Very high	86.9	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.027	33%	0.328	C	S	.	.			trans	-158.6	123.5	168.1	-179.4	0	0	0	0	110.4	L32 E33 A97 F112	L32-C109 HydrophobicContact CB-CB 4.39Å; L32-C109 HydrophobicContact CD2-CB 4.45Å; L32-C109 HydrophobicContact CG-CB 4.01Å; E33-C109 WeakPolarHBondContact OE1-CA 3.48Å; E33-C109 WeakPolarHBondContact OE2-CA 3.4Å; E33-C109 PolarHBondContact OE2-SG 2.86Å; A97-C109 PolarHBondContact O-N 2.66Å; C109-F112 HydrophobicContact CB-CB 4.03Å; C109-F112 PolarHBondContact SG-N 3.4Å
110	C	88.9	Confident	87	Confident	57 Å²	57	67.7 Å²	67.7	39%	0.385	36%	0.359	S	S	.	.	S	Bend	trans	-71.5	-39.1	176.8	45.5	0	0	0	0	112.3	P95 A97 F112	P95-C110 HydrophobicContact CG-CB 3.97Å; A97-C110 HydrophobicContact CB-CB 3.96Å; C110-F112 PolarHBondContact O-N 3.43Å
111	D	89.8	Confident	87.5	Confident	31 Å²	31	63.7 Å²	63.7	17%	0.166	35%	0.347	C	S	.	.	S	Bend	trans	-86.7	8	-172.6	-38.3	-44	0	0	0	112.4	L77 R81 R113 T114 R115	L77-D111 HydrophobicContact CD2-CB 3.71Å; R81-D111 IonicContact CZ-OD2 3.56Å; R81-D111 IonicContact NE-OD2 3.9Å; R81-D111 IonicContact NH2-OD2 2.83Å; R81-D111 PolarHBondContact NH2-OD2 2.94Å; D111-R113 PolarHBondContact O-N 3.35Å; D111-T114 WeakPolarHBondContact CA-OG1 3.06Å; D111-T114 PolarHBondContact O-N 3.13Å; D111-T114 VanDerWaalsContact O-N 3.11Å; D111-T114 PolarHBondContact O-OG1 2.98Å; D111-R115 WeakPolarHBondContact O-CB 3.42Å; D111-R115 VanDerWaalsContact O-CG 3.3Å; D111-R115 WeakPolarHBondContact O-CG 3.45Å; D111-R115 PolarHBondContact O-N 3.13Å
112	F	90.6	Very high	88.2	Confident	36 Å²	36	60 Å²	60	16%	0.158	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.3	-168.5	-178	-92.3	0	0	0	114	L32 V99 E102 I105 C109 C110	L32-F112 HydrophobicContact CD1-CD2 4.23Å; L32-F112 HydrophobicContact CD1-CE2 4.11Å; L32-F112 HydrophobicContact CD2-CD2 4.03Å; L32-F112 HydrophobicContact CD2-CE2 4.24Å; L32-F112 HydrophobicContact CG-CD2 4.16Å; L32-F112 HydrophobicContact CG-CE2 4.46Å; V99-F112 HydrophobicContact CG1-CD1 3.9Å; V99-F112 HydrophobicContact CG1-CD2 4.45Å; V99-F112 HydrophobicContact CG1-CE1 3.9Å; V99-F112 HydrophobicContact CG1-CE2 4.44Å; V99-F112 HydrophobicContact CG1-CG 4.2Å; V99-F112 HydrophobicContact CG1-CZ 4.18Å; V99-F112 HydrophobicContact CG2-CB 3.81Å; V99-F112 HydrophobicContact CG2-CD1 4.09Å; V99-F112 HydrophobicContact CG2-CD2 3.9Å; V99-F112 HydrophobicContact CG2-CG 3.63Å; E102-F112 HydrophobicContact CG-CE1 3.62Å; E102-F112 HydrophobicContact CG-CZ 3.88Å; I105-F112 HydrophobicContact CD1-CE2 4.25Å; I105-F112 HydrophobicContact CD1-CZ 3.88Å; I105-F112 HydrophobicContact CG2-CE2 3.92Å; I105-F112 HydrophobicContact CG2-CZ 4.21Å; C109-F112 HydrophobicContact CB-CB 4.03Å; C109-F112 PolarHBondContact SG-N 3.4Å; C110-F112 PolarHBondContact O-N 3.43Å
113	R	88	Confident	88.7	Confident	199 Å²	199	60.1 Å²	60.1	75%	0.751	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-12.3	-178.7	-67.6	-173.4	170.8	176.5	-5	114.7	E102 D111	E102-R113 IonicContact OE1-NH2 3.77Å; D111-R113 PolarHBondContact O-N 3.35Å
114	T	90.8	Very high	89.1	Confident	75 Å²	75	60.8 Å²	60.8	46%	0.46	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-32.5	-179.6	46.7	0	0	0	0	111.8	D111	D111-T114 WeakPolarHBondContact CA-OG1 3.06Å; D111-T114 PolarHBondContact O-N 3.13Å; D111-T114 VanDerWaalsContact O-N 3.11Å; D111-T114 PolarHBondContact O-OG1 2.98Å
115	R	92.5	Very high	89.4	Confident	26 Å²	26	59.9 Å²	59.9	10%	0.098	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-60.7	134.8	179.1	74.5	-170.9	-170.2	-178.5	6.8	112.8	L32 F75 V76 L77 D111	L32-R115 PolarHBondContact O-NH1 3.16Å; F75-R115 HydrophobicContact CB-CB 4.09Å; F75-R115 HydrophobicContact CB-CG 4.08Å; F75-R115 HydrophobicContact CD1-CG 3.83Å; F75-R115 HydrophobicContact CG-CG 4.09Å; V76-R115 CarbonylContact O-C 3.58Å; V76-R115 WeakPolarHBondContact O-CA 3.07Å; L77-R115 HydrophobicContact CD2-CB 3.62Å; D111-R115 WeakPolarHBondContact O-CB 3.42Å; D111-R115 VanDerWaalsContact O-CG 3.3Å; D111-R115 WeakPolarHBondContact O-CG 3.45Å; D111-R115 PolarHBondContact O-N 3.13Å
116	K	92.8	Very high	89.2	Confident	122 Å²	122	63.1 Å²	63.1	53%	0.53	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.5	-177	-68.7	151.5	-177	155.6	0	110.2	F75 V76 D78 V118	F75-K116 CarbonylContact C-O 3.57Å; F75-K116 VanDerWaalsContact CA-O 3.24Å; F75-K116 WeakPolarHBondContact CA-O 3.28Å; V76-K116 PolarHBondContact N-O 3.45Å; V76-K116 PolarHBondContact O-N 3.17Å; D78-K116 IonicContact OD1-NZ 2.65Å; D78-K116 PolarHBondContact OD1-NZ 2.63Å; K116-V118 PolarHBondContact O-N 3.17Å
117	D	92.8	Very high	89.2	Confident	87 Å²	87	65.6 Å²	65.6	47%	0.465	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	120.2	177.9	-167.5	-23.7	0	0	0	110.4	F75 T119	F75-D117 HydrophobicContact CD1-CB 3.95Å; F75-D117 HydrophobicContact CE1-CB 3.77Å; D117-T119 WeakPolarHBondContact OD1-CB 2.97Å; D117-T119 PolarHBondContact OD1-N 2.87Å; D117-T119 PolarHBondContact OD1-OG1 3.4Å
118	V	93.3	Very high	89.3	Confident	19 Å²	19	66.9 Å²	66.9	12%	0.115	33%	0.328	C	S	.	.			trans	-115	13	177.6	-63.7	0	0	0	0	112.3	F74 V76 K116 K120 T121 L122 L142	F74-V118 HydrophobicContact CB-CG2 4Å; F74-V118 WeakPolarHBondContact O-CG2 3.44Å; F74-V118 PolarHBondContact O-N 3.31Å; V76-V118 HydrophobicContact CB-CG1 4.36Å; V76-V118 HydrophobicContact CG2-CB 4.36Å; V76-V118 HydrophobicContact CG2-CG1 3.67Å; V76-V118 HydrophobicContact CG2-CG2 3.77Å; K116-V118 PolarHBondContact O-N 3.17Å; V118-K120 VanDerWaalsContact C-N 3.26Å; V118-K120 PolarHBondContact O-N 3.49Å; V118-T121 WeakPolarHBondContact O-CB 3.48Å; V118-T121 PolarHBondContact O-N 2.73Å; V118-L122 HydrophobicContact CG2-CD1 3.72Å; V118-L122 HydrophobicContact CG2-CG 4.24Å; V118-L122 PolarHBondContact O-N 3.49Å; V118-L142 HydrophobicContact CG2-CD1 4.12Å
119	T	91.6	Very high	89.1	Confident	15 Å²	15	71.4 Å²	71.4	9%	0.092	35%	0.349	C	S	.	.	H	α-helix	trans	-57.3	-35.5	-175.3	-56.9	0	0	0	0	113	Q73 F74 D117 R123	Q73-T119 WeakPolarHBondContact CA-OG1 3.25Å; F74-T119 HydrophobicContact CD2-CG2 4.19Å; F74-T119 PolarHBondContact N-OG1 3.3Å; F74-T119 PolarHBondContact O-N 2.91Å; F74-T119 PolarHBondContact O-OG1 2.93Å; D117-T119 WeakPolarHBondContact OD1-CB 2.97Å; D117-T119 PolarHBondContact OD1-N 2.87Å; D117-T119 PolarHBondContact OD1-OG1 3.4Å; T119-R123 WeakPolarHBondContact O-CB 3.36Å; T119-R123 WeakPolarHBondContact O-CG 3.22Å; T119-R123 PolarHBondContact O-N 3.16Å
120	K	88.7	Confident	89	Confident	167 Å²	167	75.8 Å²	75.8	73%	0.726	37%	0.372	S	S	*	.	H	α-helix	trans	-70.7	-49.8	173.6	-67.5	-173.8	179.5	-177.7	0	110.9	V118 L122 R123 L124	V118-K120 VanDerWaalsContact C-N 3.26Å; V118-K120 PolarHBondContact O-N 3.49Å; K120-L122 PolarHBondContact O-N 3.45Å; K120-R123 PolarHBondContact O-N 2.82Å; K120-R123 VanDerWaalsContact O-N 3.15Å; K120-L124 HydrophobicContact CB-CD1 4.39Å; K120-L124 WeakPolarHBondContact O-CB 3.31Å; K120-L124 WeakPolarHBondContact O-CG 3.27Å; K120-L124 PolarHBondContact O-N 3.42Å
121	T	89	Confident	88.9	Confident	71 Å²	71	74.8 Å²	74.8	44%	0.436	36%	0.36	S	S	.	.	H	α-helix	trans	-56.4	-47.2	-177.5	-45	0	0	0	0	112.5	V118 R123 G125 Y128	V118-T121 WeakPolarHBondContact O-CB 3.48Å; V118-T121 PolarHBondContact O-N 2.73Å; T121-R123 PolarHBondContact O-N 3.24Å; T121-G125 PolarHBondContact O-N 3.42Å; T121-Y128 HydrophobicContact CG2-CE2 3.87Å; T121-Y128 WeakPolarHBondContact O-CD2 3.46Å
122	L	88.9	Confident	88.7	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-70.9	-26.3	178.9	-74.1	171	0	0	0	114	W63 R67 F74 V118 K120 Y128 V134 F138 L142	W63-L122 HydrophobicContact CZ2-CD2 4.5Å; R67-L122 PolarHBondContact NE-O 2.86Å; F74-L122 HydrophobicContact CB-CD1 3.54Å; F74-L122 HydrophobicContact CD1-CD1 3.96Å; F74-L122 HydrophobicContact CD2-CD1 4.4Å; F74-L122 HydrophobicContact CG-CD1 3.73Å; V118-L122 HydrophobicContact CG2-CD1 3.72Å; V118-L122 HydrophobicContact CG2-CG 4.24Å; V118-L122 PolarHBondContact O-N 3.49Å; K120-L122 PolarHBondContact O-N 3.45Å; L122-Y128 HydrophobicContact CD2-CD1 3.7Å; L122-Y128 HydrophobicContact CD2-CD2 4.17Å; L122-Y128 HydrophobicContact CD2-CE1 4.24Å; L122-Y128 HydrophobicContact CD2-CG 3.63Å; L122-V134 HydrophobicContact CD2-CG1 4.34Å; L122-V134 HydrophobicContact CD2-CG2 4.18Å; L122-F138 HydrophobicContact CD2-CD2 4.34Å; L122-F138 HydrophobicContact CD2-CE2 3.64Å; L122-F138 HydrophobicContact CD2-CZ 4.36Å; L122-F138 HydrophobicContact CG-CE2 4.48Å; L122-L142 HydrophobicContact CD1-CD1 3.84Å; L122-L142 HydrophobicContact CD1-CD2 4.19Å
123	R	89.9	Confident	88.7	Confident	73 Å²	73	75.3 Å²	75.3	28%	0.275	37%	0.369	S	S	.	.	H	α-helix	trans	-88.1	-27.4	179.1	-75.6	-177.5	176.8	142.6	11.6	114	R67 Q69 L72 T119 K120 T121	R67-R123 WeakPolarHBondContact O-CG 3.41Å; R67-R123 PolarHBondContact O-NE 2.91Å; Q69-R123 PolarHBondContact O-NH2 2.81Å; L72-R123 PolarHBondContact O-NH2 3.4Å; T119-R123 WeakPolarHBondContact O-CB 3.36Å; T119-R123 WeakPolarHBondContact O-CG 3.22Å; T119-R123 PolarHBondContact O-N 3.16Å; K120-R123 PolarHBondContact O-N 2.82Å; K120-R123 VanDerWaalsContact O-N 3.15Å; T121-R123 PolarHBondContact O-N 3.24Å
124	L	85.9	Confident	88.7	Confident	135 Å²	135	65.8 Å²	65.8	71%	0.707	33%	0.334	S	S	*	.	H	α-helix	trans	-101.3	-22.6	-177.8	-64.6	173	0	0	0	113.4	K120	K120-L124 HydrophobicContact CB-CD1 4.39Å; K120-L124 WeakPolarHBondContact O-CB 3.31Å; K120-L124 WeakPolarHBondContact O-CG 3.27Å; K120-L124 PolarHBondContact O-N 3.42Å
125	G	82.3	Confident	88.5	Confident	22 Å²	22	64.2 Å²	64.2	23%	0.227	32%	0.324	C	S	.	.			trans	-84.2	115.5	175.5	0	0	0	0	0	111	R67 T121 K127 Y128	R67-G125 PolarHBondContact NH2-O 2.89Å; T121-G125 PolarHBondContact O-N 3.42Å; G125-K127 VanDerWaalsContact C-N 3.28Å; G125-K127 PolarHBondContact O-N 2.87Å; G125-Y128 WeakPolarHBondContact O-CB 3.46Å; G125-Y128 PolarHBondContact O-N 3.21Å; G125-Y128 VanDerWaalsContact O-N 3.08Å
126	D	82.2	Confident	88.3	Confident	127 Å²	127	69.7 Å²	69.7	68%	0.679	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-63.9	-32.7	-178.2	-56.5	-44.4	0	0	0	112.5	Y128 E129	D126-Y128 PolarHBondContact O-N 3.2Å; D126-E129 WeakPolarHBondContact O-CB 3.24Å; D126-E129 PolarHBondContact O-N 3.11Å
127	K	87.4	Confident	88.1	Confident	110 Å²	110	66.6 Å²	66.6	48%	0.478	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-57.9	-20.1	173.6	73.5	153.7	-175.7	152.7	0	114.2	G125 T133 D137	G125-K127 VanDerWaalsContact C-N 3.28Å; G125-K127 PolarHBondContact O-N 2.87Å; K127-T133 HydrophobicContact CB-CG2 4.46Å; K127-T133 HydrophobicContact CD-CG2 4.07Å; K127-T133 WeakPolarHBondContact O-CB 3.16Å; K127-T133 WeakPolarHBondContact O-CG2 3.21Å; K127-D137 IonicContact NZ-OD1 3.42Å; K127-D137 PolarHBondContact NZ-OD1 3.44Å; K127-D137 IonicContact NZ-OD2 2.62Å; K127-D137 PolarHBondContact NZ-OD2 3.11Å
128	Y	88.5	Confident	87.9	Confident	27 Å²	27	63.6 Å²	63.6	11%	0.106	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-91.6	4.9	177	-55.1	-64.5	0	0	0	113.7	W63 T121 L122 G125 D126 L130 V134 D137 F138	W63-Y128 PolarHBondContact NE1-O 3.47Å; T121-Y128 HydrophobicContact CG2-CE2 3.87Å; T121-Y128 WeakPolarHBondContact O-CD2 3.46Å; L122-Y128 HydrophobicContact CD2-CD1 3.7Å; L122-Y128 HydrophobicContact CD2-CD2 4.17Å; L122-Y128 HydrophobicContact CD2-CE1 4.24Å; L122-Y128 HydrophobicContact CD2-CG 3.63Å; G125-Y128 WeakPolarHBondContact O-CB 3.46Å; G125-Y128 PolarHBondContact O-N 3.21Å; G125-Y128 VanDerWaalsContact O-N 3.08Å; D126-Y128 PolarHBondContact O-N 3.2Å; Y128-L130 VanDerWaalsContact C-N 3.28Å; Y128-V134 HydrophobicContact CD1-CG2 3.97Å; Y128-V134 HydrophobicContact CG-CG2 4.41Å; Y128-V134 WeakPolarHBondContact O-CG2 3.37Å; Y128-D137 HydrophobicContact CE1-CB 4.42Å; Y128-D137 VanDerWaalsContact CE1-OD2 3.22Å; Y128-D137 WeakPolarHBondContact CE1-OD2 3.38Å; Y128-F138 HydrophobicContact CD1-CE2 4.03Å; Y128-F138 AromaticContact CE1-CE2 3.49Å; Y128-F138 HydrophobicContact CE1-CE2 3.49Å; Y128-F138 VanDerWaalsContact CE1-CE2 3.49Å; Y128-F138 AromaticContact CE1-CZ 3.95Å; Y128-F138 HydrophobicContact CE1-CZ 3.95Å
129	E	86.7	Confident	87.7	Confident	96 Å²	96	66.9 Å²	66.9	45%	0.449	34%	0.34	S	S	.	.	S	Bend	trans	-65.7	-35.9	164.8	-172.9	127.4	-160.6	0	0	111.2	Q60 R67 D126	Q60-E129 PolarHBondContact NE2-O 3.43Å; R67-E129 IonicContact CZ-OE2 3.19Å; R67-E129 VanDerWaalsContact NH1-CD 3.28Å; R67-E129 IonicContact NH1-OE1 2.73Å; R67-E129 IonicContact NH1-OE2 3.34Å; R67-E129 PolarHBondContact NH1-OE2 2.89Å; D126-E129 WeakPolarHBondContact O-CB 3.24Å; D126-E129 PolarHBondContact O-N 3.11Å
130	L	87.5	Confident	87.5	Confident	96 Å²	96	66.5 Å²	66.5	50%	0.503	34%	0.337	S	S	.	.	S	Bend	trans	-79.7	123.4	178.1	-145.4	70.1	0	0	0	110.6	Y128 S132 T133 V134	Y128-L130 VanDerWaalsContact C-N 3.28Å; L130-S132 VanDerWaalsContact C-N 3.3Å; L130-S132 WeakPolarHBondContact CD2-OG 3.39Å; L130-S132 PolarHBondContact O-N 2.68Å; L130-T133 PolarHBondContact O-N 2.97Å; L130-V134 PolarHBondContact O-N 2.85Å
131	Y	88.3	Confident	87.6	Confident	37 Å²	37	63.6 Å²	63.6	15%	0.145	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-34.8	-177.6	168.9	-90.7	0	0	0	112.5	L37 W41 K59 W63 V134 V135	L37-Y131 HydrophobicContact CD1-CE2 4Å; W41-Y131 AromaticContact CE2-CE2 3.98Å; W41-Y131 HydrophobicContact CZ2-CD2 4.34Å; W41-Y131 AromaticContact CZ2-CE2 3.67Å; W41-Y131 HydrophobicContact CZ2-CE2 3.67Å; W41-Y131 AromaticContact NE1-CE2 3.66Å; W41-Y131 AromaticContact NE1-CZ 3.54Å; W41-Y131 PolarHBondContact NE1-OH 3.44Å; K59-Y131 HydrophobicContact CB-CD1 4.25Å; K59-Y131 HydrophobicContact CB-CD2 4.45Å; K59-Y131 HydrophobicContact CB-CE1 4.26Å; K59-Y131 HydrophobicContact CB-CE2 4.42Å; K59-Y131 HydrophobicContact CB-CG 4.38Å; K59-Y131 HydrophobicContact CD-CE1 4.06Å; W63-Y131 HydrophobicContact CB-CD2 4.06Å; W63-Y131 HydrophobicContact CG-CD2 4.23Å; Y131-V134 PolarHBondContact O-N 3.45Å; Y131-V135 HydrophobicContact CD1-CG2 4.28Å; Y131-V135 HydrophobicContact CE1-CG2 3.59Å; Y131-V135 HydrophobicContact CE2-CG2 4.04Å; Y131-V135 VanDerWaalsContact CZ-CG2 3.43Å; Y131-V135 PolarHBondContact O-N 2.94Å; Y131-V135 VanDerWaalsContact O-N 3.15Å; Y131-V135 WeakPolarHBondContact OH-CG2 3.42Å
132	S	85.9	Confident	87.8	Confident	48 Å²	48	60.2 Å²	60.2	34%	0.336	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-50.4	178.2	47.8	0	0	0	0	111.9	L130 V134 V135 E136	L130-S132 VanDerWaalsContact C-N 3.3Å; L130-S132 WeakPolarHBondContact CD2-OG 3.39Å; L130-S132 PolarHBondContact O-N 2.68Å; S132-V134 PolarHBondContact O-N 3.37Å; S132-V135 CarbonylContact O-C 3.29Å; S132-V135 WeakPolarHBondContact O-CA 3.48Å; S132-V135 WeakPolarHBondContact O-CB 3.22Å; S132-V135 PolarHBondContact O-N 2.94Å; S132-E136 WeakPolarHBondContact O-CG 3.19Å; S132-E136 PolarHBondContact O-N 3.41Å
133	T	88.5	Confident	88	Confident	29 Å²	29	60.2 Å²	60.2	18%	0.178	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-32	179.4	-52.6	0	0	0	0	112.6	K127 L130 E136 D137	K127-T133 HydrophobicContact CB-CG2 4.46Å; K127-T133 HydrophobicContact CD-CG2 4.07Å; K127-T133 WeakPolarHBondContact O-CB 3.16Å; K127-T133 WeakPolarHBondContact O-CG2 3.21Å; L130-T133 PolarHBondContact O-N 2.97Å; T133-E136 WeakPolarHBondContact CA-OE2 3.36Å; T133-E136 PolarHBondContact O-N 2.84Å; T133-D137 WeakPolarHBondContact O-CB 3.41Å; T133-D137 PolarHBondContact O-N 3.18Å
134	V	88.8	Confident	88.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-70.1	-34.9	173.4	177.8	0	0	0	0	112.1	L37 W63 L122 Y128 L130 Y131 S132 F138 L142	L37-V134 HydrophobicContact CD1-CG1 4.01Å; W63-V134 HydrophobicContact CH2-CG1 4.05Å; W63-V134 HydrophobicContact CZ2-CB 4.35Å; W63-V134 HydrophobicContact CZ2-CG1 3.91Å; W63-V134 HydrophobicContact CZ2-CG2 3.73Å; L122-V134 HydrophobicContact CD2-CG1 4.34Å; L122-V134 HydrophobicContact CD2-CG2 4.18Å; Y128-V134 HydrophobicContact CD1-CG2 3.97Å; Y128-V134 HydrophobicContact CG-CG2 4.41Å; Y128-V134 WeakPolarHBondContact O-CG2 3.37Å; L130-V134 PolarHBondContact O-N 2.85Å; Y131-V134 PolarHBondContact O-N 3.45Å; S132-V134 PolarHBondContact O-N 3.37Å; V134-F138 HydrophobicContact CG1-CD2 4.28Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.31Å; V134-L142 HydrophobicContact CG1-CD2 3.48Å; V134-L142 VanDerWaalsContact CG1-CD2 3.48Å
135	V	87.2	Confident	88.6	Confident	42 Å²	42	50.5 Å²	50.5	26%	0.255	26%	0.255	S	S	.	.	H	α-helix	trans	-71	-43	172.6	174.8	0	0	0	0	110.7	L37 Y131 S132 D139	L37-V135 HydrophobicContact CD1-CG2 4.5Å; Y131-V135 HydrophobicContact CD1-CG2 4.28Å; Y131-V135 HydrophobicContact CE1-CG2 3.59Å; Y131-V135 HydrophobicContact CE2-CG2 4.04Å; Y131-V135 VanDerWaalsContact CZ-CG2 3.43Å; Y131-V135 PolarHBondContact O-N 2.94Å; Y131-V135 VanDerWaalsContact O-N 3.15Å; Y131-V135 WeakPolarHBondContact OH-CG2 3.42Å; S132-V135 CarbonylContact O-C 3.29Å; S132-V135 WeakPolarHBondContact O-CA 3.48Å; S132-V135 WeakPolarHBondContact O-CB 3.22Å; S132-V135 PolarHBondContact O-N 2.94Å; V135-D139 WeakPolarHBondContact O-CA 3.48Å; V135-D139 WeakPolarHBondContact O-CB 3.39Å; V135-D139 PolarHBondContact O-N 2.8Å
136	E	87.8	Confident	89.2	Confident	141 Å²	141	49.6 Å²	49.6	66%	0.659	25%	0.245	S	C	*	.	H	α-helix	trans	-61.7	-47.7	179.1	-70.6	152.7	-160.5	0	0	112.5	S132 T133	S132-E136 WeakPolarHBondContact O-CG 3.19Å; S132-E136 PolarHBondContact O-N 3.41Å; T133-E136 WeakPolarHBondContact CA-OE2 3.36Å; T133-E136 PolarHBondContact O-N 2.84Å
137	D	88.5	Confident	89.6	Confident	57 Å²	57	44.8 Å²	44.8	31%	0.305	22%	0.221	S	C	.	.	H	α-helix	trans	-72.5	-36.1	-178.7	-78.3	-44.8	0	0	0	113.1	K127 Y128 T133 R141	K127-D137 IonicContact NZ-OD1 3.42Å; K127-D137 PolarHBondContact NZ-OD1 3.44Å; K127-D137 IonicContact NZ-OD2 2.62Å; K127-D137 PolarHBondContact NZ-OD2 3.11Å; Y128-D137 HydrophobicContact CE1-CB 4.42Å; Y128-D137 VanDerWaalsContact CE1-OD2 3.22Å; Y128-D137 WeakPolarHBondContact CE1-OD2 3.38Å; T133-D137 WeakPolarHBondContact O-CB 3.41Å; T133-D137 PolarHBondContact O-N 3.18Å; D137-R141 PolarHBondContact O-NH2 3.14Å
138	F	89.5	Confident	89.7	Confident	23 Å²	23	40.7 Å²	40.7	10%	0.101	20%	0.204	C	C	.	.	H	α-helix	trans	-122	-36.6	-167.8	-54.4	-73.6	0	0	0	116	V76 L122 Y128 V134 R141 L142	V76-F138 HydrophobicContact CG1-CD1 4.49Å; V76-F138 HydrophobicContact CG2-CD1 3.45Å; V76-F138 VanDerWaalsContact CG2-CD1 3.45Å; V76-F138 HydrophobicContact CG2-CE1 3.66Å; V76-F138 HydrophobicContact CG2-CG 4.37Å; L122-F138 HydrophobicContact CD2-CD2 4.34Å; L122-F138 HydrophobicContact CD2-CE2 3.64Å; L122-F138 HydrophobicContact CD2-CZ 4.36Å; L122-F138 HydrophobicContact CG-CE2 4.48Å; Y128-F138 HydrophobicContact CD1-CE2 4.03Å; Y128-F138 AromaticContact CE1-CE2 3.49Å; Y128-F138 HydrophobicContact CE1-CE2 3.49Å; Y128-F138 VanDerWaalsContact CE1-CE2 3.49Å; Y128-F138 AromaticContact CE1-CZ 3.95Å; Y128-F138 HydrophobicContact CE1-CZ 3.95Å; V134-F138 HydrophobicContact CG1-CD2 4.28Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.31Å; F138-R141 WeakPolarHBondContact O-CB 3.23Å; F138-R141 WeakPolarHBondContact O-CG 3.42Å; F138-R141 PolarHBondContact O-N 3.23Å; F138-R141 PolarHBondContact O-NE 3.41Å; F138-L142 HydrophobicContact CB-CB 3.76Å; F138-L142 HydrophobicContact CG-CB 4.5Å
139	D	87.3	Confident	89.7	Confident	89 Å²	89	44.3 Å²	44.3	48%	0.476	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	46.6	-143.5	-174.1	-171	47.2	0	0	0	113.7	V135 R141 L142	V135-D139 WeakPolarHBondContact O-CA 3.48Å; V135-D139 WeakPolarHBondContact O-CB 3.39Å; V135-D139 PolarHBondContact O-N 2.8Å; D139-R141 PolarHBondContact O-N 3.3Å; D139-L142 PolarHBondContact O-N 3.07Å
140	D	88.3	Confident	89.9	Confident	7 Å²	7	42.7 Å²	42.7	4%	0.037	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-69.3	12.5	178.9	-98.2	-34.2	0	0	0	113.5	T36 N38 R81	T36-D140 WeakPolarHBondContact CB-OD1 3.48Å; T36-D140 WeakPolarHBondContact CG2-OD1 2.98Å; T36-D140 PolarHBondContact OG1-OD1 3.17Å; N38-D140 VanDerWaalsContact CB-OD1 3.29Å; N38-D140 WeakPolarHBondContact CB-OD1 3.32Å; N38-D140 WeakPolarHBondContact CB-OD2 3.15Å; N38-D140 PolarHBondContact ND2-OD2 3.37Å; R81-D140 PolarHBondContact N-O 2.83Å
141	R	91.4	Very high	90.1	Very high	106 Å²	106	38.4 Å²	38.4	40%	0.4	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-84.7	-21.1	162.3	-52.6	179.3	-72.3	-169.6	-0	112.7	V76 L77 A80 D137 F138 D139	V76-R141 HydrophobicContact CG1-CB 4.28Å; L77-R141 PolarHBondContact N-O 3.19Å; A80-R141 HydrophobicContact CB-CG 3.77Å; D137-R141 PolarHBondContact O-NH2 3.14Å; F138-R141 WeakPolarHBondContact O-CB 3.23Å; F138-R141 WeakPolarHBondContact O-CG 3.42Å; F138-R141 PolarHBondContact O-N 3.23Å; F138-R141 PolarHBondContact O-NE 3.41Å; D139-R141 PolarHBondContact O-N 3.3Å
142	L	93.1	Very high	90.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	126.8	179	-175.2	60.9	0	0	0	111.1	T36 L37 W63 F74 V76 V118 L122 V134 F138 D139	T36-L142 WeakPolarHBondContact CA-O 3.42Å; L37-L142 HydrophobicContact CD1-CD2 4.03Å; W63-L142 HydrophobicContact CH2-CD2 4.45Å; F74-L142 HydrophobicContact CB-CD1 4.25Å; V76-L142 HydrophobicContact CG2-CD1 4.41Å; V118-L142 HydrophobicContact CG2-CD1 4.12Å; L122-L142 HydrophobicContact CD1-CD1 3.84Å; L122-L142 HydrophobicContact CD1-CD2 4.19Å; V134-L142 HydrophobicContact CG1-CD2 3.48Å; V134-L142 VanDerWaalsContact CG1-CD2 3.48Å; F138-L142 HydrophobicContact CB-CB 3.76Å; F138-L142 HydrophobicContact CG-CB 4.5Å; D139-L142 PolarHBondContact O-N 3.07Å
143	V	93.1	Very high	90.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.5	-179.2	175.4	0	0	0	0	110.5	E33 I35 T36 F75 L77 V145	E33-V143 WeakPolarHBondContact O-CG1 3.47Å; I35-V143 WeakPolarHBondContact O-CA 3.46Å; T36-V143 HydrophobicContact CG2-CG2 4.19Å; F75-V143 PolarHBondContact N-O 3.49Å; F75-V143 PolarHBondContact O-N 3.41Å; L77-V143 HydrophobicContact CD1-CG2 3.69Å; L77-V143 HydrophobicContact CD2-CG2 4.27Å; L77-V143 HydrophobicContact CG-CG2 3.82Å; V143-V145 HydrophobicContact CG1-CG2 4Å
144	V	94	Very high	90.5	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	124.5	174.4	-164.4	0	0	0	0	109.3	V27 G34 I35 L37 L72 F74	V27-V144 HydrophobicContact CG1-CB 4.22Å; V27-V144 HydrophobicContact CG1-CG1 3.92Å; G34-V144 CarbonylContact C-O 3.58Å; G34-V144 WeakPolarHBondContact CA-O 3.4Å; I35-V144 HydrophobicContact CG2-CB 4.27Å; I35-V144 PolarHBondContact N-O 2.86Å; I35-V144 PolarHBondContact O-N 3.45Å; L37-V144 HydrophobicContact CD2-CG2 4.48Å; L72-V144 HydrophobicContact CB-CG1 4.15Å; L72-V144 HydrophobicContact CD1-CG1 3.93Å; L72-V144 HydrophobicContact CD2-CG1 4.41Å; L72-V144 HydrophobicContact CG-CG1 4.39Å; F74-V144 HydrophobicContact CD1-CB 4.48Å; F74-V144 HydrophobicContact CD1-CG1 4.17Å; F74-V144 HydrophobicContact CD1-CG2 3.93Å; F74-V144 HydrophobicContact CE1-CB 4.49Å; F74-V144 HydrophobicContact CE1-CG1 3.87Å; F74-V144 HydrophobicContact CE1-CG2 3.92Å
145	V	94.3	Very high	90.5	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.1	-179.5	-176.5	0	0	0	0	109.3	L72 Q73 F75 V143	L72-V145 WeakPolarHBondContact CA-O 3.45Å; Q73-V145 PolarHBondContact N-O 3.07Å; Q73-V145 PolarHBondContact O-N 3.22Å; F75-V145 HydrophobicContact CD2-CB 4.22Å; F75-V145 HydrophobicContact CD2-CG2 3.64Å; F75-V145 HydrophobicContact CE2-CB 3.99Å; F75-V145 HydrophobicContact CE2-CG2 3.85Å; V143-V145 HydrophobicContact CG1-CG2 4Å
146	A	93.8	Very high	90.5	Very high	3 Å²	3	35.7 Å²	35.7	3%	0.025	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	152.4	172.5	0	0	0	0	0	112.5	V27 A28 L72 W150 R151	V27-A146 HydrophobicContact CG1-CB 4.27Å; A28-A146 HydrophobicContact CB-CB 4.04Å; L72-A146 HydrophobicContact CD2-CB 3.83Å; A146-W150 HydrophobicContact CB-CB 4.23Å; A146-R151 HydrophobicContact CB-CG 4.06Å; A146-R151 WeakPolarHBondContact O-CD 3.46Å; A146-R151 PolarHBondContact O-NE 3.39Å
147	S	91.9	Very high	90.2	Very high	25 Å²	25	30 Å²	30	18%	0.175	15%	0.146	C	C	.	.			trans	-55.8	156	176.2	89.3	0	0	0	0	112.2	H71 E149 W150 R151	H71-S147 PolarHBondContact O-N 3.27Å; S147-E149 PolarHBondContact O-N 2.85Å; S147-E149 VanDerWaalsContact O-N 3.16Å; S147-W150 PolarHBondContact O-N 3.24Å; S147-W150 VanDerWaalsContact O-N 3.14Å; S147-R151 PolarHBondContact O-N 3.17Å
148	Q	89.7	Confident	89.6	Confident	25 Å²	25	33.7 Å²	33.7	12%	0.117	17%	0.173	C	C	.	.	H	α-helix	trans	-53.1	-38.2	-180	-176.7	64.5	51.9	0	0	112.4	G104 Y106 T152 L166 Y177	G104-Q148 WeakPolarHBondContact O-CG 3.25Å; Y106-Q148 HydrophobicContact CD2-CG 4.28Å; Y106-Q148 PolarHBondContact O-OE1 3.29Å; Q148-T152 PolarHBondContact NE2-OG1 2.88Å; Q148-T152 VanDerWaalsContact O-CB 3.25Å; Q148-T152 WeakPolarHBondContact O-CB 3.24Å; Q148-T152 PolarHBondContact O-N 3.02Å; Q148-T152 PolarHBondContact O-OG1 3.43Å; Q148-L166 HydrophobicContact CG-CD2 4.3Å; Q148-Y177 PolarHBondContact NE2-OH 2.75Å; Q148-Y177 VanDerWaalsContact NE2-OH 3.12Å
149	E	88.3	Confident	88.7	Confident	102 Å²	102	34.5 Å²	34.5	48%	0.477	19%	0.185	S	C	.	.	H	α-helix	trans	-63.8	-48.5	179	-58.2	176.2	132.1	0	0	111.9	S147 T152 K153 V162	S147-E149 PolarHBondContact O-N 2.85Å; S147-E149 VanDerWaalsContact O-N 3.16Å; E149-T152 PolarHBondContact O-N 3.49Å; E149-K153 VanDerWaalsContact O-CB 3.3Å; E149-K153 WeakPolarHBondContact O-CB 3.15Å; E149-K153 PolarHBondContact O-N 2.76Å; E149-V162 HydrophobicContact CB-CG1 4.41Å
150	W	90.6	Very high	88.2	Confident	62 Å²	62	32.1 Å²	32.1	24%	0.235	17%	0.171	C	C	.	.	H	α-helix	trans	-68.7	-40.1	-178.9	-79.9	88.3	0	0	0	112	A28 H71 A146 S147 T152 K153 A154	A28-W150 HydrophobicContact CB-CB 4.41Å; H71-W150 HydrophobicContact CB-CG 4.48Å; H71-W150 AromaticContact CD2-CE2 3.95Å; H71-W150 AromaticContact CD2-NE1 3.25Å; H71-W150 PolarHBondContact CD2-NE1 3.38Å; H71-W150 AromaticContact CE1-NE1 3.73Å; H71-W150 AromaticContact CG-CD1 3.62Å; H71-W150 AromaticContact CG-NE1 3.23Å; H71-W150 AromaticContact ND1-CD1 3.85Å; H71-W150 AromaticContact ND1-NE1 3.54Å; H71-W150 AromaticContact NE2-NE1 3.56Å; A146-W150 HydrophobicContact CB-CB 4.23Å; S147-W150 PolarHBondContact O-N 3.24Å; S147-W150 VanDerWaalsContact O-N 3.14Å; W150-T152 VanDerWaalsContact C-N 3.31Å; W150-T152 PolarHBondContact O-N 3.37Å; W150-K153 HydrophobicContact CD2-CD 4.46Å; W150-K153 HydrophobicContact CE3-CD 4.1Å; W150-K153 HydrophobicContact CZ3-CD 4.31Å; W150-K153 WeakPolarHBondContact O-CB 3.44Å; W150-K153 PolarHBondContact O-N 2.95Å; W150-A154 WeakPolarHBondContact O-CB 3.44Å; W150-A154 PolarHBondContact O-N 3.45Å
151	R	92.6	Very high	87.8	Confident	7 Å²	7	34.8 Å²	34.8	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-58.3	-43.8	170.6	-65.4	-169.4	-78.6	110.9	3.5	111.5	A28 G31 Y106 A146 S147 A154 I155 E181	A28-R151 WeakPolarHBondContact O-CG 3.29Å; G31-R151 VanDerWaalsContact O-CD 3.31Å; G31-R151 WeakPolarHBondContact O-CD 3.32Å; Y106-R151 PolarHBondContact O-NH1 3.15Å; A146-R151 HydrophobicContact CB-CG 4.06Å; A146-R151 WeakPolarHBondContact O-CD 3.46Å; A146-R151 PolarHBondContact O-NE 3.39Å; S147-R151 PolarHBondContact O-N 3.17Å; R151-A154 PolarHBondContact O-N 3.47Å; R151-I155 VanDerWaalsContact O-CG1 3.31Å; R151-I155 WeakPolarHBondContact O-CG1 3.11Å; R151-I155 PolarHBondContact O-N 3.49Å; R151-I155 VanDerWaalsContact O-N 3.15Å; R151-E181 IonicContact CZ-OE1 3.5Å; R151-E181 IonicContact NH1-OE1 2.65Å; R151-E181 PolarHBondContact NH1-OE1 3.12Å
152	T	90	Very high	87.3	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-43.8	178.9	-56	0	0	0	0	111.6	Q148 E149 W150 A154 I155 I156 V162 F165 L166 Y177	Q148-T152 PolarHBondContact NE2-OG1 2.88Å; Q148-T152 VanDerWaalsContact O-CB 3.25Å; Q148-T152 WeakPolarHBondContact O-CB 3.24Å; Q148-T152 PolarHBondContact O-N 3.02Å; Q148-T152 PolarHBondContact O-OG1 3.43Å; E149-T152 PolarHBondContact O-N 3.49Å; W150-T152 VanDerWaalsContact C-N 3.31Å; W150-T152 PolarHBondContact O-N 3.37Å; T152-A154 VanDerWaalsContact C-N 3.34Å; T152-A154 PolarHBondContact O-N 2.74Å; T152-I155 PolarHBondContact O-N 2.71Å; T152-I156 HydrophobicContact CG2-CD1 3.52Å; T152-I156 HydrophobicContact CG2-CG1 4.43Å; T152-I156 WeakPolarHBondContact O-CD1 3.46Å; T152-I156 VanDerWaalsContact O-CG1 3.31Å; T152-I156 WeakPolarHBondContact O-CG1 3.23Å; T152-I156 PolarHBondContact O-N 2.75Å; T152-I156 VanDerWaalsContact O-N 3.09Å; T152-V162 HydrophobicContact CG2-CG1 3.92Å; T152-F165 HydrophobicContact CG2-CD1 3.73Å; T152-F165 HydrophobicContact CG2-CE1 4.32Å; T152-F165 HydrophobicContact CG2-CG 4.48Å; T152-L166 HydrophobicContact CG2-CD2 3.94Å; T152-L166 HydrophobicContact CG2-CG 4.26Å; T152-Y177 PolarHBondContact N-OH 3.4Å; T152-Y177 PolarHBondContact OG1-OH 2.87Å; T152-Y177 VanDerWaalsContact OG1-OH 3.12Å
153	K	89.2	Confident	86.5	Confident	84 Å²	84	35.7 Å²	35.7	37%	0.365	20%	0.201	S	C	.	.	H	α-helix	trans	-56.5	-45	174.6	-172	-178.9	177.1	-176.3	0	111.8	E149 W150 G157 V162	E149-K153 VanDerWaalsContact O-CB 3.3Å; E149-K153 WeakPolarHBondContact O-CB 3.15Å; E149-K153 PolarHBondContact O-N 2.76Å; W150-K153 HydrophobicContact CD2-CD 4.46Å; W150-K153 HydrophobicContact CE3-CD 4.1Å; W150-K153 HydrophobicContact CZ3-CD 4.31Å; W150-K153 WeakPolarHBondContact O-CB 3.44Å; W150-K153 PolarHBondContact O-N 2.95Å; K153-G157 PolarHBondContact O-N 3.02Å; K153-V162 HydrophobicContact CB-CG2 3.67Å; K153-V162 HydrophobicContact CG-CG2 4.11Å
154	A	90.4	Very high	85.7	Confident	5 Å²	5	38.5 Å²	38.5	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-69.6	-34.6	-179.3	0	0	0	0	0	113	A28 L29 W150 R151 T152 R247	A28-A154 HydrophobicContact CB-CB 3.78Å; L29-A154 HydrophobicContact CD2-CB 3.73Å; L29-A154 HydrophobicContact CG-CB 3.84Å; W150-A154 WeakPolarHBondContact O-CB 3.44Å; W150-A154 PolarHBondContact O-N 3.45Å; R151-A154 PolarHBondContact O-N 3.47Å; T152-A154 VanDerWaalsContact C-N 3.34Å; T152-A154 PolarHBondContact O-N 2.74Å; A154-R247 WeakPolarHBondContact O-CD 3.48Å; A154-R247 PolarHBondContact O-NH1 3.07Å
155	I	90.1	Very high	85.1	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-46.1	175.9	-71.2	168.9	0	0	0	112	R151 T152 Y177 L180 E181 A184 L245	R151-I155 VanDerWaalsContact O-CG1 3.31Å; R151-I155 WeakPolarHBondContact O-CG1 3.11Å; R151-I155 PolarHBondContact O-N 3.49Å; R151-I155 VanDerWaalsContact O-N 3.15Å; T152-I155 PolarHBondContact O-N 2.71Å; I155-Y177 HydrophobicContact CD1-CE1 4.32Å; I155-Y177 HydrophobicContact CD1-CE2 4.15Å; I155-Y177 WeakPolarHBondContact CD1-OH 3.24Å; I155-L180 HydrophobicContact CD1-CB 4.5Å; I155-L180 HydrophobicContact CG2-CB 3.96Å; I155-L180 HydrophobicContact CG2-CD1 4.2Å; I155-L180 HydrophobicContact CG2-CD2 4.45Å; I155-L180 HydrophobicContact CG2-CG 4.45Å; I155-E181 HydrophobicContact CD1-CG 3.91Å; I155-A184 HydrophobicContact CG1-CB 3.94Å; I155-L245 HydrophobicContact CG2-CD2 4.34Å
156	I	86.4	Confident	84.1	Confident	7 Å²	7	40.1 Å²	40.1	4%	0.036	23%	0.227	C	C	.	.	H	α-helix	trans	-79.5	-37.5	-174.4	-58.7	161.7	0	0	0	111.5	T152 A159 I160 F165 V222	T152-I156 HydrophobicContact CG2-CD1 3.52Å; T152-I156 HydrophobicContact CG2-CG1 4.43Å; T152-I156 WeakPolarHBondContact O-CD1 3.46Å; T152-I156 VanDerWaalsContact O-CG1 3.31Å; T152-I156 WeakPolarHBondContact O-CG1 3.23Å; T152-I156 PolarHBondContact O-N 2.75Å; T152-I156 VanDerWaalsContact O-N 3.09Å; I156-A159 HydrophobicContact CG2-CB 4.16Å; I156-I160 HydrophobicContact CG2-CB 3.79Å; I156-I160 HydrophobicContact CG2-CG1 3.99Å; I156-I160 WeakPolarHBondContact CG2-O 3.37Å; I156-F165 HydrophobicContact CD1-CB 3.37Å; I156-F165 HydrophobicContact CD1-CD1 3.8Å; I156-F165 HydrophobicContact CD1-CD2 3.82Å; I156-F165 HydrophobicContact CD1-CG 3.4Å; I156-F165 HydrophobicContact CG1-CB 4.48Å; I156-F165 HydrophobicContact CG1-CD1 4.45Å; I156-F165 HydrophobicContact CG1-CD2 4.05Å; I156-F165 HydrophobicContact CG1-CE2 4.37Å; I156-F165 HydrophobicContact CG1-CG 4.1Å; I156-V222 HydrophobicContact CG2-CG2 4.2Å
157	G	80.9	Confident	83	Confident	21 Å²	21	45 Å²	45	22%	0.216	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	61.8	-144.8	-165.4	0	0	0	0	0	111.2	K153 A159	K153-G157 PolarHBondContact O-N 3.02Å; G157-A159 VanDerWaalsContact C-N 3.25Å; G157-A159 PolarHBondContact O-N 3.21Å
158	P	77	Confident	81.6	Confident	134 Å²	134	46.8 Å²	46.8	87%	0.87	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-77.7	-2.4	-176.5	32.8	-36.5	0	0	0	114.4	I160	P158-I160 PolarHBondContact O-N 2.83Å
159	A	70.3	Confident	80.3	Confident	41 Å²	41	45.8 Å²	45.8	34%	0.339	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-69.6	-28.3	-168.2	0	0	0	0	0	114.6	I156 G157 V222	I156-A159 HydrophobicContact CG2-CB 4.16Å; G157-A159 VanDerWaalsContact C-N 3.25Å; G157-A159 PolarHBondContact O-N 3.21Å; A159-V222 HydrophobicContact CB-CG2 4.2Å
160	I	76.8	Confident	78.9	Confident	39 Å²	39	41.4 Å²	41.4	20%	0.2	23%	0.23	C	C	.	.	S	Bend	trans	-152.8	146.1	-178.1	-38.7	176.3	0	0	0	108.9	I156 P158 V164 F165 M220 V222	I156-I160 HydrophobicContact CG2-CB 3.79Å; I156-I160 HydrophobicContact CG2-CG1 3.99Å; I156-I160 WeakPolarHBondContact CG2-O 3.37Å; P158-I160 PolarHBondContact O-N 2.83Å; I160-V164 HydrophobicContact CG2-CB 4.21Å; I160-V164 HydrophobicContact CG2-CG1 4Å; I160-F165 HydrophobicContact CD1-CD2 4.14Å; I160-M220 HydrophobicContact CD1-CB 4.35Å; I160-M220 HydrophobicContact CD1-CE 3.44Å; I160-M220 VanDerWaalsContact CD1-CE 3.44Å; I160-V222 HydrophobicContact CD1-CG2 4.2Å
161	S	79.6	Confident	77.2	Confident	62 Å²	62	45 Å²	45	43%	0.434	25%	0.249	S	C	.	.			trans	-58	138.2	166.9	168.9	0	0	0	0	111.6	Q163 V164 F165	S161-Q163 PolarHBondContact O-N 3.48Å; S161-V164 PolarHBondContact O-N 3.05Å; S161-F165 PolarHBondContact O-N 2.7Å
162	V	81.6	Confident	75.5	Confident	33 Å²	33	47.6 Å²	47.6	20%	0.2	26%	0.262	C	S	.	.	H	α-helix	trans	-56	-52.5	178.9	174.2	0	0	0	0	110.8	E149 T152 K153 V164 F165 L166	E149-V162 HydrophobicContact CB-CG1 4.41Å; T152-V162 HydrophobicContact CG2-CG1 3.92Å; K153-V162 HydrophobicContact CB-CG2 3.67Å; K153-V162 HydrophobicContact CG-CG2 4.11Å; V162-V164 PolarHBondContact O-N 2.94Å; V162-F165 PolarHBondContact O-N 2.96Å; V162-F165 VanDerWaalsContact O-N 3.13Å; V162-L166 HydrophobicContact CG1-CD1 4.04Å; V162-L166 HydrophobicContact CG1-CG 4.34Å; V162-L166 WeakPolarHBondContact O-CG 3.37Å; V162-L166 PolarHBondContact O-N 3.09Å
163	Q	77.2	Confident	74.3	Confident	92 Å²	92	52.6 Å²	52.6	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-53.5	-50.4	176.4	-85.5	172.2	-26	0	0	111.8	S161 F165 L166 R167 E1109	S161-Q163 PolarHBondContact O-N 3.48Å; Q163-F165 VanDerWaalsContact C-N 3.31Å; Q163-F165 PolarHBondContact O-N 3.19Å; Q163-L166 PolarHBondContact O-N 2.93Å; Q163-R167 WeakPolarHBondContact O-CB 3.37Å; Q163-R167 WeakPolarHBondContact O-CG 3.31Å; Q163-R167 PolarHBondContact O-N 3.46Å; Q163-E1109 WeakPolarHBondContact CB-OE2 3.12Å
164	V	76.3	Confident	73.8	Confident	60 Å²	60	51 Å²	51	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-59.2	-41.2	177.8	175.8	0	0	0	0	111.5	I160 S161 V162 R167 T168	I160-V164 HydrophobicContact CG2-CB 4.21Å; I160-V164 HydrophobicContact CG2-CG1 4Å; S161-V164 PolarHBondContact O-N 3.05Å; V162-V164 PolarHBondContact O-N 2.94Å; V164-R167 PolarHBondContact O-N 2.84Å; V164-T168 HydrophobicContact CG1-CG2 4.35Å; V164-T168 WeakPolarHBondContact O-CB 3.39Å; V164-T168 WeakPolarHBondContact O-CG2 3.47Å; V164-T168 PolarHBondContact O-N 3.23Å; V164-T168 PolarHBondContact O-OG1 3.22Å
165	F	79.8	Confident	73.6	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-68.1	-45.9	177.8	-177.1	-87.5	0	0	0	112.5	T152 I156 I160 S161 V162 Q163 R167 T168 C169 I170 Y177 L180 Y217	T152-F165 HydrophobicContact CG2-CD1 3.73Å; T152-F165 HydrophobicContact CG2-CE1 4.32Å; T152-F165 HydrophobicContact CG2-CG 4.48Å; I156-F165 HydrophobicContact CD1-CB 3.37Å; I156-F165 HydrophobicContact CD1-CD1 3.8Å; I156-F165 HydrophobicContact CD1-CD2 3.82Å; I156-F165 HydrophobicContact CD1-CG 3.4Å; I156-F165 HydrophobicContact CG1-CB 4.48Å; I156-F165 HydrophobicContact CG1-CD1 4.45Å; I156-F165 HydrophobicContact CG1-CD2 4.05Å; I156-F165 HydrophobicContact CG1-CE2 4.37Å; I156-F165 HydrophobicContact CG1-CG 4.1Å; I160-F165 HydrophobicContact CD1-CD2 4.14Å; S161-F165 PolarHBondContact O-N 2.7Å; V162-F165 PolarHBondContact O-N 2.96Å; V162-F165 VanDerWaalsContact O-N 3.13Å; Q163-F165 VanDerWaalsContact C-N 3.31Å; Q163-F165 PolarHBondContact O-N 3.19Å; F165-R167 PolarHBondContact O-N 2.94Å; F165-T168 PolarHBondContact O-N 2.92Å; F165-C169 HydrophobicContact CD1-CB 4.39Å; F165-C169 HydrophobicContact CD2-CB 3.61Å; F165-C169 HydrophobicContact CE1-CB 4.47Å; F165-C169 HydrophobicContact CE2-CB 3.72Å; F165-C169 HydrophobicContact CG-CB 3.97Å; F165-C169 HydrophobicContact CZ-CB 4.15Å; F165-C169 WeakPolarHBondContact O-CA 3.25Å; F165-C169 VanDerWaalsContact O-CB 3.3Å; F165-C169 WeakPolarHBondContact O-CB 3.21Å; F165-C169 PolarHBondContact O-N 3.3Å; F165-I170 HydrophobicContact CD1-CD1 4.16Å; F165-I170 HydrophobicContact CD1-CG1 3.93Å; F165-I170 HydrophobicContact CE1-CD1 3.98Å; F165-I170 HydrophobicContact CE1-CG1 3.66Å; F165-I170 PolarHBondContact O-N 3.39Å; F165-Y177 HydrophobicContact CE1-CD2 4.09Å; F165-Y177 HydrophobicContact CE1-CE2 4.19Å; F165-L180 HydrophobicContact CE2-CD1 4.39Å; F165-L180 HydrophobicContact CZ-CD1 3.66Å; F165-Y217 AromaticContact CE2-CE1 3.85Å; F165-Y217 HydrophobicContact CE2-CE1 3.85Å; F165-Y217 HydrophobicContact CZ-CE1 4.24Å
166	L	74.5	Confident	73.4	Confident	37 Å²	37	52.9 Å²	52.9	19%	0.194	30%	0.296	C	S	.	.	H	α-helix	trans	-54.9	-42.2	174.9	-66.3	177.2	0	0	0	110.9	Q148 T152 V162 Q163 I170	Q148-L166 HydrophobicContact CG-CD2 4.3Å; T152-L166 HydrophobicContact CG2-CD2 3.94Å; T152-L166 HydrophobicContact CG2-CG 4.26Å; V162-L166 HydrophobicContact CG1-CD1 4.04Å; V162-L166 HydrophobicContact CG1-CG 4.34Å; V162-L166 WeakPolarHBondContact O-CG 3.37Å; V162-L166 PolarHBondContact O-N 3.09Å; Q163-L166 PolarHBondContact O-N 2.93Å; L166-I170 HydrophobicContact CD2-CD1 3.53Å
167	R	70	Confident	73.5	Confident	104 Å²	104	52.8 Å²	52.8	39%	0.392	30%	0.295	S	S	.	.	H	α-helix	trans	-91	-9.7	-176.1	-65.3	-161.8	-175.8	-137.6	7.2	117.7	Q163 V164 F165 H171 E1107 K1108 E1109	Q163-R167 WeakPolarHBondContact O-CB 3.37Å; Q163-R167 WeakPolarHBondContact O-CG 3.31Å; Q163-R167 PolarHBondContact O-N 3.46Å; V164-R167 PolarHBondContact O-N 2.84Å; F165-R167 PolarHBondContact O-N 2.94Å; R167-H171 PolarHBondContact O-CD2 3.07Å; R167-H171 VanDerWaalsContact O-CD2 3.23Å; R167-H171 PolarHBondContact O-NE2 2.85Å; R167-H171 VanDerWaalsContact O-NE2 3.09Å; R167-E1107 PolarHBondContact NH1-O 3.07Å; R167-K1108 PolarHBondContact NH1-O 3.26Å; R167-K1108 PolarHBondContact NH2-O 2.92Å; R167-E1109 WeakPolarHBondContact CD-OE2 3.11Å; R167-E1109 IonicContact CZ-OE1 3.86Å; R167-E1109 IonicContact CZ-OE2 3.56Å; R167-E1109 IonicContact NE-OE1 3.07Å; R167-E1109 PolarHBondContact NE-OE1 3.07Å; R167-E1109 IonicContact NE-OE2 3.13Å; R167-E1109 PolarHBondContact NE-OE2 3.42Å; R167-E1109 IonicContact NH2-OE1 2.98Å; R167-E1109 PolarHBondContact NH2-OE1 3.09Å; R167-E1109 IonicContact NH2-OE2 3.63Å
168	T	62.6	Low	73.8	Confident	63 Å²	63	51.8 Å²	51.8	39%	0.387	29%	0.285	S	S	.	.	H	α-helix	trans	-128.9	-17.7	-178	68	0	0	0	0	114.4	V164 F165	V164-T168 HydrophobicContact CG1-CG2 4.35Å; V164-T168 WeakPolarHBondContact O-CB 3.39Å; V164-T168 WeakPolarHBondContact O-CG2 3.47Å; V164-T168 PolarHBondContact O-N 3.23Å; V164-T168 PolarHBondContact O-OG1 3.22Å; F165-T168 PolarHBondContact O-N 2.92Å
169	C	62.7	Low	74.4	Confident	4 Å²	4	45.6 Å²	45.6	3%	0.027	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-36.5	-174.6	-63.7	0	0	0	0	113.3	F165	F165-C169 HydrophobicContact CD1-CB 4.39Å; F165-C169 HydrophobicContact CD2-CB 3.61Å; F165-C169 HydrophobicContact CE1-CB 4.47Å; F165-C169 HydrophobicContact CE2-CB 3.72Å; F165-C169 HydrophobicContact CG-CB 3.97Å; F165-C169 HydrophobicContact CZ-CB 4.15Å; F165-C169 WeakPolarHBondContact O-CA 3.25Å; F165-C169 VanDerWaalsContact O-CB 3.3Å; F165-C169 WeakPolarHBondContact O-CB 3.21Å; F165-C169 PolarHBondContact O-N 3.3Å
170	I	59.5	Low	75.4	Confident	11 Å²	11	43.7 Å²	43.7	6%	0.056	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-72.8	-28.7	-174.4	-68.2	-167.1	0	0	0	113.8	Y106 F165 L166 M172 L173 Y177	Y106-I170 HydrophobicContact CD1-CG2 3.67Å; Y106-I170 HydrophobicContact CD2-CD1 3.83Å; Y106-I170 HydrophobicContact CD2-CG2 3.95Å; Y106-I170 HydrophobicContact CE1-CG2 3.52Å; Y106-I170 HydrophobicContact CE2-CD1 4.22Å; Y106-I170 HydrophobicContact CE2-CG2 3.8Å; Y106-I170 HydrophobicContact CG-CD1 4.27Å; Y106-I170 HydrophobicContact CG-CG2 3.89Å; F165-I170 HydrophobicContact CD1-CD1 4.16Å; F165-I170 HydrophobicContact CD1-CG1 3.93Å; F165-I170 HydrophobicContact CE1-CD1 3.98Å; F165-I170 HydrophobicContact CE1-CG1 3.66Å; F165-I170 PolarHBondContact O-N 3.39Å; L166-I170 HydrophobicContact CD2-CD1 3.53Å; I170-M172 PolarHBondContact O-N 3.37Å; I170-L173 PolarHBondContact O-N 2.79Å; I170-Y177 HydrophobicContact CD1-CD2 3.5Å; I170-Y177 VanDerWaalsContact CD1-CD2 3.5Å; I170-Y177 HydrophobicContact CD1-CE2 3.87Å; I170-Y177 HydrophobicContact CD1-CG 4.3Å; I170-Y177 HydrophobicContact CG1-CD2 4.11Å
171	H	53.3	Low	76	Confident	138 Å²	138	41.9 Å²	41.9	64%	0.639	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-60.5	-1.1	178.8	-52.2	-48.1	0	0	0	115.2	R167	R167-H171 PolarHBondContact O-CD2 3.07Å; R167-H171 VanDerWaalsContact O-CD2 3.23Å; R167-H171 PolarHBondContact O-NE2 2.85Å; R167-H171 VanDerWaalsContact O-NE2 3.09Å
172	M	56.9	Low	76.5	Confident	61 Å²	61	40.1 Å²	40.1	30%	0.3	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-84.9	-15.8	-177.8	-71.4	-68.4	-53.8	0	0	115.6	I170 H176	I170-M172 PolarHBondContact O-N 3.37Å; M172-H176 PolarHBondContact O-CE1 3.36Å; M172-H176 VanDerWaalsContact O-CE1 3.22Å; M172-H176 PolarHBondContact O-ND1 2.96Å
173	L	66.4	Low	76.9	Confident	105 Å²	105	38.8 Å²	38.8	55%	0.55	20%	0.195	S	C	.	.			trans	148.6	137.8	167.6	-86.5	156.5	0	0	0	109.6	I170 V175 H176	I170-L173 PolarHBondContact O-N 2.79Å; L173-V175 HydrophobicContact CB-CG1 4.03Å; L173-V175 PolarHBondContact O-N 3.17Å; L173-V175 VanDerWaalsContact O-N 3.13Å; L173-H176 WeakPolarHBondContact O-CB 3.42Å; L173-H176 PolarHBondContact O-N 3.39Å
174	P	77.5	Confident	77.5	Confident	51 Å²	51	34.4 Å²	34.4	33%	0.331	18%	0.175	S	C	.	.	H	α-helix	trans	-56.3	-31	179.5	-28.6	36.1	0	0	0	115.4	I98 H176 Y177 A178	I98-P174 HydrophobicContact CG2-CB 4.07Å; P174-H176 PolarHBondContact O-N 3.44Å; P174-Y177 PolarHBondContact O-N 2.87Å; P174-Y177 VanDerWaalsContact O-N 3.14Å; P174-A178 PolarHBondContact O-N 2.7Å
175	V	85.4	Confident	78.2	Confident	21 Å²	21	32 Å²	32	13%	0.127	16%	0.159	C	C	.	.	H	α-helix	trans	-58.2	-29.4	176.8	70	0	0	0	0	113	I98 L173 A178 M179 F203 V205	I98-V175 HydrophobicContact CD1-CB 3.79Å; I98-V175 HydrophobicContact CD1-CG2 3.62Å; L173-V175 HydrophobicContact CB-CG1 4.03Å; L173-V175 PolarHBondContact O-N 3.17Å; L173-V175 VanDerWaalsContact O-N 3.13Å; V175-A178 PolarHBondContact O-N 3.38Å; V175-M179 HydrophobicContact CG2-CE 4.16Å; V175-M179 WeakPolarHBondContact O-CB 3.39Å; V175-M179 WeakPolarHBondContact O-CG 3.5Å; V175-M179 PolarHBondContact O-N 2.67Å; V175-F203 HydrophobicContact CG2-CB 3.87Å; V175-F203 HydrophobicContact CG2-CD1 3.97Å; V175-F203 HydrophobicContact CG2-CG 4.12Å; V175-V205 HydrophobicContact CG1-CG2 4.49Å; V175-V205 HydrophobicContact CG2-CG2 3.93Å
176	H	86.4	Confident	78.5	Confident	26 Å²	26	32.5 Å²	32.5	12%	0.12	16%	0.162	C	C	.	.	H	α-helix	trans	-70	-35	179.6	-60	149.9	0	0	0	112.3	M172 L173 P174 L180 L213	M172-H176 PolarHBondContact O-CE1 3.36Å; M172-H176 VanDerWaalsContact O-CE1 3.22Å; M172-H176 PolarHBondContact O-ND1 2.96Å; L173-H176 WeakPolarHBondContact O-CB 3.42Å; L173-H176 PolarHBondContact O-N 3.39Å; P174-H176 PolarHBondContact O-N 3.44Å; H176-L180 PolarHBondContact O-N 2.85Å; H176-L180 VanDerWaalsContact O-N 3.17Å; H176-L213 HydrophobicContact CB-CD1 3.94Å; H176-L213 HydrophobicContact CB-CD2 4.06Å
177	Y	88.2	Confident	79.1	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-72.6	-42.5	175.1	-168.1	-89.5	0	0	0	110.9	Y106 Q148 T152 I155 F165 I170 P174 M179 L180 E181	Y106-Y177 WeakPolarHBondContact O-CD1 3.46Å; Y106-Y177 VanDerWaalsContact O-CE1 3.3Å; Y106-Y177 WeakPolarHBondContact O-CE1 3.25Å; Q148-Y177 PolarHBondContact NE2-OH 2.75Å; Q148-Y177 VanDerWaalsContact NE2-OH 3.12Å; T152-Y177 PolarHBondContact N-OH 3.4Å; T152-Y177 PolarHBondContact OG1-OH 2.87Å; T152-Y177 VanDerWaalsContact OG1-OH 3.12Å; I155-Y177 HydrophobicContact CD1-CE1 4.32Å; I155-Y177 HydrophobicContact CD1-CE2 4.15Å; I155-Y177 WeakPolarHBondContact CD1-OH 3.24Å; F165-Y177 HydrophobicContact CE1-CD2 4.09Å; F165-Y177 HydrophobicContact CE1-CE2 4.19Å; I170-Y177 HydrophobicContact CD1-CD2 3.5Å; I170-Y177 VanDerWaalsContact CD1-CD2 3.5Å; I170-Y177 HydrophobicContact CD1-CE2 3.87Å; I170-Y177 HydrophobicContact CD1-CG 4.3Å; I170-Y177 HydrophobicContact CG1-CD2 4.11Å; P174-Y177 PolarHBondContact O-N 2.87Å; P174-Y177 VanDerWaalsContact O-N 3.14Å; Y177-M179 VanDerWaalsContact C-N 3.28Å; Y177-M179 PolarHBondContact O-N 2.74Å; Y177-L180 WeakPolarHBondContact O-CB 3.47Å; Y177-L180 PolarHBondContact O-N 3.46Å; Y177-E181 HydrophobicContact CD1-CG 4.01Å; Y177-E181 HydrophobicContact CE1-CG 3.65Å; Y177-E181 WeakPolarHBondContact CE1-OE1 3.29Å; Y177-E181 PolarHBondContact O-N 2.86Å
178	A	88.7	Confident	79.5	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-60.2	-35	173.3	0	0	0	0	0	112.9	I98 P174 V175 R182 F203	I98-A178 HydrophobicContact CG1-CB 4.26Å; P174-A178 PolarHBondContact O-N 2.7Å; V175-A178 PolarHBondContact O-N 3.38Å; A178-R182 PolarHBondContact O-N 2.83Å; A178-F203 HydrophobicContact CB-CE1 3.72Å; A178-F203 HydrophobicContact CB-CZ 4.22Å; A178-F203 WeakPolarHBondContact O-CZ 3.23Å
179	M	89	Confident	80.2	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-39.7	170.6	-79.3	-179.8	177.4	0	0	112.9	V175 Y177 R182 I183 F203 V205 V210 L213	V175-M179 HydrophobicContact CG2-CE 4.16Å; V175-M179 WeakPolarHBondContact O-CB 3.39Å; V175-M179 WeakPolarHBondContact O-CG 3.5Å; V175-M179 PolarHBondContact O-N 2.67Å; Y177-M179 VanDerWaalsContact C-N 3.28Å; Y177-M179 PolarHBondContact O-N 2.74Å; M179-R182 PolarHBondContact O-N 3.27Å; M179-I183 VanDerWaalsContact O-CG1 3.31Å; M179-I183 WeakPolarHBondContact O-CG1 3.47Å; M179-I183 PolarHBondContact O-N 2.83Å; M179-I183 VanDerWaalsContact O-N 3.07Å; M179-F203 HydrophobicContact CB-CE2 4.32Å; M179-F203 HydrophobicContact CE-CB 3.55Å; M179-F203 HydrophobicContact CE-CD2 3.87Å; M179-F203 HydrophobicContact CE-CG 3.93Å; M179-F203 HydrophobicContact CG-CD2 3.48Å; M179-F203 VanDerWaalsContact CG-CD2 3.48Å; M179-F203 HydrophobicContact CG-CE2 3.65Å; M179-F203 HydrophobicContact CG-CG 3.99Å; M179-F203 HydrophobicContact CG-CZ 4.28Å; M179-V205 HydrophobicContact CE-CB 3.73Å; M179-V205 HydrophobicContact CE-CG1 4.18Å; M179-V205 HydrophobicContact CE-CG2 3.58Å; M179-V210 HydrophobicContact CE-CG2 3.81Å; M179-V210 HydrophobicContact SD-CG2 4.37Å; M179-L213 HydrophobicContact CB-CD2 4.41Å; M179-L213 HydrophobicContact SD-CD2 3.64Å
180	L	90	Very high	81	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-68.9	-40.1	175.9	-76.5	174.1	0	0	0	112.2	I155 F165 H176 Y177 R182 I183 A184 Y217 V222 L223	I155-L180 HydrophobicContact CD1-CB 4.5Å; I155-L180 HydrophobicContact CG2-CB 3.96Å; I155-L180 HydrophobicContact CG2-CD1 4.2Å; I155-L180 HydrophobicContact CG2-CD2 4.45Å; I155-L180 HydrophobicContact CG2-CG 4.45Å; F165-L180 HydrophobicContact CE2-CD1 4.39Å; F165-L180 HydrophobicContact CZ-CD1 3.66Å; H176-L180 PolarHBondContact O-N 2.85Å; H176-L180 VanDerWaalsContact O-N 3.17Å; Y177-L180 WeakPolarHBondContact O-CB 3.47Å; Y177-L180 PolarHBondContact O-N 3.46Å; L180-R182 PolarHBondContact O-N 3.18Å; L180-I183 PolarHBondContact O-N 3.48Å; L180-A184 WeakPolarHBondContact O-CB 3.36Å; L180-A184 PolarHBondContact O-N 2.69Å; L180-Y217 HydrophobicContact CD1-CD2 4.25Å; L180-Y217 HydrophobicContact CD1-CE1 4.13Å; L180-Y217 HydrophobicContact CD1-CE2 3.7Å; L180-Y217 HydrophobicContact CD2-CD2 3.82Å; L180-Y217 HydrophobicContact CD2-CE2 4.01Å; L180-Y217 HydrophobicContact CD2-CG 4.31Å; L180-Y217 HydrophobicContact CG-CD2 4.23Å; L180-Y217 HydrophobicContact CG-CE2 3.89Å; L180-V222 HydrophobicContact CD2-CG1 4.49Å; L180-L223 HydrophobicContact CD2-CD1 4.34Å; L180-L223 HydrophobicContact CD2-CD2 4.05Å; L180-L223 HydrophobicContact CD2-CG 4.35Å
181	E	90.3	Very high	82.1	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-57.5	-47.6	170.5	-72.6	-169.6	147.2	0	0	110.7	G31 L32 G107 S108 R151 I155 Y177 I183 A184 R185	G31-E181 WeakPolarHBondContact CA-OE1 3.31Å; L32-E181 PolarHBondContact N-OE1 3.47Å; L32-E181 PolarHBondContact N-OE2 2.97Å; G107-E181 WeakPolarHBondContact CA-OE2 3.46Å; S108-E181 PolarHBondContact N-OE2 3.1Å; S108-E181 VanDerWaalsContact N-OE2 3.09Å; R151-E181 IonicContact CZ-OE1 3.5Å; R151-E181 IonicContact NH1-OE1 2.65Å; R151-E181 PolarHBondContact NH1-OE1 3.12Å; I155-E181 HydrophobicContact CD1-CG 3.91Å; Y177-E181 HydrophobicContact CD1-CG 4.01Å; Y177-E181 HydrophobicContact CE1-CG 3.65Å; Y177-E181 WeakPolarHBondContact CE1-OE1 3.29Å; Y177-E181 PolarHBondContact O-N 2.86Å; E181-I183 VanDerWaalsContact C-N 3.27Å; E181-I183 PolarHBondContact O-N 2.88Å; E181-A184 CarbonylContact O-C 3.6Å; E181-A184 WeakPolarHBondContact O-CA 3.12Å; E181-A184 WeakPolarHBondContact O-CB 3.34Å; E181-A184 PolarHBondContact O-N 2.64Å; E181-R185 WeakPolarHBondContact O-CG 3.34Å; E181-R185 PolarHBondContact O-N 3.23Å
182	R	90.2	Very high	83.2	Confident	25 Å²	25	23.2 Å²	23.2	9%	0.094	12%	0.121	C	C	.	.	H	α-helix	trans	-58.5	-36.1	176.3	-168.1	123.5	-164.6	165.5	10	113.2	D92 F94 A178 M179 L180 L199 F203	D92-R182 VanDerWaalsContact CG-CZ 3.46Å; D92-R182 VanDerWaalsContact CG-NE 3.31Å; D92-R182 PolarHBondContact O-NH2 2.98Å; D92-R182 IonicContact OD1-CZ 3.89Å; D92-R182 IonicContact OD1-NE 2.72Å; D92-R182 IonicContact OD1-NH1 2.96Å; D92-R182 IonicContact OD1-NH2 3.62Å; D92-R182 PolarHBondContact OD1-NH2 3.15Å; D92-R182 VanDerWaalsContact OD1-NH2 3.13Å; D92-R182 VanDerWaalsContact OD2-CD 3.28Å; D92-R182 WeakPolarHBondContact OD2-CD 3.47Å; D92-R182 VanDerWaalsContact OD2-CG 3.3Å; D92-R182 WeakPolarHBondContact OD2-CG 3.06Å; D92-R182 IonicContact OD2-CZ 2.94Å; D92-R182 IonicContact OD2-NE 3.09Å; D92-R182 PolarHBondContact OD2-NE 3.24Å; D92-R182 IonicContact OD2-NH2 3.35Å; F94-R182 PolarHBondContact O-NH1 3.07Å; F94-R182 PolarHBondContact O-NH2 3.38Å; A178-R182 PolarHBondContact O-N 2.83Å; M179-R182 PolarHBondContact O-N 3.27Å; L180-R182 PolarHBondContact O-N 3.18Å; R182-L199 HydrophobicContact CB-CD2 4.28Å; R182-L199 HydrophobicContact CG-CD2 4.1Å; R182-F203 HydrophobicContact CB-CE2 3.96Å; R182-F203 HydrophobicContact CB-CZ 3.96Å; R182-F203 HydrophobicContact CG-CE2 4.23Å; R182-F203 HydrophobicContact CG-CZ 4.47Å
183	I	90	Very high	84.1	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-71	-40.9	174.1	-63.9	162.1	0	0	0	110.7	M179 L180 E181 S186 V191 L199 L223 I243 L245	M179-I183 VanDerWaalsContact O-CG1 3.31Å; M179-I183 WeakPolarHBondContact O-CG1 3.47Å; M179-I183 PolarHBondContact O-N 2.83Å; M179-I183 VanDerWaalsContact O-N 3.07Å; L180-I183 PolarHBondContact O-N 3.48Å; E181-I183 VanDerWaalsContact C-N 3.27Å; E181-I183 PolarHBondContact O-N 2.88Å; I183-S186 WeakPolarHBondContact O-CB 3.29Å; I183-S186 PolarHBondContact O-N 3.21Å; I183-S186 PolarHBondContact O-OG 3.35Å; I183-V191 HydrophobicContact CG1-CG2 4.22Å; I183-L199 HydrophobicContact CD1-CD1 3.95Å; I183-L199 HydrophobicContact CG1-CD1 4.11Å; I183-L199 HydrophobicContact CG1-CD2 4.49Å; I183-L223 HydrophobicContact CD1-CD1 4.01Å; I183-L223 HydrophobicContact CD1-CD2 4.2Å; I183-L223 HydrophobicContact CG2-CD2 3.86Å; I183-I243 HydrophobicContact CD1-CG2 4.15Å; I183-I243 HydrophobicContact CG2-CG2 4.3Å; I183-L245 HydrophobicContact CG2-CD2 4.16Å
184	A	90.4	Very high	84.2	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.008	10%	0.103	C	C	.	.	H	α-helix	trans	-64.6	-36.9	176.7	0	0	0	0	0	113.2	L29 I155 L180 E181 S186 R187 L245	L29-A184 HydrophobicContact CD2-CB 4.02Å; I155-A184 HydrophobicContact CG1-CB 3.94Å; L180-A184 WeakPolarHBondContact O-CB 3.36Å; L180-A184 PolarHBondContact O-N 2.69Å; E181-A184 CarbonylContact O-C 3.6Å; E181-A184 WeakPolarHBondContact O-CA 3.12Å; E181-A184 WeakPolarHBondContact O-CB 3.34Å; E181-A184 PolarHBondContact O-N 2.64Å; A184-S186 PolarHBondContact O-N 3.34Å; A184-R187 PolarHBondContact O-N 3.17Å; A184-R187 PolarHBondContact O-NH1 3.06Å; A184-R187 VanDerWaalsContact O-NH1 3.08Å; A184-L245 HydrophobicContact CB-CD1 3.85Å; A184-L245 HydrophobicContact CB-CG 4.39Å
185	R	89.9	Confident	83.7	Confident	9 Å²	9	17.5 Å²	17.5	3%	0.034	10%	0.097	C	C	.	.	H	α-helix	trans	-57.1	-30.8	172.7	-71.5	-158.8	-58.7	-145.8	9.3	113.3	E30 E33 R43 D92 E181 R187	E30-R185 WeakPolarHBondContact O-CD 3.39Å; E33-R185 IonicContact OE1-NH1 2.77Å; R43-R185 PolarHBondContact NH1-O 2.84Å; D92-R185 IonicContact OD1-CZ 3.53Å; D92-R185 IonicContact OD1-NE 3.95Å; D92-R185 IonicContact OD1-NH2 3.93Å; D92-R185 PolarHBondContact OD1-NH2 2.91Å; D92-R185 IonicContact OD2-CZ 2.68Å; D92-R185 VanDerWaalsContact OD2-CZ 3.24Å; D92-R185 IonicContact OD2-NE 2.76Å; D92-R185 PolarHBondContact OD2-NE 3.3Å; D92-R185 IonicContact OD2-NH2 3.19Å; D92-R185 PolarHBondContact OD2-NH2 3.44Å; E181-R185 WeakPolarHBondContact O-CG 3.34Å; E181-R185 PolarHBondContact O-N 3.23Å; R185-R187 VanDerWaalsContact C-N 3.35Å
186	S	86.2	Confident	82.9	Confident	11 Å²	11	22.2 Å²	22.2	8%	0.077	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-15.1	175.8	79	0	0	0	0	114.7	I183 A184 H188 H189 G190	I183-S186 WeakPolarHBondContact O-CB 3.29Å; I183-S186 PolarHBondContact O-N 3.21Å; I183-S186 PolarHBondContact O-OG 3.35Å; A184-S186 PolarHBondContact O-N 3.34Å; S186-H188 PolarHBondContact O-N 3.44Å; S186-H189 WeakPolarHBondContact O-CA 3.32Å; S186-H189 VanDerWaalsContact O-CB 3.31Å; S186-H189 WeakPolarHBondContact O-CB 3.38Å; S186-H189 PolarHBondContact O-N 3.29Å; S186-G190 VanDerWaalsContact OG-CA 3.23Å; S186-G190 WeakPolarHBondContact OG-CA 3.43Å; S186-G190 PolarHBondContact OG-N 3.22Å
187	R	87.1	Confident	82.2	Confident	14 Å²	14	25.3 Å²	25.3	5%	0.053	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	36.9	-107.6	-168.4	-65.9	95.4	167.1	114.7	-15.8	112.8	E26 L29 E30 A184 R185 C244 F248	E26-R187 PolarHBondContact O-NH2 3.22Å; E26-R187 IonicContact OE1-NE 3.88Å; E26-R187 IonicContact OE2-CZ 2.71Å; E26-R187 IonicContact OE2-NE 3.26Å; E26-R187 PolarHBondContact OE2-NE 3.38Å; E26-R187 IonicContact OE2-NH2 2.64Å; E26-R187 PolarHBondContact OE2-NH2 2.85Å; L29-R187 VanDerWaalsContact CB-NH1 3.27Å; L29-R187 HydrophobicContact CD1-CG 4.4Å; L29-R187 PolarHBondContact O-NH1 3.28Å; E30-R187 IonicContact OE2-CZ 3.84Å; E30-R187 IonicContact OE2-NH1 2.69Å; E30-R187 PolarHBondContact OE2-NH1 3.04Å; E30-R187 VanDerWaalsContact OE2-NH1 3.13Å; E30-R187 IonicContact OE2-NH2 3.15Å; A184-R187 PolarHBondContact O-N 3.17Å; A184-R187 PolarHBondContact O-NH1 3.06Å; A184-R187 VanDerWaalsContact O-NH1 3.08Å; R185-R187 VanDerWaalsContact C-N 3.35Å; R187-C244 WeakPolarHBondContact O-CB 3.45Å; R187-F248 HydrophobicContact CB-CD2 4.01Å; R187-F248 HydrophobicContact CB-CE2 4.19Å; R187-F248 HydrophobicContact CB-CG 4.27Å; R187-F248 HydrophobicContact CG-CD2 4.25Å; R187-F248 HydrophobicContact CG-CE2 3.91Å; R187-F248 HydrophobicContact CG-CZ 4.21Å; R187-F248 WeakPolarHBondContact O-CB 3.15Å
188	H	78.6	Confident	81.7	Confident	25 Å²	25	25.1 Å²	25.1	12%	0.116	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-10	-179.2	-61.9	-79	0	0	0	114.4	S186 F248 M253 R296	S186-H188 PolarHBondContact O-N 3.44Å; H188-F248 AromaticContact CE1-CD1 3.54Å; H188-F248 PolarHBondContact ND1-O 3.25Å; H188-F248 AromaticContact NE2-CD1 3.59Å; H188-M253 HydrophobicContact CB-CE 3.8Å; H188-M253 HydrophobicContact CB-SD 3.69Å; H188-R296 VanDerWaalsContact C-NH2 3.33Å; H188-R296 PolarHBondContact O-NH2 2.68Å
189	H	77	Confident	81.6	Confident	34 Å²	34	25.5 Å²	25.5	16%	0.157	14%	0.144	C	C	.	.	S	Bend	trans	-80.1	-25.7	-179.6	-58.8	114.4	0	0	0	112.8	D90 S186 F242 R296	D90-H189 HydrophobicContact CB-CB 3.72Å; S186-H189 WeakPolarHBondContact O-CA 3.32Å; S186-H189 VanDerWaalsContact O-CB 3.31Å; S186-H189 WeakPolarHBondContact O-CB 3.38Å; S186-H189 PolarHBondContact O-N 3.29Å; H189-F242 WeakPolarHBondContact O-CE2 3.43Å; H189-R296 PolarHBondContact CD2-NH2 3.07Å; H189-R296 VanDerWaalsContact CD2-NH2 3.32Å
190	G	80.1	Confident	81.3	Confident	12 Å²	12	28 Å²	28	12%	0.124	16%	0.155	C	C	.	.			trans	69.1	171.7	175.4	0	0	0	0	0	114.7	S186 I243	S186-G190 VanDerWaalsContact OG-CA 3.23Å; S186-G190 WeakPolarHBondContact OG-CA 3.43Å; S186-G190 PolarHBondContact OG-N 3.22Å; G190-I243 CarbonylContact C-O 3.56Å; G190-I243 WeakPolarHBondContact CA-O 3.49Å
191	V	83.3	Confident	81	Confident	18 Å²	18	32.4 Å²	32.4	11%	0.109	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.1	176.1	-173.4	0	0	0	0	109.6	I183 L199 I243	I183-V191 HydrophobicContact CG1-CG2 4.22Å; V191-L199 HydrophobicContact CG1-CD1 4.43Å; V191-L199 HydrophobicContact CG1-CD2 4.05Å; V191-L199 HydrophobicContact CG1-CG 3.87Å; V191-I243 PolarHBondContact N-O 2.93Å; V191-I243 PolarHBondContact O-N 3.41Å
192	K	76.1	Confident	80.7	Confident	60 Å²	60	34.2 Å²	34.2	26%	0.261	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137.3	178.9	53.1	-173.7	175	-167.7	0	112.3	C194 T197 S198 M230 W288	K192-C194 WeakPolarHBondContact CD-O 3.28Å; K192-C194 WeakPolarHBondContact CG-O 3.38Å; K192-C194 PolarHBondContact O-N 3.22Å; K192-T197 WeakPolarHBondContact CE-OG1 3.35Å; K192-S198 WeakPolarHBondContact O-CA 3.46Å; K192-S198 WeakPolarHBondContact O-CB 3.37Å; K192-M230 HydrophobicContact CB-CE 3.73Å; K192-M230 HydrophobicContact CB-SD 4.06Å; K192-M230 HydrophobicContact CD-CE 3.73Å; K192-M230 HydrophobicContact CG-CE 4.35Å; K192-W288 HydrophobicContact CB-CH2 4.34Å; K192-W288 HydrophobicContact CB-CZ2 4.48Å
193	T	75.5	Confident	80.6	Confident	50 Å²	50	33.8 Å²	33.8	31%	0.307	18%	0.184	S	C	.	.	S	Bend	trans	-74.9	-11.5	175.1	60.5	0	0	0	0	114.1	A241 I243	T193-A241 HydrophobicContact CG2-CB 3.96Å; T193-A241 PolarHBondContact N-O 3.23Å; T193-A241 PolarHBondContact OG1-N 2.95Å; T193-I243 HydrophobicContact CG2-CD1 3.51Å; T193-I243 HydrophobicContact CG2-CG1 4.33Å
194	C	68.4	Low	80.3	Confident	25 Å²	25	41 Å²	41	17%	0.169	22%	0.223	C	C	.	.	S	Bend	trans	-129.3	156.2	-174.3	-63.6	0	0	0	0	111.4	K192 M230 V232	K192-C194 WeakPolarHBondContact CD-O 3.28Å; K192-C194 WeakPolarHBondContact CG-O 3.38Å; K192-C194 PolarHBondContact O-N 3.22Å; C194-M230 HydrophobicContact CB-SD 4.2Å; C194-V232 HydrophobicContact CB-CG2 4.36Å
195	G	67.6	Low	80	Confident	21 Å²	21	42.3 Å²	42.3	22%	0.216	23%	0.231	C	C	.	.	S	Bend	trans	92.7	-176.1	-168.2	0	0	0	0	0	112.9	S198 K201	G195-S198 PolarHBondContact O-OG 3.15Å; G195-K201 PolarHBondContact O-NZ 2.91Å
196	D	68.6	Low	79.6	Confident	120 Å²	120	50.3 Å²	50.3	64%	0.642	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-38.8	-173.4	-72.4	-78.8	0	0	0	114	S198 K201	D196-S198 PolarHBondContact O-N 3.26Å; D196-K201 WeakPolarHBondContact O-CB 3.23Å; D196-K201 WeakPolarHBondContact O-CD 3.49Å; D196-K201 IonicContact OD1-NZ 3.94Å; D196-K201 PolarHBondContact OD1-NZ 3.48Å; D196-K201 IonicContact OD2-NZ 2.63Å; D196-K201 PolarHBondContact OD2-NZ 2.8Å
197	T	71.4	Confident	79.2	Confident	91 Å²	91	52.3 Å²	52.3	56%	0.558	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	16.5	174.7	52.4	0	0	0	0	114.6	K192	K192-T197 WeakPolarHBondContact CE-OG1 3.35Å
198	S	78.2	Confident	78.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-82.3	142.5	-179.5	62.4	0	0	0	0	112.2	K192 G195 D196 H200 K201 V202	K192-S198 WeakPolarHBondContact O-CA 3.46Å; K192-S198 WeakPolarHBondContact O-CB 3.37Å; G195-S198 PolarHBondContact O-OG 3.15Å; D196-S198 PolarHBondContact O-N 3.26Å; S198-H200 PolarHBondContact O-N 3.42Å; S198-H200 PolarHBondContact OG-CE1 3.05Å; S198-H200 PolarHBondContact OG-ND1 3.47Å; S198-K201 PolarHBondContact O-N 3.19Å; S198-V202 PolarHBondContact O-N 3.32Å; S198-V202 VanDerWaalsContact O-N 3.16Å
199	L	84.8	Confident	78.8	Confident	9 Å²	9	58.7 Å²	58.7	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-47.2	-34.6	-171.8	-64	170.8	0	0	0	114.7	R182 I183 V191 F203 V210	R182-L199 HydrophobicContact CB-CD2 4.28Å; R182-L199 HydrophobicContact CG-CD2 4.1Å; I183-L199 HydrophobicContact CD1-CD1 3.95Å; I183-L199 HydrophobicContact CG1-CD1 4.11Å; I183-L199 HydrophobicContact CG1-CD2 4.49Å; V191-L199 HydrophobicContact CG1-CD1 4.43Å; V191-L199 HydrophobicContact CG1-CD2 4.05Å; V191-L199 HydrophobicContact CG1-CG 3.87Å; L199-F203 HydrophobicContact CD2-CD2 4.31Å; L199-F203 HydrophobicContact CD2-CE2 3.96Å; L199-F203 PolarHBondContact O-N 2.73Å; L199-F203 VanDerWaalsContact O-N 3.12Å; L199-V210 HydrophobicContact CB-CG1 4.09Å; L199-V210 HydrophobicContact CD1-CG1 4.28Å
200	H	83.4	Confident	79.1	Confident	55 Å²	55	57.7 Å²	57.7	26%	0.255	30%	0.304	S	S	.	.	H	α-helix	trans	-69.2	-34.6	-178.4	83.3	-89.5	0	0	0	113.2	S198 N204 V205 A207 V210	S198-H200 PolarHBondContact O-N 3.42Å; S198-H200 PolarHBondContact OG-CE1 3.05Å; S198-H200 PolarHBondContact OG-ND1 3.47Å; H200-N204 PolarHBondContact O-N 2.81Å; H200-V205 CarbonylContact C-O 3.58Å; H200-V205 WeakPolarHBondContact CA-O 3.15Å; H200-V205 VanDerWaalsContact CB-O 3.31Å; H200-V205 WeakPolarHBondContact CB-O 3.34Å; H200-V205 PolarHBondContact O-N 3.38Å; H200-A207 HydrophobicContact CB-CB 3.96Å; H200-V210 HydrophobicContact CB-CG2 3.9Å
201	K	83.9	Confident	79.2	Confident	95 Å²	95	62.1 Å²	62.1	41%	0.413	32%	0.321	S	S	.	.	H	α-helix	trans	-77.8	-51.7	173.1	-72.6	174	174.9	-178.2	0	110.5	G195 D196 S198 F203 N204	G195-K201 PolarHBondContact O-NZ 2.91Å; D196-K201 WeakPolarHBondContact O-CB 3.23Å; D196-K201 WeakPolarHBondContact O-CD 3.49Å; D196-K201 IonicContact OD1-NZ 3.94Å; D196-K201 PolarHBondContact OD1-NZ 3.48Å; D196-K201 IonicContact OD2-NZ 2.63Å; D196-K201 PolarHBondContact OD2-NZ 2.8Å; S198-K201 PolarHBondContact O-N 3.19Å; K201-F203 VanDerWaalsContact C-N 3.31Å; K201-F203 PolarHBondContact O-N 3.46Å; K201-N204 PolarHBondContact O-N 2.81Å
202	V	84.9	Confident	79.1	Confident	39 Å²	39	67.4 Å²	67.4	24%	0.236	34%	0.339	C	S	.	.	H	α-helix	trans	-51.9	-45.5	-176.5	170.4	0	0	0	0	112.6	A96 S198	A96-V202 HydrophobicContact CB-CG1 3.98Å; A96-V202 WeakPolarHBondContact CB-O 3.5Å; S198-V202 PolarHBondContact O-N 3.32Å; S198-V202 VanDerWaalsContact O-N 3.16Å
203	F	86.5	Confident	79.4	Confident	16 Å²	16	65.5 Å²	65.5	7%	0.07	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	5.6	-180	-68.4	-77.9	0	0	0	114.1	A96 I98 V175 A178 M179 R182 L199 K201 V205	A96-F203 HydrophobicContact CB-CD1 3.78Å; A96-F203 HydrophobicContact CB-CE1 3.86Å; A96-F203 HydrophobicContact CB-CG 4.44Å; I98-F203 HydrophobicContact CD1-CD1 4.25Å; I98-F203 HydrophobicContact CG1-CD1 4.3Å; I98-F203 HydrophobicContact CG1-CE1 4.47Å; V175-F203 HydrophobicContact CG2-CB 3.87Å; V175-F203 HydrophobicContact CG2-CD1 3.97Å; V175-F203 HydrophobicContact CG2-CG 4.12Å; A178-F203 HydrophobicContact CB-CE1 3.72Å; A178-F203 HydrophobicContact CB-CZ 4.22Å; A178-F203 WeakPolarHBondContact O-CZ 3.23Å; M179-F203 HydrophobicContact CB-CE2 4.32Å; M179-F203 HydrophobicContact CE-CB 3.55Å; M179-F203 HydrophobicContact CE-CD2 3.87Å; M179-F203 HydrophobicContact CE-CG 3.93Å; M179-F203 HydrophobicContact CG-CD2 3.48Å; M179-F203 VanDerWaalsContact CG-CD2 3.48Å; M179-F203 HydrophobicContact CG-CE2 3.65Å; M179-F203 HydrophobicContact CG-CG 3.99Å; M179-F203 HydrophobicContact CG-CZ 4.28Å; R182-F203 HydrophobicContact CB-CE2 3.96Å; R182-F203 HydrophobicContact CB-CZ 3.96Å; R182-F203 HydrophobicContact CG-CE2 4.23Å; R182-F203 HydrophobicContact CG-CZ 4.47Å; L199-F203 HydrophobicContact CD2-CD2 4.31Å; L199-F203 HydrophobicContact CD2-CE2 3.96Å; L199-F203 PolarHBondContact O-N 2.73Å; L199-F203 VanDerWaalsContact O-N 3.12Å; K201-F203 VanDerWaalsContact C-N 3.31Å; K201-F203 PolarHBondContact O-N 3.46Å; F203-V205 VanDerWaalsContact C-N 3.31Å; F203-V205 HydrophobicContact CB-CG2 4.09Å; F203-V205 PolarHBondContact O-N 3.19Å
204	N	84.7	Confident	79.9	Confident	157 Å²	157	63.5 Å²	63.5	84%	0.84	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	45.6	-174.2	-164.4	13.7	0	0	0	113.7	H200 K201	H200-N204 PolarHBondContact O-N 2.81Å; K201-N204 PolarHBondContact O-N 2.81Å
205	V	83.6	Confident	80.7	Confident	28 Å²	28	64.3 Å²	64.3	17%	0.17	32%	0.321	C	S	.	.			trans	-112.7	142.5	179.4	177	0	0	0	0	109.3	V175 M179 H200 F203 A207 D209 V210	V175-V205 HydrophobicContact CG1-CG2 4.49Å; V175-V205 HydrophobicContact CG2-CG2 3.93Å; M179-V205 HydrophobicContact CE-CB 3.73Å; M179-V205 HydrophobicContact CE-CG1 4.18Å; M179-V205 HydrophobicContact CE-CG2 3.58Å; H200-V205 CarbonylContact C-O 3.58Å; H200-V205 WeakPolarHBondContact CA-O 3.15Å; H200-V205 VanDerWaalsContact CB-O 3.31Å; H200-V205 WeakPolarHBondContact CB-O 3.34Å; H200-V205 PolarHBondContact O-N 3.38Å; F203-V205 VanDerWaalsContact C-N 3.31Å; F203-V205 HydrophobicContact CB-CG2 4.09Å; F203-V205 PolarHBondContact O-N 3.19Å; V205-A207 PolarHBondContact O-N 2.97Å; V205-D209 HydrophobicContact CG1-CB 3.94Å; V205-V210 HydrophobicContact CB-CG2 4.15Å; V205-V210 HydrophobicContact CG1-CG2 3.91Å
206	R	81.5	Confident	81.4	Confident	177 Å²	177	67.5 Å²	67.5	67%	0.668	33%	0.326	S	S	*	.			trans	-62.1	132.6	179.8	-47.5	176.7	-60	-154.2	-0.7	109.5	K208 D209 V210	R206-K208 PolarHBondContact O-N 3.12Å; R206-D209 WeakPolarHBondContact CB-OD2 3.48Å; R206-D209 IonicContact CZ-OD1 3.34Å; R206-D209 IonicContact CZ-OD2 3.3Å; R206-D209 IonicContact NE-OD1 3.13Å; R206-D209 IonicContact NE-OD2 3.51Å; R206-D209 PolarHBondContact NE-OD2 2.81Å; R206-D209 VanDerWaalsContact NH2-CG 3.26Å; R206-D209 IonicContact NH2-OD1 3.87Å; R206-D209 PolarHBondContact NH2-OD1 2.84Å; R206-D209 IonicContact NH2-OD2 3.66Å; R206-D209 PolarHBondContact NH2-OD2 2.77Å; R206-D209 PolarHBondContact O-N 3.11Å; R206-V210 PolarHBondContact O-N 2.97Å
207	A	79.1	Confident	82.2	Confident	52 Å²	52	62.1 Å²	62.1	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-54.1	-27.1	-178.7	0	0	0	0	0	114.2	H200 V205 F211	H200-A207 HydrophobicContact CB-CB 3.96Å; V205-A207 PolarHBondContact O-N 2.97Å; A207-F211 WeakPolarHBondContact O-CB 3.47Å; A207-F211 PolarHBondContact O-N 3.42Å
208	K	78.2	Confident	82.9	Confident	126 Å²	126	60 Å²	60	55%	0.548	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-34.9	173.6	175.5	168.6	174.6	167.8	0	113.7	R206 Y212	R206-K208 PolarHBondContact O-N 3.12Å; K208-Y212 HydrophobicContact CD-CE2 4.27Å; K208-Y212 VanDerWaalsContact CE-OH 3.28Å; K208-Y212 WeakPolarHBondContact CE-OH 3.43Å; K208-Y212 HydrophobicContact CG-CD2 4.27Å; K208-Y212 HydrophobicContact CG-CE2 3.81Å; K208-Y212 VanDerWaalsContact O-CD2 3.25Å; K208-Y212 WeakPolarHBondContact O-CD2 3.43Å; K208-Y212 PolarHBondContact O-N 3.22Å
209	D	78.8	Confident	83.1	Confident	48 Å²	48	67.8 Å²	67.8	26%	0.257	31%	0.313	S	S	.	.	H	α-helix	trans	-78.4	-40.1	179.2	-51.9	-42.3	0	0	0	110	V205 R206 F211 Y212 L213	V205-D209 HydrophobicContact CG1-CB 3.94Å; R206-D209 WeakPolarHBondContact CB-OD2 3.48Å; R206-D209 IonicContact CZ-OD1 3.34Å; R206-D209 IonicContact CZ-OD2 3.3Å; R206-D209 IonicContact NE-OD1 3.13Å; R206-D209 IonicContact NE-OD2 3.51Å; R206-D209 PolarHBondContact NE-OD2 2.81Å; R206-D209 VanDerWaalsContact NH2-CG 3.26Å; R206-D209 IonicContact NH2-OD1 3.87Å; R206-D209 PolarHBondContact NH2-OD1 2.84Å; R206-D209 IonicContact NH2-OD2 3.66Å; R206-D209 PolarHBondContact NH2-OD2 2.77Å; R206-D209 PolarHBondContact O-N 3.11Å; D209-F211 VanDerWaalsContact C-N 3.29Å; D209-F211 PolarHBondContact O-N 3.29Å; D209-Y212 PolarHBondContact O-N 3.19Å; D209-L213 WeakPolarHBondContact O-CB 3.38Å; D209-L213 PolarHBondContact O-N 3.42Å
210	V	83.2	Confident	82.9	Confident	12 Å²	12	70 Å²	70	7%	0.073	32%	0.324	C	S	.	.	H	α-helix	trans	-56.1	-43.8	169.8	-178.7	0	0	0	0	111	M179 L199 H200 V205 R206 L213 V214	M179-V210 HydrophobicContact CE-CG2 3.81Å; M179-V210 HydrophobicContact SD-CG2 4.37Å; L199-V210 HydrophobicContact CB-CG1 4.09Å; L199-V210 HydrophobicContact CD1-CG1 4.28Å; H200-V210 HydrophobicContact CB-CG2 3.9Å; V205-V210 HydrophobicContact CB-CG2 4.15Å; V205-V210 HydrophobicContact CG1-CG2 3.91Å; R206-V210 PolarHBondContact O-N 2.97Å; V210-L213 PolarHBondContact O-N 2.96Å; V210-V214 HydrophobicContact CG1-CG2 4.35Å; V210-V214 VanDerWaalsContact O-CG2 3.32Å; V210-V214 WeakPolarHBondContact O-CG2 3.33Å; V210-V214 PolarHBondContact O-N 3.48Å
211	F	81.8	Confident	82.8	Confident	106 Å²	106	69 Å²	69	47%	0.465	33%	0.328	S	S	.	.	H	α-helix	trans	-55.5	-53.6	174.1	172.5	-94.8	0	0	0	111.7	A207 D209 L213 V214 E215	A207-F211 WeakPolarHBondContact O-CB 3.47Å; A207-F211 PolarHBondContact O-N 3.42Å; D209-F211 VanDerWaalsContact C-N 3.29Å; D209-F211 PolarHBondContact O-N 3.29Å; F211-L213 VanDerWaalsContact C-N 3.29Å; F211-L213 PolarHBondContact O-N 2.91Å; F211-V214 PolarHBondContact O-N 2.95Å; F211-E215 HydrophobicContact CD1-CG 4.21Å; F211-E215 HydrophobicContact CD2-CG 4.22Å; F211-E215 HydrophobicContact CE1-CG 3.83Å; F211-E215 HydrophobicContact CE2-CG 3.84Å; F211-E215 WeakPolarHBondContact CE2-OE1 3.44Å; F211-E215 HydrophobicContact CG-CG 4.39Å; F211-E215 HydrophobicContact CZ-CG 3.63Å; F211-E215 WeakPolarHBondContact O-CB 3.38Å; F211-E215 VanDerWaalsContact O-CG 3.3Å; F211-E215 WeakPolarHBondContact O-CG 3.45Å; F211-E215 PolarHBondContact O-N 2.83Å
212	Y	80.9	Confident	82.9	Confident	129 Å²	129	64.5 Å²	64.5	51%	0.506	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-30.1	179.2	-67	-49.2	0	0	0	114	K208 D209 R216	K208-Y212 HydrophobicContact CD-CE2 4.27Å; K208-Y212 VanDerWaalsContact CE-OH 3.28Å; K208-Y212 WeakPolarHBondContact CE-OH 3.43Å; K208-Y212 HydrophobicContact CG-CD2 4.27Å; K208-Y212 HydrophobicContact CG-CE2 3.81Å; K208-Y212 VanDerWaalsContact O-CD2 3.25Å; K208-Y212 WeakPolarHBondContact O-CD2 3.43Å; K208-Y212 PolarHBondContact O-N 3.22Å; D209-Y212 PolarHBondContact O-N 3.19Å; Y212-R216 WeakPolarHBondContact O-CB 3.31Å; Y212-R216 PolarHBondContact O-N 2.71Å
213	L	82.4	Confident	83.1	Confident	20 Å²	20	62.8 Å²	62.8	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-66.9	-47.3	175.6	-171.1	71.5	0	0	0	111	H176 M179 D209 V210 F211 R216 Y217	H176-L213 HydrophobicContact CB-CD1 3.94Å; H176-L213 HydrophobicContact CB-CD2 4.06Å; M179-L213 HydrophobicContact CB-CD2 4.41Å; M179-L213 HydrophobicContact SD-CD2 3.64Å; D209-L213 WeakPolarHBondContact O-CB 3.38Å; D209-L213 PolarHBondContact O-N 3.42Å; V210-L213 PolarHBondContact O-N 2.96Å; F211-L213 VanDerWaalsContact C-N 3.29Å; F211-L213 PolarHBondContact O-N 2.91Å; L213-R216 WeakPolarHBondContact O-CB 3.45Å; L213-R216 PolarHBondContact O-N 2.83Å; L213-Y217 HydrophobicContact CD1-CD2 4.21Å; L213-Y217 HydrophobicContact CD1-CE2 3.46Å; L213-Y217 VanDerWaalsContact CD1-CE2 3.46Å; L213-Y217 HydrophobicContact CD2-CE2 4.16Å; L213-Y217 HydrophobicContact CG-CD2 3.94Å; L213-Y217 HydrophobicContact CG-CE2 3.55Å; L213-Y217 WeakPolarHBondContact O-CD2 3.21Å; L213-Y217 PolarHBondContact O-N 3.03Å
214	V	86.7	Confident	83.1	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-48.1	175.7	174.8	0	0	0	0	110.3	V210 F211 R216 Y217 V218 L223 K225 I243	V210-V214 HydrophobicContact CG1-CG2 4.35Å; V210-V214 VanDerWaalsContact O-CG2 3.32Å; V210-V214 WeakPolarHBondContact O-CG2 3.33Å; V210-V214 PolarHBondContact O-N 3.48Å; F211-V214 PolarHBondContact O-N 2.95Å; V214-R216 PolarHBondContact O-N 3.38Å; V214-R216 VanDerWaalsContact O-N 3.11Å; V214-Y217 PolarHBondContact O-N 2.92Å; V214-Y217 VanDerWaalsContact O-N 3.16Å; V214-V218 HydrophobicContact CG1-CG2 3.94Å; V214-V218 WeakPolarHBondContact O-CB 3.13Å; V214-V218 VanDerWaalsContact O-CG2 3.22Å; V214-V218 WeakPolarHBondContact O-CG2 3.28Å; V214-V218 PolarHBondContact O-N 3.1Å; V214-L223 HydrophobicContact CG1-CD1 4.34Å; V214-L223 HydrophobicContact CG2-CD1 4.4Å; V214-K225 HydrophobicContact CG1-CD 4.13Å; V214-I243 HydrophobicContact CB-CD1 4.43Å; V214-I243 HydrophobicContact CG1-CD1 3.82Å; V214-I243 HydrophobicContact CG1-CG1 4.22Å; V214-I243 HydrophobicContact CG2-CD1 3.79Å
215	E	83.9	Confident	83.1	Confident	43 Å²	43	59.4 Å²	59.4	20%	0.201	28%	0.276	C	S	.	.	H	α-helix	trans	-61.8	-17.9	175.2	-68	-56.2	153.2	0	0	114	F211 R219 K225	F211-E215 HydrophobicContact CD1-CG 4.21Å; F211-E215 HydrophobicContact CD2-CG 4.22Å; F211-E215 HydrophobicContact CE1-CG 3.83Å; F211-E215 HydrophobicContact CE2-CG 3.84Å; F211-E215 WeakPolarHBondContact CE2-OE1 3.44Å; F211-E215 HydrophobicContact CG-CG 4.39Å; F211-E215 HydrophobicContact CZ-CG 3.63Å; F211-E215 WeakPolarHBondContact O-CB 3.38Å; F211-E215 VanDerWaalsContact O-CG 3.3Å; F211-E215 WeakPolarHBondContact O-CG 3.45Å; F211-E215 PolarHBondContact O-N 2.83Å; E215-R219 PolarHBondContact O-NE 3.39Å; E215-R219 PolarHBondContact O-NH2 3.39Å; E215-K225 IonicContact OE1-NZ 2.79Å; E215-K225 PolarHBondContact OE1-NZ 2.73Å
216	R	82.3	Confident	82.6	Confident	88 Å²	88	61 Å²	61	33%	0.332	28%	0.279	S	S	.	.	H	α-helix	trans	-81.1	-52.7	170.6	-179.7	173.4	179.3	177	-2.2	110.5	Y212 L213 V214 V218 R219 M220	Y212-R216 WeakPolarHBondContact O-CB 3.31Å; Y212-R216 PolarHBondContact O-N 2.71Å; L213-R216 WeakPolarHBondContact O-CB 3.45Å; L213-R216 PolarHBondContact O-N 2.83Å; V214-R216 PolarHBondContact O-N 3.38Å; V214-R216 VanDerWaalsContact O-N 3.11Å; R216-V218 VanDerWaalsContact C-N 3.34Å; R216-V218 PolarHBondContact O-N 2.78Å; R216-R219 PolarHBondContact O-N 3.26Å; R216-M220 HydrophobicContact CG-SD 3.58Å; R216-M220 VanDerWaalsContact CG-SD 3.58Å; R216-M220 VanDerWaalsContact O-CG 3.28Å; R216-M220 WeakPolarHBondContact O-CG 3.12Å; R216-M220 PolarHBondContact O-N 3Å; R216-M220 VanDerWaalsContact O-N 3.07Å
217	Y	86.5	Confident	81.9	Confident	7 Å²	7	56.2 Å²	56.2	3%	0.027	27%	0.272	C	S	.	.	H	α-helix	trans	-71.5	-24.2	-177.5	-63.5	-51.2	0	0	0	114.2	F165 L180 L213 V214 M220 G221 V222 L223	F165-Y217 AromaticContact CE2-CE1 3.85Å; F165-Y217 HydrophobicContact CE2-CE1 3.85Å; F165-Y217 HydrophobicContact CZ-CE1 4.24Å; L180-Y217 HydrophobicContact CD1-CD2 4.25Å; L180-Y217 HydrophobicContact CD1-CE1 4.13Å; L180-Y217 HydrophobicContact CD1-CE2 3.7Å; L180-Y217 HydrophobicContact CD2-CD2 3.82Å; L180-Y217 HydrophobicContact CD2-CE2 4.01Å; L180-Y217 HydrophobicContact CD2-CG 4.31Å; L180-Y217 HydrophobicContact CG-CD2 4.23Å; L180-Y217 HydrophobicContact CG-CE2 3.89Å; L213-Y217 HydrophobicContact CD1-CD2 4.21Å; L213-Y217 HydrophobicContact CD1-CE2 3.46Å; L213-Y217 VanDerWaalsContact CD1-CE2 3.46Å; L213-Y217 HydrophobicContact CD2-CE2 4.16Å; L213-Y217 HydrophobicContact CG-CD2 3.94Å; L213-Y217 HydrophobicContact CG-CE2 3.55Å; L213-Y217 WeakPolarHBondContact O-CD2 3.21Å; L213-Y217 PolarHBondContact O-N 3.03Å; V214-Y217 PolarHBondContact O-N 2.92Å; V214-Y217 VanDerWaalsContact O-N 3.16Å; Y217-M220 HydrophobicContact CD1-SD 4.44Å; Y217-M220 PolarHBondContact O-N 3.04Å; Y217-G221 PolarHBondContact O-N 3.49Å; Y217-V222 PolarHBondContact O-N 2.78Å; Y217-L223 HydrophobicContact CD2-CD1 4.34Å; Y217-L223 PolarHBondContact O-N 3.12Å
218	V	86.3	Confident	80.8	Confident	45 Å²	45	54.4 Å²	54.4	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-65.1	-48.8	169	170.8	0	0	0	0	110.7	V214 R216 M220 G221 L223 K225	V214-V218 HydrophobicContact CG1-CG2 3.94Å; V214-V218 WeakPolarHBondContact O-CB 3.13Å; V214-V218 VanDerWaalsContact O-CG2 3.22Å; V214-V218 WeakPolarHBondContact O-CG2 3.28Å; V214-V218 PolarHBondContact O-N 3.1Å; R216-V218 VanDerWaalsContact C-N 3.34Å; R216-V218 PolarHBondContact O-N 2.78Å; V218-M220 PolarHBondContact O-N 3.1Å; V218-G221 PolarHBondContact O-N 3.47Å; V218-L223 WeakPolarHBondContact CA-O 3.1Å; V218-L223 HydrophobicContact CG2-CB 3.91Å; V218-L223 WeakPolarHBondContact CG2-O 2.86Å; V218-K225 HydrophobicContact CG2-CB 3.72Å; V218-K225 HydrophobicContact CG2-CD 4.45Å
219	R	82.1	Confident	79.8	Confident	165 Å²	165	54 Å²	54	62%	0.623	26%	0.257	S	S	*	.	H	α-helix	trans	-67.5	-19.5	176	-79.4	-178.9	-67.4	158.1	-0.2	114	E215 R216 G221	E215-R219 PolarHBondContact O-NE 3.39Å; E215-R219 PolarHBondContact O-NH2 3.39Å; R216-R219 PolarHBondContact O-N 3.26Å; R219-G221 VanDerWaalsContact C-N 3.32Å
220	M	79.8	Confident	78.8	Confident	54 Å²	54	52.6 Å²	52.6	27%	0.266	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	11.1	173.4	-63.8	170.1	63.9	0	0	112.6	I160 R216 Y217 V218 V222	I160-M220 HydrophobicContact CD1-CB 4.35Å; I160-M220 HydrophobicContact CD1-CE 3.44Å; I160-M220 VanDerWaalsContact CD1-CE 3.44Å; R216-M220 HydrophobicContact CG-SD 3.58Å; R216-M220 VanDerWaalsContact CG-SD 3.58Å; R216-M220 VanDerWaalsContact O-CG 3.28Å; R216-M220 WeakPolarHBondContact O-CG 3.12Å; R216-M220 PolarHBondContact O-N 3Å; R216-M220 VanDerWaalsContact O-N 3.07Å; Y217-M220 HydrophobicContact CD1-SD 4.44Å; Y217-M220 PolarHBondContact O-N 3.04Å; V218-M220 PolarHBondContact O-N 3.1Å; M220-V222 PolarHBondContact O-N 3.15Å; M220-V222 VanDerWaalsContact O-N 3.12Å
221	G	81.8	Confident	77.3	Confident	34 Å²	34	54.9 Å²	54.9	35%	0.351	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	3.6	176	0	0	0	0	0	115.9	Y217 V218 R219 Q246	Y217-G221 PolarHBondContact O-N 3.49Å; V218-G221 PolarHBondContact O-N 3.47Å; R219-G221 VanDerWaalsContact C-N 3.32Å; G221-Q246 WeakPolarHBondContact O-CB 3.33Å; G221-Q246 WeakPolarHBondContact O-CG 3.44Å
222	V	86.5	Confident	76.1	Confident	2 Å²	2	51 Å²	51	1%	0.012	25%	0.25	C	S	.	.	S	Bend	trans	-84	-35.6	-176.3	176.1	0	0	0	0	111.9	I156 A159 I160 L180 Y217 M220 L245 Q246	I156-V222 HydrophobicContact CG2-CG2 4.2Å; A159-V222 HydrophobicContact CB-CG2 4.2Å; I160-V222 HydrophobicContact CD1-CG2 4.2Å; L180-V222 HydrophobicContact CD2-CG1 4.49Å; Y217-V222 PolarHBondContact O-N 2.78Å; M220-V222 PolarHBondContact O-N 3.15Å; M220-V222 VanDerWaalsContact O-N 3.12Å; V222-L245 CarbonylContact O-C 3.54Å; V222-L245 WeakPolarHBondContact O-CA 3.44Å; V222-Q246 PolarHBondContact O-N 2.87Å
223	L	89.4	Confident	74.6	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.4	-178.1	-65.4	-174.9	0	0	0	113	L180 I183 V214 Y217 V218 I243 C244 L245	L180-L223 HydrophobicContact CD2-CD1 4.34Å; L180-L223 HydrophobicContact CD2-CD2 4.05Å; L180-L223 HydrophobicContact CD2-CG 4.35Å; I183-L223 HydrophobicContact CD1-CD1 4.01Å; I183-L223 HydrophobicContact CD1-CD2 4.2Å; I183-L223 HydrophobicContact CG2-CD2 3.86Å; V214-L223 HydrophobicContact CG1-CD1 4.34Å; V214-L223 HydrophobicContact CG2-CD1 4.4Å; Y217-L223 HydrophobicContact CD2-CD1 4.34Å; Y217-L223 PolarHBondContact O-N 3.12Å; V218-L223 WeakPolarHBondContact CA-O 3.1Å; V218-L223 HydrophobicContact CG2-CB 3.91Å; V218-L223 WeakPolarHBondContact CG2-O 2.86Å; L223-I243 HydrophobicContact CB-CG2 4.49Å; L223-I243 HydrophobicContact CD1-CG2 4.01Å; L223-I243 HydrophobicContact CD2-CG2 4.4Å; L223-C244 CarbonylContact C-O 3.57Å; L223-C244 WeakPolarHBondContact CA-O 3.4Å; L223-L245 HydrophobicContact CD2-CD2 3.8Å
224	Y	86.1	Confident	73	Confident	31 Å²	31	55.1 Å²	55.1	12%	0.122	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	134.2	161.3	-179.9	-107	0	0	0	109.6	R226 F242 I243 C244 S249 P250	Y224-R226 HydrophobicContact CE1-CB 4.16Å; Y224-F242 HydrophobicContact CD1-CD1 4.29Å; Y224-F242 HydrophobicContact CD1-CE1 4.23Å; Y224-F242 HydrophobicContact CE1-CD1 4.36Å; Y224-F242 HydrophobicContact CE1-CE1 4.44Å; Y224-I243 WeakPolarHBondContact O-CA 3.18Å; Y224-C244 PolarHBondContact N-O 2.86Å; Y224-C244 PolarHBondContact O-N 3.3Å; Y224-S249 WeakPolarHBondContact CD2-OG 3.46Å; Y224-S249 VanDerWaalsContact CE2-OG 3.28Å; Y224-S249 WeakPolarHBondContact CE2-OG 3.42Å; Y224-P250 HydrophobicContact CE1-CG 3.97Å
225	K	84.4	Confident	71.2	Confident	70 Å²	70	58.5 Å²	58.5	30%	0.304	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.8	177	177.6	-163.9	168.7	-152.5	0	109.9	V214 E215 V218 A241 F242 I243	V214-K225 HydrophobicContact CG1-CD 4.13Å; E215-K225 IonicContact OE1-NZ 2.79Å; E215-K225 PolarHBondContact OE1-NZ 2.73Å; V218-K225 HydrophobicContact CG2-CB 3.72Å; V218-K225 HydrophobicContact CG2-CD 4.45Å; K225-A241 HydrophobicContact CG-CB 4.16Å; K225-F242 WeakPolarHBondContact CA-O 3.1Å; K225-I243 HydrophobicContact CG-CG1 4.29Å
226	R	73.2	Confident	69.8	Low	61 Å²	61	58.3 Å²	58.3	23%	0.23	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.7	170.9	-166.7	-169.8	-174.4	152	11.6	111.6	Y224 A241 F242 Q298	Y224-R226 HydrophobicContact CE1-CB 4.16Å; R226-A241 CarbonylContact O-C 3.5Å; R226-A241 WeakPolarHBondContact O-CA 3.36Å; R226-A241 VanDerWaalsContact O-CB 3.31Å; R226-A241 WeakPolarHBondContact O-CB 3.23Å; R226-F242 PolarHBondContact N-O 2.84Å; R226-F242 PolarHBondContact O-N 3.23Å; R226-Q298 VanDerWaalsContact NH1-CD 3.31Å
227	S	65.7	Low	68.5	Low	77 Å²	77	58.7 Å²	58.7	54%	0.538	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	143.5	170.7	-54.5	0	0	0	0	111.7	G240	S227-G240 WeakPolarHBondContact CA-O 3.45Å
228	C	58	Low	67.2	Low	14 Å²	14	63.8 Å²	63.8	10%	0.095	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	146.3	173.5	55	0	0	0	0	109.9	G240 L295	C228-G240 PolarHBondContact N-O 3.47Å; C228-G240 CarbonylContact O-C 3.48Å; C228-G240 PolarHBondContact O-N 2.99Å; C228-L295 HydrophobicContact CB-CD1 4.3Å
229	E	55.4	Low	66	Low	118 Å²	118	66.5 Å²	66.5	55%	0.551	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	130.3	170.1	-61.1	-155.9	173.2	0	0	109.6	L237	E229-L237 HydrophobicContact CB-CD2 4.21Å
230	M	57.6	Low	65.3	Low	19 Å²	19	58.9 Å²	58.9	9%	0.094	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125	-174.8	-55.6	-161.5	73.4	0	0	109.5	K192 C194 V232 R238 W288	K192-M230 HydrophobicContact CB-CE 3.73Å; K192-M230 HydrophobicContact CB-SD 4.06Å; K192-M230 HydrophobicContact CD-CE 3.73Å; K192-M230 HydrophobicContact CG-CE 4.35Å; C194-M230 HydrophobicContact CB-SD 4.2Å; M230-V232 PolarHBondContact O-N 3.29Å; M230-R238 PolarHBondContact N-O 3.36Å; M230-R238 PolarHBondContact O-N 2.85Å; M230-W288 HydrophobicContact CE-CE3 3.74Å; M230-W288 HydrophobicContact CE-CH2 4.13Å; M230-W288 HydrophobicContact CE-CZ3 3.44Å; M230-W288 VanDerWaalsContact CE-CZ3 3.44Å; M230-W288 HydrophobicContact SD-CZ3 4.48Å
231	S	52.8	Low	64.9	Low	59 Å²	59	56.5 Å²	56.5	41%	0.413	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	120.5	165.3	-164.8	0	0	0	0	108.5
232	V	57	Low	64.8	Low	26 Å²	26	55.5 Å²	55.5	16%	0.158	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.3	172	179	0	0	0	0	108.6	C194 M230 G234 I235 G236 R238	C194-V232 HydrophobicContact CB-CG2 4.36Å; M230-V232 PolarHBondContact O-N 3.29Å; V232-G234 PolarHBondContact O-N 2.74Å; V232-I235 HydrophobicContact CG1-CD1 4.34Å; V232-I235 PolarHBondContact O-N 2.66Å; V232-G236 PolarHBondContact N-O 2.78Å; V232-G236 VanDerWaalsContact N-O 3.08Å; V232-G236 PolarHBondContact O-N 3.29Å; V232-G236 VanDerWaalsContact O-N 3.1Å; V232-R238 HydrophobicContact CB-CG 4.49Å; V232-R238 HydrophobicContact CG2-CB 4.24Å; V232-R238 HydrophobicContact CG2-CG 4.32Å
233	D	49.4	Very low	64.8	Low	143 Å²	143	55.5 Å²	55.5	77%	0.765	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	130	-165.5	-53.1	-55.2	0	0	0	112.4	I235	D233-I235 PolarHBondContact O-N 3.05Å
234	G	48.6	Very low	64.7	Low	92 Å²	92	55.3 Å²	55.3	95%	0.948	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	2.2	-176	0	0	0	0	0	116.3	V232	V232-G234 PolarHBondContact O-N 2.74Å
235	I	48.8	Very low	64.9	Low	77 Å²	77	53.9 Å²	53.9	40%	0.395	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	-9.6	-178.1	-37.9	174	0	0	0	113.3	V232 D233 A1169	V232-I235 HydrophobicContact CG1-CD1 4.34Å; V232-I235 PolarHBondContact O-N 2.66Å; D233-I235 PolarHBondContact O-N 3.05Å; I235-A1169 HydrophobicContact CD1-CB 3.69Å; I235-A1169 HydrophobicContact CG1-CB 3.93Å
236	G	54.5	Low	64.9	Low	39 Å²	39	55 Å²	55	40%	0.402	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	82.1	-162.6	177.1	0	0	0	0	0	113.5	V232 R238	V232-G236 PolarHBondContact N-O 2.78Å; V232-G236 VanDerWaalsContact N-O 3.08Å; V232-G236 PolarHBondContact O-N 3.29Å; V232-G236 VanDerWaalsContact O-N 3.1Å; G236-R238 PolarHBondContact O-N 3.1Å
237	L	54.7	Low	65.3	Low	96 Å²	96	56.4 Å²	56.4	50%	0.503	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	123.3	-179.8	-70.2	164.7	0	0	0	110.9	E229	E229-L237 HydrophobicContact CB-CD2 4.21Å
238	R	58.6	Low	66.1	Low	114 Å²	114	53 Å²	53	43%	0.43	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.8	170.1	-70	-171.9	171.6	-156.2	0.6	109.7	M230 V232 G236 G240	M230-R238 PolarHBondContact N-O 3.36Å; M230-R238 PolarHBondContact O-N 2.85Å; V232-R238 HydrophobicContact CB-CG 4.49Å; V232-R238 HydrophobicContact CG2-CB 4.24Å; V232-R238 HydrophobicContact CG2-CG 4.32Å; G236-R238 PolarHBondContact O-N 3.1Å; R238-G240 PolarHBondContact O-N 3.2Å; R238-G240 VanDerWaalsContact O-N 3.08Å
239	V	62.4	Low	66.9	Low	102 Å²	102	53.2 Å²	53.2	62%	0.618	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	110	167.5	-173.7	0	0	0	0	108.7
240	G	65.9	Low	67.2	Low	5 Å²	5	48.5 Å²	48.5	5%	0.052	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-166.7	167	0	0	0	0	0	110.7	S227 C228 R238	S227-G240 WeakPolarHBondContact CA-O 3.45Å; C228-G240 PolarHBondContact N-O 3.47Å; C228-G240 CarbonylContact O-C 3.48Å; C228-G240 PolarHBondContact O-N 2.99Å; R238-G240 PolarHBondContact O-N 3.2Å; R238-G240 VanDerWaalsContact O-N 3.08Å
241	A	73	Confident	67.2	Low	5 Å²	5	54.3 Å²	54.3	4%	0.041	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	145.7	169.1	0	0	0	0	0	112	T193 K225 R226	T193-A241 HydrophobicContact CG2-CB 3.96Å; T193-A241 PolarHBondContact N-O 3.23Å; T193-A241 PolarHBondContact OG1-N 2.95Å; K225-A241 HydrophobicContact CG-CB 4.16Å; R226-A241 CarbonylContact O-C 3.5Å; R226-A241 WeakPolarHBondContact O-CA 3.36Å; R226-A241 VanDerWaalsContact O-CB 3.31Å; R226-A241 WeakPolarHBondContact O-CB 3.23Å
242	F	77.9	Confident	67.1	Low	12 Å²	12	59 Å²	59	5%	0.053	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.8	164.5	174.6	-82	0	0	0	109	H189 Y224 K225 R226 C244 W288	H189-F242 WeakPolarHBondContact O-CE2 3.43Å; Y224-F242 HydrophobicContact CD1-CD1 4.29Å; Y224-F242 HydrophobicContact CD1-CE1 4.23Å; Y224-F242 HydrophobicContact CE1-CD1 4.36Å; Y224-F242 HydrophobicContact CE1-CE1 4.44Å; K225-F242 WeakPolarHBondContact CA-O 3.1Å; R226-F242 PolarHBondContact N-O 2.84Å; R226-F242 PolarHBondContact O-N 3.23Å; F242-C244 HydrophobicContact CE1-CB 4.02Å; F242-C244 HydrophobicContact CZ-CB 4.38Å; F242-W288 HydrophobicContact CB-CH2 4.48Å; F242-W288 AromaticContact CD2-CH2 3.93Å; F242-W288 HydrophobicContact CD2-CH2 3.93Å; F242-W288 AromaticContact CD2-CZ2 3.95Å; F242-W288 HydrophobicContact CD2-CZ2 3.95Å
243	I	86.9	Confident	67	Low	2 Å²	2	59.6 Å²	59.6	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.3	178.7	-58.7	163.5	0	0	0	109.8	I183 G190 V191 T193 V214 L223 Y224 K225	I183-I243 HydrophobicContact CD1-CG2 4.15Å; I183-I243 HydrophobicContact CG2-CG2 4.3Å; G190-I243 CarbonylContact C-O 3.56Å; G190-I243 WeakPolarHBondContact CA-O 3.49Å; V191-I243 PolarHBondContact N-O 2.93Å; V191-I243 PolarHBondContact O-N 3.41Å; T193-I243 HydrophobicContact CG2-CD1 3.51Å; T193-I243 HydrophobicContact CG2-CG1 4.33Å; V214-I243 HydrophobicContact CB-CD1 4.43Å; V214-I243 HydrophobicContact CG1-CD1 3.82Å; V214-I243 HydrophobicContact CG1-CG1 4.22Å; V214-I243 HydrophobicContact CG2-CD1 3.79Å; L223-I243 HydrophobicContact CB-CG2 4.49Å; L223-I243 HydrophobicContact CD1-CG2 4.01Å; L223-I243 HydrophobicContact CD2-CG2 4.4Å; Y224-I243 WeakPolarHBondContact O-CA 3.18Å; K225-I243 HydrophobicContact CG-CG1 4.29Å
244	C	88.4	Confident	67.5	Low	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	175.8	169.3	66.9	0	0	0	0	110.2	R187 L223 Y224 F242	R187-C244 WeakPolarHBondContact O-CB 3.45Å; L223-C244 CarbonylContact C-O 3.57Å; L223-C244 WeakPolarHBondContact CA-O 3.4Å; Y224-C244 PolarHBondContact N-O 2.86Å; Y224-C244 PolarHBondContact O-N 3.3Å; F242-C244 HydrophobicContact CE1-CB 4.02Å; F242-C244 HydrophobicContact CZ-CB 4.38Å
245	L	89.2	Confident	68.1	Low	1 Å²	1	58.5 Å²	58.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	144.4	168.7	-55	-176.7	0	0	0	109.7	L29 I155 I183 A184 V222 L223 R247 F248 S249	L29-L245 HydrophobicContact CD2-CD1 4Å; I155-L245 HydrophobicContact CG2-CD2 4.34Å; I183-L245 HydrophobicContact CG2-CD2 4.16Å; A184-L245 HydrophobicContact CB-CD1 3.85Å; A184-L245 HydrophobicContact CB-CG 4.39Å; V222-L245 CarbonylContact O-C 3.54Å; V222-L245 WeakPolarHBondContact O-CA 3.44Å; L223-L245 HydrophobicContact CD2-CD2 3.8Å; L245-R247 HydrophobicContact CB-CG 3.94Å; L245-R247 HydrophobicContact CD1-CG 4.41Å; L245-R247 PolarHBondContact O-N 3.48Å; L245-F248 HydrophobicContact CB-CD2 3.97Å; L245-F248 HydrophobicContact CD1-CD2 4.02Å; L245-F248 HydrophobicContact CD1-CE2 3.94Å; L245-F248 HydrophobicContact CG-CD2 4.28Å; L245-F248 CarbonylContact O-C 3.01Å; L245-F248 WeakPolarHBondContact O-CA 3.29Å; L245-F248 PolarHBondContact O-N 3.43Å; L245-S249 PolarHBondContact O-N 2.97Å
246	Q	84.8	Confident	68.9	Low	94 Å²	94	56 Å²	56	44%	0.439	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-57.1	-38.6	-178.4	-178.6	69.4	-4.8	0	0	112.2	G221 V222 F248 S249	G221-Q246 WeakPolarHBondContact O-CB 3.33Å; G221-Q246 WeakPolarHBondContact O-CG 3.44Å; V222-Q246 PolarHBondContact O-N 2.87Å; Q246-F248 PolarHBondContact O-N 3.46Å; Q246-F248 VanDerWaalsContact O-N 3.14Å; Q246-S249 WeakPolarHBondContact O-CB 3.49Å; Q246-S249 PolarHBondContact O-N 3.17Å
247	R	81.7	Confident	69.4	Low	90 Å²	90	58 Å²	58	34%	0.34	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-62.3	-13.2	173.9	65.2	179.4	-63.2	-148.3	-3.1	115.3	D25 A154 L245	D25-R247 IonicContact OD1-CZ 3.29Å; D25-R247 IonicContact OD1-NH1 3.78Å; D25-R247 PolarHBondContact OD1-NH1 2.95Å; D25-R247 IonicContact OD1-NH2 3.72Å; D25-R247 PolarHBondContact OD1-NH2 2.9Å; D25-R247 IonicContact OD2-CZ 2.99Å; D25-R247 IonicContact OD2-NH1 2.69Å; D25-R247 PolarHBondContact OD2-NH1 3.19Å; D25-R247 IonicContact OD2-NH2 2.8Å; D25-R247 PolarHBondContact OD2-NH2 3.15Å; A154-R247 WeakPolarHBondContact O-CD 3.48Å; A154-R247 PolarHBondContact O-NH1 3.07Å; L245-R247 HydrophobicContact CB-CG 3.94Å; L245-R247 HydrophobicContact CD1-CG 4.41Å; L245-R247 PolarHBondContact O-N 3.48Å
248	F	82.7	Confident	70	Confident	5 Å²	5	57.2 Å²	57.2	2%	0.022	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-114.4	12.2	176	-61	-46.9	0	0	0	113.1	L29 R187 H188 L245 Q246	L29-F248 HydrophobicContact CD1-CE2 3.77Å; L29-F248 HydrophobicContact CD1-CZ 3.51Å; L29-F248 HydrophobicContact CD2-CE2 3.95Å; L29-F248 HydrophobicContact CD2-CZ 4.42Å; R187-F248 HydrophobicContact CB-CD2 4.01Å; R187-F248 HydrophobicContact CB-CE2 4.19Å; R187-F248 HydrophobicContact CB-CG 4.27Å; R187-F248 HydrophobicContact CG-CD2 4.25Å; R187-F248 HydrophobicContact CG-CE2 3.91Å; R187-F248 HydrophobicContact CG-CZ 4.21Å; R187-F248 WeakPolarHBondContact O-CB 3.15Å; H188-F248 AromaticContact CE1-CD1 3.54Å; H188-F248 PolarHBondContact ND1-O 3.25Å; H188-F248 AromaticContact NE2-CD1 3.59Å; L245-F248 HydrophobicContact CB-CD2 3.97Å; L245-F248 HydrophobicContact CD1-CD2 4.02Å; L245-F248 HydrophobicContact CD1-CE2 3.94Å; L245-F248 HydrophobicContact CG-CD2 4.28Å; L245-F248 CarbonylContact O-C 3.01Å; L245-F248 WeakPolarHBondContact O-CA 3.29Å; L245-F248 PolarHBondContact O-N 3.43Å; Q246-F248 PolarHBondContact O-N 3.46Å; Q246-F248 VanDerWaalsContact O-N 3.14Å
249	S	74.1	Confident	70.8	Confident	19 Å²	19	52 Å²	52	13%	0.133	26%	0.259	C	S	.	.			trans	-51.9	135.1	174.8	-174.3	0	0	0	0	111.2	Y224 L245 Q246 K251	Y224-S249 WeakPolarHBondContact CD2-OG 3.46Å; Y224-S249 VanDerWaalsContact CE2-OG 3.28Å; Y224-S249 WeakPolarHBondContact CE2-OG 3.42Å; L245-S249 PolarHBondContact O-N 2.97Å; Q246-S249 WeakPolarHBondContact O-CB 3.49Å; Q246-S249 PolarHBondContact O-N 3.17Å; S249-K251 PolarHBondContact O-N 3.11Å
250	P	63.2	Low	71.5	Confident	19 Å²	19	52.5 Å²	52.5	12%	0.123	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-68.7	-0.4	-171.1	27.2	-36.4	0	0	0	115.5	Y224 N252 R296	Y224-P250 HydrophobicContact CE1-CG 3.97Å; P250-N252 VanDerWaalsContact C-N 3.28Å; P250-N252 PolarHBondContact O-N 3.05Å; P250-R296 HydrophobicContact CB-CG 3.8Å
251	K	57.1	Low	72.2	Confident	141 Å²	141	60.3 Å²	60.3	61%	0.613	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-60.9	-30.6	-175.7	-68.3	-171.2	175.4	-172.4	0	114.3	S249	S249-K251 PolarHBondContact O-N 3.11Å
252	N	50.7	Low	72.7	Confident	158 Å²	158	60 Å²	60	85%	0.845	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-122	19.6	-171.3	-62.7	15.5	0	0	0	113.2	P250	P250-N252 VanDerWaalsContact C-N 3.28Å; P250-N252 PolarHBondContact O-N 3.05Å
253	M	55.4	Low	72.9	Confident	37 Å²	37	59.6 Å²	59.6	18%	0.182	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-87.9	138.8	-177.5	-160.9	176.6	-170.5	0	0	111.4	P48 H188 T256	P48-M253 HydrophobicContact CG-CE 3.75Å; P48-M253 HydrophobicContact CG-CG 4.09Å; H188-M253 HydrophobicContact CB-CE 3.8Å; H188-M253 HydrophobicContact CB-SD 3.69Å; M253-T256 HydrophobicContact CE-CG2 4.26Å
254	R	58.2	Low	72.8	Confident	160 Å²	160	63 Å²	63	60%	0.604	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-64.8	154.2	171.9	-66.3	-175.2	-178.5	168.3	3.5	111.4	E51 T256	E51-R254 IonicContact OE1-CZ 2.73Å; E51-R254 IonicContact OE1-NH1 3.68Å; E51-R254 PolarHBondContact OE1-NH1 3.5Å; E51-R254 IonicContact OE1-NH2 2.89Å; E51-R254 PolarHBondContact OE1-NH2 2.85Å; R254-T256 PolarHBondContact O-N 2.84Å
255	D	61.5	Low	72.7	Confident	52 Å²	52	65 Å²	65	28%	0.278	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-55.9	119.7	171.8	-56.1	-28.9	0	0	0	110.4	M259 K260 R300	D255-M259 HydrophobicContact CB-CB 4.26Å; D255-K260 HydrophobicContact CB-CG 3.69Å; D255-R300 IonicContact OD1-CZ 3.68Å; D255-R300 IonicContact OD1-NH1 3.27Å; D255-R300 PolarHBondContact OD1-NH1 3.16Å; D255-R300 IonicContact OD2-CZ 2.7Å; D255-R300 IonicContact OD2-NH1 3.72Å; D255-R300 PolarHBondContact OD2-NH1 3.47Å; D255-R300 IonicContact OD2-NH2 2.98Å
256	T	65.1	Low	72.5	Confident	25 Å²	25	65 Å²	65	15%	0.153	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-76.8	164	170.4	63.4	0	0	0	0	109.5	M253 R254 E258 M259 K260	M253-T256 HydrophobicContact CE-CG2 4.26Å; R254-T256 PolarHBondContact O-N 2.84Å; T256-E258 WeakPolarHBondContact CB-OE2 3.29Å; T256-E258 PolarHBondContact O-N 2.87Å; T256-E258 VanDerWaalsContact O-N 3.14Å; T256-E258 PolarHBondContact OG1-OE2 3.02Å; T256-M259 HydrophobicContact CG2-CE 3.67Å; T256-M259 WeakPolarHBondContact O-CA 3.43Å; T256-M259 WeakPolarHBondContact O-CB 3.38Å; T256-M259 PolarHBondContact O-N 2.59Å; T256-M259 VanDerWaalsContact OG1-CE 3.27Å; T256-M259 WeakPolarHBondContact OG1-CE 3.13Å; T256-K260 PolarHBondContact O-N 2.85Å
257	P	66.8	Low	72.5	Confident	80 Å²	80	67.1 Å²	67.1	52%	0.519	31%	0.306	S	S	.	.	H	α-helix	trans	-56.2	-33.4	-177	-26.7	36.6	0	0	0	113.7	K260 R261	P257-K260 PolarHBondContact O-N 2.8Å; P257-R261 WeakPolarHBondContact O-CB 3.3Å; P257-R261 VanDerWaalsContact O-CG 3.3Å; P257-R261 WeakPolarHBondContact O-CG 3.44Å; P257-R261 PolarHBondContact O-N 2.98Å
258	E	66.9	Low	72.7	Confident	81 Å²	81	67.1 Å²	67.1	38%	0.379	32%	0.32	S	S	.	.	H	α-helix	trans	-69.8	-39.5	177	-45.2	69.9	-140.5	0	0	110.9	T256 L262 L285	T256-E258 WeakPolarHBondContact CB-OE2 3.29Å; T256-E258 PolarHBondContact O-N 2.87Å; T256-E258 VanDerWaalsContact O-N 3.14Å; T256-E258 PolarHBondContact OG1-OE2 3.02Å; E258-L262 VanDerWaalsContact O-CB 3.27Å; E258-L262 WeakPolarHBondContact O-CB 3.47Å; E258-L262 PolarHBondContact O-N 3.38Å; E258-L285 HydrophobicContact CB-CD1 4.41Å; E258-L285 HydrophobicContact CB-CD2 4.11Å; E258-L285 HydrophobicContact CG-CD2 4Å
259	M	74.2	Confident	72.7	Confident	4 Å²	4	70 Å²	70	2%	0.02	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-40.1	174	-77.2	-171	-95.3	0	0	111.9	D255 T256 L262 L263 A293 R296 L297	D255-M259 HydrophobicContact CB-CB 4.26Å; T256-M259 HydrophobicContact CG2-CE 3.67Å; T256-M259 WeakPolarHBondContact O-CA 3.43Å; T256-M259 WeakPolarHBondContact O-CB 3.38Å; T256-M259 PolarHBondContact O-N 2.59Å; T256-M259 VanDerWaalsContact OG1-CE 3.27Å; T256-M259 WeakPolarHBondContact OG1-CE 3.13Å; M259-L262 PolarHBondContact O-N 3.11Å; M259-L263 WeakPolarHBondContact O-CB 3.42Å; M259-L263 WeakPolarHBondContact O-CD1 3.36Å; M259-L263 WeakPolarHBondContact O-CG 3.49Å; M259-L263 PolarHBondContact O-N 3.17Å; M259-A293 HydrophobicContact CG-CB 4.14Å; M259-R296 HydrophobicContact CE-CB 3.89Å; M259-R296 HydrophobicContact CE-CG 4.24Å; M259-R296 HydrophobicContact SD-CB 3.5Å; M259-R296 WeakPolarHBondContact SD-CB 3.47Å; M259-R296 HydrophobicContact SD-CG 4.44Å; M259-L297 HydrophobicContact CB-CD1 3.86Å; M259-L297 HydrophobicContact CB-CD2 4.18Å; M259-L297 HydrophobicContact CB-CG 4.14Å; M259-L297 HydrophobicContact CG-CD1 3.77Å; M259-L297 HydrophobicContact CG-CD2 4.24Å; M259-L297 HydrophobicContact CG-CG 3.79Å; M259-L297 HydrophobicContact SD-CD1 4.31Å; M259-L297 HydrophobicContact SD-CD2 3.84Å; M259-L297 HydrophobicContact SD-CG 3.63Å
260	K	78.4	Confident	72.8	Confident	113 Å²	113	75.4 Å²	75.4	49%	0.491	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-53.9	174.1	-67.8	-168.9	178.5	-174.3	0	110.8	D255 T256 P257 L262 L263 D264	D255-K260 HydrophobicContact CB-CG 3.69Å; T256-K260 PolarHBondContact O-N 2.85Å; P257-K260 PolarHBondContact O-N 2.8Å; K260-L262 VanDerWaalsContact C-N 3.27Å; K260-L262 PolarHBondContact O-N 3.35Å; K260-L263 CarbonylContact O-C 3.54Å; K260-L263 WeakPolarHBondContact O-CB 3.33Å; K260-L263 PolarHBondContact O-N 3.21Å; K260-D264 WeakPolarHBondContact O-CB 3.46Å; K260-D264 PolarHBondContact O-N 3.43Å; K260-D264 VanDerWaalsContact O-OD2 3.04Å
261	R	80.8	Confident	73.4	Confident	168 Å²	168	79.1 Å²	79.1	63%	0.634	38%	0.384	S	S	*	.	H	α-helix	trans	-53.7	-41.6	175.4	-71.3	174	179.7	-178.3	-0.6	112.7	P257 D264 Y265 L283	P257-R261 WeakPolarHBondContact O-CB 3.3Å; P257-R261 VanDerWaalsContact O-CG 3.3Å; P257-R261 WeakPolarHBondContact O-CG 3.44Å; P257-R261 PolarHBondContact O-N 2.98Å; R261-D264 PolarHBondContact O-N 2.73Å; R261-Y265 WeakPolarHBondContact O-CB 3.4Å; R261-Y265 PolarHBondContact O-N 3.26Å; R261-L283 HydrophobicContact CB-CD2 4Å
262	L	82.2	Confident	74.7	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-64.8	-45.5	175.6	-175.5	149	0	0	0	112.4	E258 M259 K260 D264 I266 L279 L283 L290 A293 L297 V301	E258-L262 VanDerWaalsContact O-CB 3.27Å; E258-L262 WeakPolarHBondContact O-CB 3.47Å; E258-L262 PolarHBondContact O-N 3.38Å; M259-L262 PolarHBondContact O-N 3.11Å; K260-L262 VanDerWaalsContact C-N 3.27Å; K260-L262 PolarHBondContact O-N 3.35Å; L262-D264 VanDerWaalsContact C-N 3.33Å; L262-I266 HydrophobicContact CD2-CD1 3.49Å; L262-I266 VanDerWaalsContact CD2-CD1 3.49Å; L262-I266 HydrophobicContact CG-CD1 3.98Å; L262-I266 WeakPolarHBondContact O-CB 3.48Å; L262-I266 WeakPolarHBondContact O-CG1 3.37Å; L262-I266 PolarHBondContact O-N 3.32Å; L262-L279 HydrophobicContact CD1-CD1 4.44Å; L262-L283 HydrophobicContact CB-CD1 3.63Å; L262-L283 HydrophobicContact CD1-CD1 3.93Å; L262-L283 HydrophobicContact CG-CD1 3.93Å; L262-L290 HydrophobicContact CD1-CD1 3.33Å; L262-A293 HydrophobicContact CD1-CB 4.07Å; L262-L297 HydrophobicContact CD2-CD1 3.76Å; L262-V301 HydrophobicContact CD2-CG2 4.29Å
263	L	83.6	Confident	76.3	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-39.9	176.6	-72.3	164.1	0	0	0	111.7	M259 K260 R267 L297 R300 V301 L331	M259-L263 WeakPolarHBondContact O-CB 3.42Å; M259-L263 WeakPolarHBondContact O-CD1 3.36Å; M259-L263 WeakPolarHBondContact O-CG 3.49Å; M259-L263 PolarHBondContact O-N 3.17Å; K260-L263 CarbonylContact O-C 3.54Å; K260-L263 WeakPolarHBondContact O-CB 3.33Å; K260-L263 PolarHBondContact O-N 3.21Å; L263-R267 WeakPolarHBondContact O-CB 3.14Å; L263-R267 WeakPolarHBondContact O-CD 3.22Å; L263-R267 WeakPolarHBondContact O-CG 3.47Å; L263-R267 PolarHBondContact O-N 3.05Å; L263-L297 HydrophobicContact CD1-CD1 4.26Å; L263-L297 HydrophobicContact CD1-CD2 3.77Å; L263-L297 HydrophobicContact CD2-CD1 4.14Å; L263-L297 HydrophobicContact CD2-CD2 4.29Å; L263-L297 HydrophobicContact CG-CD1 3.87Å; L263-L297 HydrophobicContact CG-CD2 4.2Å; L263-R300 HydrophobicContact CD2-CB 4.39Å; L263-V301 HydrophobicContact CD2-CG2 3.8Å; L263-L331 HydrophobicContact CD2-CD2 3.67Å
264	D	83.7	Confident	77.7	Confident	73 Å²	73	68.2 Å²	68.2	39%	0.39	33%	0.33	S	S	.	.	H	α-helix	trans	-76.5	-37.1	-176	-62.5	-32.4	0	0	0	111.7	K260 R261 L262 R267 S268	K260-D264 WeakPolarHBondContact O-CB 3.46Å; K260-D264 PolarHBondContact O-N 3.43Å; K260-D264 VanDerWaalsContact O-OD2 3.04Å; R261-D264 PolarHBondContact O-N 2.73Å; L262-D264 VanDerWaalsContact C-N 3.33Å; D264-R267 WeakPolarHBondContact O-CB 3.4Å; D264-R267 PolarHBondContact O-N 2.91Å; D264-R267 WeakPolarHBondContact OD1-CD 3.49Å; D264-R267 IonicContact OD1-CZ 3.2Å; D264-R267 IonicContact OD1-NE 2.7Å; D264-R267 IonicContact OD1-NH1 2.79Å; D264-R267 PolarHBondContact OD1-NH1 2.73Å; D264-S268 PolarHBondContact O-N 3.15Å; D264-S268 PolarHBondContact O-OG 2.92Å
265	Y	86.2	Confident	78.8	Confident	43 Å²	43	60.7 Å²	60.7	17%	0.169	30%	0.302	C	S	.	.	H	α-helix	trans	-65.7	-40.7	169.9	-170.5	-78.4	0	0	0	112	R261 R267 S268 R269 C274 L279 E282 L283	R261-Y265 WeakPolarHBondContact O-CB 3.4Å; R261-Y265 PolarHBondContact O-N 3.26Å; Y265-R267 VanDerWaalsContact C-N 3.28Å; Y265-R267 PolarHBondContact O-N 2.92Å; Y265-S268 PolarHBondContact O-N 3.18Å; Y265-S268 PolarHBondContact O-OG 2.81Å; Y265-R269 HydrophobicContact CD1-CG 4.22Å; Y265-R269 HydrophobicContact CE1-CG 3.86Å; Y265-R269 WeakPolarHBondContact O-CG 3.45Å; Y265-R269 PolarHBondContact O-N 3.38Å; Y265-R269 VanDerWaalsContact O-N 3.16Å; Y265-R269 PolarHBondContact OH-NE 2.74Å; Y265-R269 PolarHBondContact OH-NH2 2.61Å; Y265-C274 HydrophobicContact CE1-CB 4.46Å; Y265-C274 VanDerWaalsContact CE1-SG 3.55Å; Y265-L279 HydrophobicContact CD1-CD2 3.8Å; Y265-L279 HydrophobicContact CE1-CD2 4.37Å; Y265-E282 HydrophobicContact CD2-CB 4.35Å; Y265-E282 HydrophobicContact CE2-CB 3.78Å; Y265-E282 HydrophobicContact CE2-CG 3.79Å; Y265-E282 VanDerWaalsContact CE2-OE1 3.24Å; Y265-E282 WeakPolarHBondContact CE2-OE1 3.09Å; Y265-E282 VanDerWaalsContact CZ-OE1 3.25Å; Y265-E282 WeakPolarHBondContact OH-CG 3.35Å; Y265-E282 PolarHBondContact OH-OE1 3.17Å; Y265-L283 HydrophobicContact CG-CD2 4.46Å
266	I	85	Confident	79.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-72.8	-22.3	174.5	-61.1	172.7	0	0	0	111.2	L262 K272 C274 L279 V329 L331	L262-I266 HydrophobicContact CD2-CD1 3.49Å; L262-I266 VanDerWaalsContact CD2-CD1 3.49Å; L262-I266 HydrophobicContact CG-CD1 3.98Å; L262-I266 WeakPolarHBondContact O-CB 3.48Å; L262-I266 WeakPolarHBondContact O-CG1 3.37Å; L262-I266 PolarHBondContact O-N 3.32Å; I266-K272 WeakPolarHBondContact CG2-O 3.39Å; I266-K272 WeakPolarHBondContact O-CA 3.24Å; I266-C274 HydrophobicContact CG1-CB 4.1Å; I266-L279 HydrophobicContact CD1-CD1 3.94Å; I266-L279 HydrophobicContact CD1-CD2 4.38Å; I266-L279 HydrophobicContact CG1-CD1 4.4Å; I266-L279 HydrophobicContact CG1-CD2 4.08Å; I266-V329 HydrophobicContact CD1-CB 4.11Å; I266-V329 HydrophobicContact CD1-CG1 3.66Å; I266-L331 HydrophobicContact CB-CD1 4.32Å; I266-L331 HydrophobicContact CB-CG 4.4Å; I266-L331 HydrophobicContact CG2-CD1 3.81Å; I266-L331 HydrophobicContact CG2-CG 3.71Å
267	R	85.9	Confident	80.4	Confident	139 Å²	139	61.9 Å²	61.9	53%	0.525	31%	0.313	S	S	.	.	H	α-helix	trans	-73.9	-33.6	170.2	-79.6	158.7	166.8	170.6	-11.2	112.9	L263 D264 Y265 L331	L263-R267 WeakPolarHBondContact O-CB 3.14Å; L263-R267 WeakPolarHBondContact O-CD 3.22Å; L263-R267 WeakPolarHBondContact O-CG 3.47Å; L263-R267 PolarHBondContact O-N 3.05Å; D264-R267 WeakPolarHBondContact O-CB 3.4Å; D264-R267 PolarHBondContact O-N 2.91Å; D264-R267 WeakPolarHBondContact OD1-CD 3.49Å; D264-R267 IonicContact OD1-CZ 3.2Å; D264-R267 IonicContact OD1-NE 2.7Å; D264-R267 IonicContact OD1-NH1 2.79Å; D264-R267 PolarHBondContact OD1-NH1 2.73Å; Y265-R267 VanDerWaalsContact C-N 3.28Å; Y265-R267 PolarHBondContact O-N 2.92Å; R267-L331 HydrophobicContact CG-CD1 3.8Å
268	S	85.1	Confident	81.2	Confident	91 Å²	91	60.3 Å²	60.3	64%	0.636	30%	0.3	S	S	*	.	H	α-helix	trans	-80.1	-23.6	178.4	59.1	0	0	0	0	113.4	D264 Y265	D264-S268 PolarHBondContact O-N 3.15Å; D264-S268 PolarHBondContact O-OG 2.92Å; Y265-S268 PolarHBondContact O-N 3.18Å; Y265-S268 PolarHBondContact O-OG 2.81Å
269	R	83.3	Confident	81.9	Confident	66 Å²	66	56.4 Å²	56.4	25%	0.249	28%	0.282	C	S	.	.	S	Bend	trans	-66.4	128.3	169.1	-74.6	-81.6	-178.3	120.6	0.5	110.2	Y265 D271 K272 C273 C274 D278	Y265-R269 HydrophobicContact CD1-CG 4.22Å; Y265-R269 HydrophobicContact CE1-CG 3.86Å; Y265-R269 WeakPolarHBondContact O-CG 3.45Å; Y265-R269 PolarHBondContact O-N 3.38Å; Y265-R269 VanDerWaalsContact O-N 3.16Å; Y265-R269 PolarHBondContact OH-NE 2.74Å; Y265-R269 PolarHBondContact OH-NH2 2.61Å; R269-D271 VanDerWaalsContact C-N 3.31Å; R269-D271 WeakPolarHBondContact CB-OD1 3.41Å; R269-D271 PolarHBondContact O-N 2.87Å; R269-K272 PolarHBondContact O-N 3.32Å; R269-C273 VanDerWaalsContact CB-O 3.3Å; R269-C273 WeakPolarHBondContact CB-O 3.37Å; R269-C274 HydrophobicContact CG-CB 4.38Å; R269-C274 VanDerWaalsContact CZ-SG 3.51Å; R269-D278 IonicContact CZ-OD2 3.14Å; R269-D278 VanDerWaalsContact CZ-OD2 3.26Å; R269-D278 IonicContact NH1-OD2 2.75Å; R269-D278 PolarHBondContact NH1-OD2 2.95Å; R269-D278 IonicContact NH2-OD2 2.8Å; R269-D278 PolarHBondContact NH2-OD2 2.93Å
270	P	75.8	Confident	82.3	Confident	132 Å²	132	58.9 Å²	58.9	86%	0.857	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-24.4	-167.6	27.5	-36	0	0	0	114.4	K272	P270-K272 VanDerWaalsContact C-N 3.31Å
271	D	76.7	Confident	82.5	Confident	96 Å²	96	60.8 Å²	60.8	51%	0.513	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-4.6	174.1	61.8	-10.1	0	0	0	113.2	R269 C273	R269-D271 VanDerWaalsContact C-N 3.31Å; R269-D271 WeakPolarHBondContact CB-OD1 3.41Å; R269-D271 PolarHBondContact O-N 2.87Å; D271-C273 PolarHBondContact O-N 2.7Å; D271-C273 PolarHBondContact OD1-N 3.18Å; D271-C273 PolarHBondContact OD2-SG 2.88Å
272	K	84.2	Confident	82.5	Confident	92 Å²	92	57.9 Å²	57.9	40%	0.4	30%	0.299	S	S	.	.	S	Bend	trans	55.1	32.3	-171	-66.4	170.5	-178.1	164.2	0	113.3	I266 R269 P270 C330 L331 E333	I266-K272 WeakPolarHBondContact CG2-O 3.39Å; I266-K272 WeakPolarHBondContact O-CA 3.24Å; R269-K272 PolarHBondContact O-N 3.32Å; P270-K272 VanDerWaalsContact C-N 3.31Å; K272-C330 WeakPolarHBondContact O-CA 3.5Å; K272-L331 HydrophobicContact CB-CB 4.41Å; K272-L331 HydrophobicContact CB-CD1 4.22Å; K272-L331 HydrophobicContact CG-CD1 4.41Å; K272-L331 PolarHBondContact O-N 2.92Å; K272-E333 VanDerWaalsContact CD-OE1 3.24Å; K272-E333 WeakPolarHBondContact CD-OE1 3.44Å; K272-E333 WeakPolarHBondContact CE-OE1 3.09Å; K272-E333 IonicContact NZ-OE1 3.63Å; K272-E333 PolarHBondContact NZ-OE1 2.81Å
273	C	82.9	Confident	82.4	Confident	12 Å²	12	58.9 Å²	58.9	8%	0.081	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	168.3	170.8	53.4	0	0	0	0	113.8	R269 D271 I328 V329 C330	R269-C273 VanDerWaalsContact CB-O 3.3Å; R269-C273 WeakPolarHBondContact CB-O 3.37Å; D271-C273 PolarHBondContact O-N 2.7Å; D271-C273 PolarHBondContact OD1-N 3.18Å; D271-C273 PolarHBondContact OD2-SG 2.88Å; C273-I328 HydrophobicContact CB-CG2 3.57Å; C273-V329 CarbonylContact C-O 3.55Å; C273-V329 WeakPolarHBondContact CA-O 3.46Å; C273-V329 WeakPolarHBondContact CB-O 3.43Å; C273-C330 HydrophobicContact CB-CB 3.87Å; C273-C330 WeakPolarHBondContact CB-SG 3.11Å
274	C	84.5	Confident	82.2	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.02	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	150.2	-176.7	-166.9	0	0	0	0	110.3	Y265 I266 R269 D278 L279 I328 V329	Y265-C274 HydrophobicContact CE1-CB 4.46Å; Y265-C274 VanDerWaalsContact CE1-SG 3.55Å; I266-C274 HydrophobicContact CG1-CB 4.1Å; R269-C274 HydrophobicContact CG-CB 4.38Å; R269-C274 VanDerWaalsContact CZ-SG 3.51Å; C274-D278 WeakPolarHBondContact SG-CB 3.43Å; C274-L279 HydrophobicContact CB-CD1 4.09Å; C274-L279 HydrophobicContact CB-CD2 3.93Å; C274-L279 HydrophobicContact CB-CG 3.87Å; C274-I328 CarbonylContact O-C 3.55Å; C274-I328 WeakPolarHBondContact O-CA 3.47Å; C274-V329 PolarHBondContact N-O 3.2Å; C274-V329 PolarHBondContact O-N 3.14Å
275	S	82.2	Confident	81.6	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	152.5	176.9	109.9	0	0	0	0	111.6	S277 D278 L279 E327	S275-S277 PolarHBondContact O-N 3.13Å; S275-S277 WeakPolarHBondContact OG-CB 3.22Å; S275-S277 PolarHBondContact OG-N 3.25Å; S275-D278 WeakPolarHBondContact CB-OD1 3.26Å; S275-D278 PolarHBondContact O-N 3.34Å; S275-D278 PolarHBondContact OG-N 2.77Å; S275-D278 PolarHBondContact OG-OD1 2.76Å; S275-L279 WeakPolarHBondContact O-CB 3.42Å; S275-L279 VanDerWaalsContact O-CG 3.29Å; S275-L279 WeakPolarHBondContact O-CG 3.34Å; S275-L279 PolarHBondContact O-N 2.92Å; S275-E327 CarbonylContact C-O 3.56Å
276	K	82	Confident	80.8	Confident	18 Å²	18	68 Å²	68	8%	0.078	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-23.5	172.3	-76.3	-166.4	-169.1	169	0	112.8	I280 L290 E291 I294 E327 V329	K276-I280 WeakPolarHBondContact O-CB 3.44Å; K276-I280 WeakPolarHBondContact O-CD1 3.31Å; K276-I280 VanDerWaalsContact O-CG1 3.28Å; K276-I280 WeakPolarHBondContact O-CG1 3.17Å; K276-I280 PolarHBondContact O-N 3.35Å; K276-L290 HydrophobicContact CB-CD2 3.76Å; K276-L290 HydrophobicContact CD-CD2 4.4Å; K276-L290 HydrophobicContact CG-CD2 3.87Å; K276-L290 VanDerWaalsContact O-CD2 3.25Å; K276-L290 WeakPolarHBondContact O-CD2 3.08Å; K276-E291 IonicContact NZ-OE1 2.87Å; K276-E291 PolarHBondContact NZ-OE1 3.17Å; K276-E291 IonicContact NZ-OE2 2.81Å; K276-I294 HydrophobicContact CD-CD1 4.34Å; K276-I294 HydrophobicContact CG-CD1 4.37Å; K276-E327 HydrophobicContact CB-CB 4.36Å; K276-E327 HydrophobicContact CD-CB 3.7Å; K276-E327 HydrophobicContact CD-CG 4.45Å; K276-E327 WeakPolarHBondContact CD-OE2 3.46Å; K276-E327 WeakPolarHBondContact CE-OE2 3.04Å; K276-E327 HydrophobicContact CG-CB 3.82Å; K276-E327 PolarHBondContact N-O 2.99Å; K276-E327 IonicContact NZ-OE1 3.64Å; K276-E327 PolarHBondContact NZ-OE1 3.1Å; K276-E327 IonicContact NZ-OE2 3.24Å; K276-E327 PolarHBondContact NZ-OE2 3.17Å; K276-V329 HydrophobicContact CG-CG2 3.61Å
277	S	78.2	Confident	80	Confident	83 Å²	83	73 Å²	73	58%	0.58	37%	0.368	S	S	*	.	H	α-helix	trans	-73.4	-54.2	176.6	-54.7	0	0	0	0	110.3	S275 L279 I280 E281	S275-S277 PolarHBondContact O-N 3.13Å; S275-S277 WeakPolarHBondContact OG-CB 3.22Å; S275-S277 PolarHBondContact OG-N 3.25Å; S277-L279 PolarHBondContact O-N 2.72Å; S277-I280 WeakPolarHBondContact O-CB 3.21Å; S277-I280 PolarHBondContact O-N 3.07Å; S277-E281 PolarHBondContact O-N 3.04Å; S277-E281 VanDerWaalsContact O-N 3.07Å
278	D	82.7	Confident	79	Confident	47 Å²	47	68 Å²	68	25%	0.251	35%	0.35	S	S	.	.	H	α-helix	trans	-49.9	-47.3	173.3	-55.9	37.3	0	0	0	110.7	R269 C274 S275 I280 E281 E282	R269-D278 IonicContact CZ-OD2 3.14Å; R269-D278 VanDerWaalsContact CZ-OD2 3.26Å; R269-D278 IonicContact NH1-OD2 2.75Å; R269-D278 PolarHBondContact NH1-OD2 2.95Å; R269-D278 IonicContact NH2-OD2 2.8Å; R269-D278 PolarHBondContact NH2-OD2 2.93Å; C274-D278 WeakPolarHBondContact SG-CB 3.43Å; S275-D278 WeakPolarHBondContact CB-OD1 3.26Å; S275-D278 PolarHBondContact O-N 3.34Å; S275-D278 PolarHBondContact OG-N 2.77Å; S275-D278 PolarHBondContact OG-OD1 2.76Å; D278-I280 VanDerWaalsContact C-N 3.33Å; D278-I280 PolarHBondContact O-N 2.76Å; D278-E281 PolarHBondContact O-N 3.35Å; D278-E282 VanDerWaalsContact O-CB 3.25Å; D278-E282 WeakPolarHBondContact O-CB 3.31Å; D278-E282 WeakPolarHBondContact O-CG 3.02Å; D278-E282 PolarHBondContact O-N 3.38Å
279	L	83.2	Confident	78.1	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-70.1	-22.9	-179.3	-69.7	175.5	0	0	0	114.4	L262 Y265 I266 C274 S275 S277 L283 L290 V329	L262-L279 HydrophobicContact CD1-CD1 4.44Å; Y265-L279 HydrophobicContact CD1-CD2 3.8Å; Y265-L279 HydrophobicContact CE1-CD2 4.37Å; I266-L279 HydrophobicContact CD1-CD1 3.94Å; I266-L279 HydrophobicContact CD1-CD2 4.38Å; I266-L279 HydrophobicContact CG1-CD1 4.4Å; I266-L279 HydrophobicContact CG1-CD2 4.08Å; C274-L279 HydrophobicContact CB-CD1 4.09Å; C274-L279 HydrophobicContact CB-CD2 3.93Å; C274-L279 HydrophobicContact CB-CG 3.87Å; S275-L279 WeakPolarHBondContact O-CB 3.42Å; S275-L279 VanDerWaalsContact O-CG 3.29Å; S275-L279 WeakPolarHBondContact O-CG 3.34Å; S275-L279 PolarHBondContact O-N 2.92Å; S277-L279 PolarHBondContact O-N 2.72Å; L279-L283 HydrophobicContact CB-CD1 4.3Å; L279-L283 HydrophobicContact CD2-CD1 3.95Å; L279-L283 HydrophobicContact CD2-CG 4.34Å; L279-L283 VanDerWaalsContact O-CB 3.24Å; L279-L283 WeakPolarHBondContact O-CB 3.19Å; L279-L283 WeakPolarHBondContact O-CG 2.83Å; L279-L290 HydrophobicContact CB-CD1 4.02Å; L279-L290 HydrophobicContact CB-CD2 3.87Å; L279-L290 HydrophobicContact CD1-CD1 4.22Å; L279-V329 HydrophobicContact CD1-CB 3.6Å; L279-V329 HydrophobicContact CD1-CG1 4.05Å; L279-V329 HydrophobicContact CD1-CG2 3.67Å
280	I	82.5	Confident	77.8	Confident	55 Å²	55	61 Å²	61	28%	0.282	31%	0.311	S	S	.	.	H	α-helix	trans	-73.3	-45.6	171	-83.4	166	0	0	0	109.5	K276 S277 D278 K284 L285 K287 L290	K276-I280 WeakPolarHBondContact O-CB 3.44Å; K276-I280 WeakPolarHBondContact O-CD1 3.31Å; K276-I280 VanDerWaalsContact O-CG1 3.28Å; K276-I280 WeakPolarHBondContact O-CG1 3.17Å; K276-I280 PolarHBondContact O-N 3.35Å; S277-I280 WeakPolarHBondContact O-CB 3.21Å; S277-I280 PolarHBondContact O-N 3.07Å; D278-I280 VanDerWaalsContact C-N 3.33Å; D278-I280 PolarHBondContact O-N 2.76Å; I280-K284 VanDerWaalsContact O-CA 3.29Å; I280-K284 WeakPolarHBondContact O-CA 3.31Å; I280-K284 PolarHBondContact O-N 3.03Å; I280-K284 VanDerWaalsContact O-N 3.17Å; I280-L285 WeakPolarHBondContact CG2-O 3.5Å; I280-L285 PolarHBondContact O-N 3.33Å; I280-L285 VanDerWaalsContact O-N 3.07Å; I280-K287 HydrophobicContact CD1-CB 3.97Å; I280-K287 HydrophobicContact CD1-CG 4.09Å; I280-L290 HydrophobicContact CD1-CD2 4.3Å; I280-L290 HydrophobicContact CG1-CB 4.31Å; I280-L290 HydrophobicContact CG1-CD2 3.83Å
281	E	81.5	Confident	77.5	Confident	153 Å²	153	56.3 Å²	56.3	72%	0.715	28%	0.278	S	S	*	.	H	α-helix	trans	-71.5	-52.9	-175.2	-171.4	161.5	-160.1	0	0	112.4	S277 D278 K284	S277-E281 PolarHBondContact O-N 3.04Å; S277-E281 VanDerWaalsContact O-N 3.07Å; D278-E281 PolarHBondContact O-N 3.35Å; E281-K284 WeakPolarHBondContact O-CG 3.27Å; E281-K284 PolarHBondContact O-N 2.62Å
282	E	81.9	Confident	77.1	Confident	107 Å²	107	53.1 Å²	53.1	50%	0.5	26%	0.259	S	S	.	.	H	α-helix	trans	-69.6	-45.8	-176	-71.5	-90.5	-128.4	0	0	112.7	Y265 D278 K284	Y265-E282 HydrophobicContact CD2-CB 4.35Å; Y265-E282 HydrophobicContact CE2-CB 3.78Å; Y265-E282 HydrophobicContact CE2-CG 3.79Å; Y265-E282 VanDerWaalsContact CE2-OE1 3.24Å; Y265-E282 WeakPolarHBondContact CE2-OE1 3.09Å; Y265-E282 VanDerWaalsContact CZ-OE1 3.25Å; Y265-E282 WeakPolarHBondContact OH-CG 3.35Å; Y265-E282 PolarHBondContact OH-OE1 3.17Å; D278-E282 VanDerWaalsContact O-CB 3.25Å; D278-E282 WeakPolarHBondContact O-CB 3.31Å; D278-E282 WeakPolarHBondContact O-CG 3.02Å; D278-E282 PolarHBondContact O-N 3.38Å; E282-K284 PolarHBondContact O-N 3.46Å
283	L	78.8	Confident	76.5	Confident	22 Å²	22	49 Å²	49	12%	0.115	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.7	178.6	-52.6	177.7	0	0	0	112.6	R261 L262 Y265 L279 L285	R261-L283 HydrophobicContact CB-CD2 4Å; L262-L283 HydrophobicContact CB-CD1 3.63Å; L262-L283 HydrophobicContact CD1-CD1 3.93Å; L262-L283 HydrophobicContact CG-CD1 3.93Å; Y265-L283 HydrophobicContact CG-CD2 4.46Å; L279-L283 HydrophobicContact CB-CD1 4.3Å; L279-L283 HydrophobicContact CD2-CD1 3.95Å; L279-L283 HydrophobicContact CD2-CG 4.34Å; L279-L283 VanDerWaalsContact O-CB 3.24Å; L279-L283 WeakPolarHBondContact O-CB 3.19Å; L279-L283 WeakPolarHBondContact O-CG 2.83Å; L283-L285 HydrophobicContact CB-CB 4.45Å; L283-L285 HydrophobicContact CB-CD1 3.82Å; L283-L285 HydrophobicContact CB-CG 3.74Å; L283-L285 HydrophobicContact CD1-CD1 3.77Å; L283-L285 HydrophobicContact CG-CD1 4.49Å; L283-L285 PolarHBondContact O-N 3.32Å
284	K	79.1	Confident	76.1	Confident	190 Å²	190	49 Å²	49	83%	0.826	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	43	-174.6	-59	178.8	-177.4	179.2	0	111.6	I280 E281 E282	I280-K284 VanDerWaalsContact O-CA 3.29Å; I280-K284 WeakPolarHBondContact O-CA 3.31Å; I280-K284 PolarHBondContact O-N 3.03Å; I280-K284 VanDerWaalsContact O-N 3.17Å; E281-K284 WeakPolarHBondContact O-CG 3.27Å; E281-K284 PolarHBondContact O-N 2.62Å; E282-K284 PolarHBondContact O-N 3.46Å
285	L	71.2	Confident	75.3	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.141	25%	0.247	C	C	.	.			trans	-101.5	138.1	179.3	-68.9	178.1	0	0	0	110.2	E258 I280 L283	E258-L285 HydrophobicContact CB-CD1 4.41Å; E258-L285 HydrophobicContact CB-CD2 4.11Å; E258-L285 HydrophobicContact CG-CD2 4Å; I280-L285 WeakPolarHBondContact CG2-O 3.5Å; I280-L285 PolarHBondContact O-N 3.33Å; I280-L285 VanDerWaalsContact O-N 3.07Å; L283-L285 HydrophobicContact CB-CB 4.45Å; L283-L285 HydrophobicContact CB-CD1 3.82Å; L283-L285 HydrophobicContact CB-CG 3.74Å; L283-L285 HydrophobicContact CD1-CD1 3.77Å; L283-L285 HydrophobicContact CG-CD1 4.49Å; L283-L285 PolarHBondContact O-N 3.32Å
286	D	70.2	Confident	74.7	Confident	91 Å²	91	51.6 Å²	51.6	49%	0.487	25%	0.252	S	S	.	.			trans	-68.3	162.1	168.5	91.9	-73.4	0	0	0	110.9	W288 G289 L290	D286-W288 PolarHBondContact O-N 3.09Å; D286-W288 VanDerWaalsContact O-N 3.16Å; D286-W288 WeakPolarHBondContact OD2-CA 3.4Å; D286-W288 WeakPolarHBondContact OD2-CB 3.41Å; D286-W288 PolarHBondContact OD2-N 2.85Å; D286-G289 WeakPolarHBondContact O-CA 3.43Å; D286-G289 PolarHBondContact O-N 2.92Å; D286-G289 VanDerWaalsContact OD1-CA 3.31Å; D286-G289 WeakPolarHBondContact OD1-CA 3.3Å; D286-G289 PolarHBondContact OD1-N 3.29Å; D286-L290 PolarHBondContact O-N 3.45Å
287	K	67.6	Low	74.2	Confident	105 Å²	105	51 Å²	51	46%	0.457	25%	0.25	S	C	.	.	H	α-helix	trans	-59.4	-30.3	-177.3	-169.2	167.3	-173.3	169.3	0	113.2	I280 E291	I280-K287 HydrophobicContact CD1-CB 3.97Å; I280-K287 HydrophobicContact CD1-CG 4.09Å; K287-E291 WeakPolarHBondContact O-CG 3.4Å; K287-E291 PolarHBondContact O-N 3.47Å
288	W	64.8	Low	73.7	Confident	36 Å²	36	50 Å²	50	14%	0.136	24%	0.236	C	C	.	.	H	α-helix	trans	-77.6	-38.3	173.5	179.2	-115.9	0	0	0	112.3	K192 M230 F242 D286 L290 E291 R292	K192-W288 HydrophobicContact CB-CH2 4.34Å; K192-W288 HydrophobicContact CB-CZ2 4.48Å; M230-W288 HydrophobicContact CE-CE3 3.74Å; M230-W288 HydrophobicContact CE-CH2 4.13Å; M230-W288 HydrophobicContact CE-CZ3 3.44Å; M230-W288 VanDerWaalsContact CE-CZ3 3.44Å; M230-W288 HydrophobicContact SD-CZ3 4.48Å; F242-W288 HydrophobicContact CB-CH2 4.48Å; F242-W288 AromaticContact CD2-CH2 3.93Å; F242-W288 HydrophobicContact CD2-CH2 3.93Å; F242-W288 AromaticContact CD2-CZ2 3.95Å; F242-W288 HydrophobicContact CD2-CZ2 3.95Å; D286-W288 PolarHBondContact O-N 3.09Å; D286-W288 VanDerWaalsContact O-N 3.16Å; D286-W288 WeakPolarHBondContact OD2-CA 3.4Å; D286-W288 WeakPolarHBondContact OD2-CB 3.41Å; D286-W288 PolarHBondContact OD2-N 2.85Å; W288-L290 VanDerWaalsContact C-N 3.33Å; W288-L290 PolarHBondContact O-N 2.78Å; W288-E291 HydrophobicContact CE3-CB 4.37Å; W288-E291 PolarHBondContact O-N 3.06Å; W288-R292 WeakPolarHBondContact O-CB 3.02Å; W288-R292 PolarHBondContact O-N 3.13Å
289	G	67.9	Low	73	Confident	6 Å²	6	53 Å²	53	6%	0.062	25%	0.248	C	C	.	.	H	α-helix	trans	-54.6	-45.6	170.5	0	0	0	0	0	112.8	D286 R292 A293	D286-G289 WeakPolarHBondContact O-CA 3.43Å; D286-G289 PolarHBondContact O-N 2.92Å; D286-G289 VanDerWaalsContact OD1-CA 3.31Å; D286-G289 WeakPolarHBondContact OD1-CA 3.3Å; D286-G289 PolarHBondContact OD1-N 3.29Å; G289-R292 PolarHBondContact O-N 3.3Å; G289-A293 PolarHBondContact O-N 3.01Å
290	L	75.1	Confident	72.7	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-49	175.9	-179.5	58.4	0	0	0	112.5	L262 K276 L279 I280 D286 W288 R292 A293 I294	L262-L290 HydrophobicContact CD1-CD1 3.33Å; K276-L290 HydrophobicContact CB-CD2 3.76Å; K276-L290 HydrophobicContact CD-CD2 4.4Å; K276-L290 HydrophobicContact CG-CD2 3.87Å; K276-L290 VanDerWaalsContact O-CD2 3.25Å; K276-L290 WeakPolarHBondContact O-CD2 3.08Å; L279-L290 HydrophobicContact CB-CD1 4.02Å; L279-L290 HydrophobicContact CB-CD2 3.87Å; L279-L290 HydrophobicContact CD1-CD1 4.22Å; I280-L290 HydrophobicContact CD1-CD2 4.3Å; I280-L290 HydrophobicContact CG1-CB 4.31Å; I280-L290 HydrophobicContact CG1-CD2 3.83Å; D286-L290 PolarHBondContact O-N 3.45Å; W288-L290 VanDerWaalsContact C-N 3.33Å; W288-L290 PolarHBondContact O-N 2.78Å; L290-R292 VanDerWaalsContact C-N 3.26Å; L290-R292 PolarHBondContact O-N 3.49Å; L290-A293 PolarHBondContact O-N 2.85Å; L290-A293 VanDerWaalsContact O-N 3.14Å; L290-I294 HydrophobicContact CD1-CD1 3.96Å; L290-I294 HydrophobicContact CD1-CG1 4.19Å; L290-I294 HydrophobicContact CG-CD1 3.88Å; L290-I294 WeakPolarHBondContact O-CG1 3.47Å; L290-I294 PolarHBondContact O-N 2.89Å
291	E	70.3	Confident	72.4	Confident	34 Å²	34	54.7 Å²	54.7	16%	0.159	25%	0.251	C	S	.	.	H	α-helix	trans	-56	-42.3	174.9	-75.4	-63.2	163.6	0	0	111.9	K276 K287 W288 I294 L295	K276-E291 IonicContact NZ-OE1 2.87Å; K276-E291 PolarHBondContact NZ-OE1 3.17Å; K276-E291 IonicContact NZ-OE2 2.81Å; K287-E291 WeakPolarHBondContact O-CG 3.4Å; K287-E291 PolarHBondContact O-N 3.47Å; W288-E291 HydrophobicContact CE3-CB 4.37Å; W288-E291 PolarHBondContact O-N 3.06Å; E291-I294 PolarHBondContact O-N 3Å; E291-L295 VanDerWaalsContact O-CB 3.28Å; E291-L295 WeakPolarHBondContact O-CB 3.21Å; E291-L295 VanDerWaalsContact O-CG 3.23Å; E291-L295 WeakPolarHBondContact O-CG 3.37Å; E291-L295 PolarHBondContact O-N 3.49Å
292	R	67.8	Low	72.1	Confident	29 Å²	29	51.1 Å²	51.1	11%	0.109	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-39.5	177.1	171.7	169.8	55.2	-166.3	-1.7	112.5	D90 W288 G289 L290 R296	D90-R292 VanDerWaalsContact CB-NH1 3.34Å; D90-R292 IonicContact OD2-CZ 3.15Å; D90-R292 IonicContact OD2-NH1 3.89Å; D90-R292 PolarHBondContact OD2-NH1 3.39Å; D90-R292 IonicContact OD2-NH2 3.78Å; D90-R292 PolarHBondContact OD2-NH2 3.42Å; W288-R292 WeakPolarHBondContact O-CB 3.02Å; W288-R292 PolarHBondContact O-N 3.13Å; G289-R292 PolarHBondContact O-N 3.3Å; L290-R292 VanDerWaalsContact C-N 3.26Å; L290-R292 PolarHBondContact O-N 3.49Å; R292-R296 WeakPolarHBondContact O-CB 3.07Å; R292-R296 VanDerWaalsContact O-CG 3.25Å; R292-R296 WeakPolarHBondContact O-CG 3.13Å; R292-R296 PolarHBondContact O-N 2.97Å
293	A	71.4	Confident	71.5	Confident	5 Å²	5	48.2 Å²	48.2	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-46.1	173.6	0	0	0	0	0	111.3	M259 L262 G289 L290 R296 L297	M259-A293 HydrophobicContact CG-CB 4.14Å; L262-A293 HydrophobicContact CD1-CB 4.07Å; G289-A293 PolarHBondContact O-N 3.01Å; L290-A293 PolarHBondContact O-N 2.85Å; L290-A293 VanDerWaalsContact O-N 3.14Å; A293-R296 PolarHBondContact O-N 3.47Å; A293-L297 WeakPolarHBondContact O-CB 3.43Å; A293-L297 WeakPolarHBondContact O-CG 3.4Å; A293-L297 PolarHBondContact O-N 2.89Å
294	I	76.1	Confident	70.8	Confident	13 Å²	13	52.9 Å²	52.9	7%	0.067	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-45.9	177	-67.4	168.1	0	0	0	111.4	K276 L290 E291 R296 L297 Q298 V303 V329	K276-I294 HydrophobicContact CD-CD1 4.34Å; K276-I294 HydrophobicContact CG-CD1 4.37Å; L290-I294 HydrophobicContact CD1-CD1 3.96Å; L290-I294 HydrophobicContact CD1-CG1 4.19Å; L290-I294 HydrophobicContact CG-CD1 3.88Å; L290-I294 WeakPolarHBondContact O-CG1 3.47Å; L290-I294 PolarHBondContact O-N 2.89Å; E291-I294 PolarHBondContact O-N 3Å; I294-R296 VanDerWaalsContact C-N 3.28Å; I294-R296 PolarHBondContact O-N 2.88Å; I294-L297 CarbonylContact O-C 3.5Å; I294-L297 PolarHBondContact O-N 3.38Å; I294-Q298 PolarHBondContact O-N 3.07Å; I294-V303 HydrophobicContact CD1-CG2 4.16Å; I294-V303 HydrophobicContact CG2-CG2 3.59Å; I294-V329 HydrophobicContact CD1-CG1 4.23Å; I294-V329 HydrophobicContact CD1-CG2 3.7Å; I294-V329 HydrophobicContact CG1-CG1 4.12Å; I294-V329 HydrophobicContact CG1-CG2 4.47Å
295	L	67.7	Low	69.5	Low	30 Å²	30	45.9 Å²	45.9	16%	0.157	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-31.9	179.5	-78.6	168	0	0	0	113.2	C228 E291	C228-L295 HydrophobicContact CB-CD1 4.3Å; E291-L295 VanDerWaalsContact O-CB 3.28Å; E291-L295 WeakPolarHBondContact O-CB 3.21Å; E291-L295 VanDerWaalsContact O-CG 3.23Å; E291-L295 WeakPolarHBondContact O-CG 3.37Å; E291-L295 PolarHBondContact O-N 3.49Å
296	R	67.9	Low	68.6	Low	30 Å²	30	48.8 Å²	48.8	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-78.1	-40.8	173	-69.7	173.6	179	178.9	-5	111.4	H188 H189 P250 M259 R292 A293 I294 Q298	H188-R296 VanDerWaalsContact C-NH2 3.33Å; H188-R296 PolarHBondContact O-NH2 2.68Å; H189-R296 PolarHBondContact CD2-NH2 3.07Å; H189-R296 VanDerWaalsContact CD2-NH2 3.32Å; P250-R296 HydrophobicContact CB-CG 3.8Å; M259-R296 HydrophobicContact CE-CB 3.89Å; M259-R296 HydrophobicContact CE-CG 4.24Å; M259-R296 HydrophobicContact SD-CB 3.5Å; M259-R296 WeakPolarHBondContact SD-CB 3.47Å; M259-R296 HydrophobicContact SD-CG 4.44Å; R292-R296 WeakPolarHBondContact O-CB 3.07Å; R292-R296 VanDerWaalsContact O-CG 3.25Å; R292-R296 WeakPolarHBondContact O-CG 3.13Å; R292-R296 PolarHBondContact O-N 2.97Å; A293-R296 PolarHBondContact O-N 3.47Å; I294-R296 VanDerWaalsContact C-N 3.28Å; I294-R296 PolarHBondContact O-N 2.88Å; R296-Q298 VanDerWaalsContact C-N 3.32Å; R296-Q298 PolarHBondContact O-N 3.11Å
297	L	72	Confident	67.2	Low	6 Å²	6	47 Å²	47	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-82.2	5.4	-179.2	-70.5	173.6	0	0	0	115.6	M259 L262 L263 A293 I294 H299 R300 V301	M259-L297 HydrophobicContact CB-CD1 3.86Å; M259-L297 HydrophobicContact CB-CD2 4.18Å; M259-L297 HydrophobicContact CB-CG 4.14Å; M259-L297 HydrophobicContact CG-CD1 3.77Å; M259-L297 HydrophobicContact CG-CD2 4.24Å; M259-L297 HydrophobicContact CG-CG 3.79Å; M259-L297 HydrophobicContact SD-CD1 4.31Å; M259-L297 HydrophobicContact SD-CD2 3.84Å; M259-L297 HydrophobicContact SD-CG 3.63Å; L262-L297 HydrophobicContact CD2-CD1 3.76Å; L263-L297 HydrophobicContact CD1-CD1 4.26Å; L263-L297 HydrophobicContact CD1-CD2 3.77Å; L263-L297 HydrophobicContact CD2-CD1 4.14Å; L263-L297 HydrophobicContact CD2-CD2 4.29Å; L263-L297 HydrophobicContact CG-CD1 3.87Å; L263-L297 HydrophobicContact CG-CD2 4.2Å; A293-L297 WeakPolarHBondContact O-CB 3.43Å; A293-L297 WeakPolarHBondContact O-CG 3.4Å; A293-L297 PolarHBondContact O-N 2.89Å; I294-L297 CarbonylContact O-C 3.5Å; I294-L297 PolarHBondContact O-N 3.38Å; L297-H299 PolarHBondContact O-N 3.12Å; L297-R300 CarbonylContact O-C 3.57Å; L297-R300 WeakPolarHBondContact O-CA 3.22Å; L297-R300 PolarHBondContact O-N 3.13Å; L297-V301 HydrophobicContact CB-CB 3.93Å; L297-V301 HydrophobicContact CB-CG2 3.84Å; L297-V301 HydrophobicContact CD1-CG2 4.13Å; L297-V301 PolarHBondContact O-N 3.43Å
298	Q	68.3	Low	65.9	Low	63 Å²	63	47.8 Å²	47.8	29%	0.294	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-23.7	-172.7	60.4	157.2	3.2	0	0	117.8	R226 I294 R296 V301	R226-Q298 VanDerWaalsContact NH1-CD 3.31Å; I294-Q298 PolarHBondContact O-N 3.07Å; R296-Q298 VanDerWaalsContact C-N 3.32Å; R296-Q298 PolarHBondContact O-N 3.11Å; Q298-V301 CarbonylContact C-O 3.56Å
299	H	68.4	Low	64.6	Low	110 Å²	110	50.1 Å²	50.1	51%	0.509	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-25.3	177.8	-61.7	-73.1	0	0	0	112.4	L297 N332	L297-H299 PolarHBondContact O-N 3.12Å; H299-N332 PolarHBondContact O-ND2 3.05Å
300	R	75.6	Confident	63.2	Low	86 Å²	86	53.6 Å²	53.6	33%	0.325	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-18.1	-177.2	-61.6	172.2	68.7	173.8	4.1	112.9	D255 L263 L297 N332	D255-R300 IonicContact OD1-CZ 3.68Å; D255-R300 IonicContact OD1-NH1 3.27Å; D255-R300 PolarHBondContact OD1-NH1 3.16Å; D255-R300 IonicContact OD2-CZ 2.7Å; D255-R300 IonicContact OD2-NH1 3.72Å; D255-R300 PolarHBondContact OD2-NH1 3.47Å; D255-R300 IonicContact OD2-NH2 2.98Å; L263-R300 HydrophobicContact CD2-CB 4.39Å; L297-R300 CarbonylContact O-C 3.57Å; L297-R300 WeakPolarHBondContact O-CA 3.22Å; L297-R300 PolarHBondContact O-N 3.13Å; R300-N332 WeakPolarHBondContact O-CB 3.46Å; R300-N332 PolarHBondContact O-N 3.04Å
301	V	75.9	Confident	61.1	Low	4 Å²	4	62 Å²	62	2%	0.024	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137.2	-174.1	171.6	0	0	0	0	110.2	L262 L263 L297 Q298 V329 C330 L331	L262-V301 HydrophobicContact CD2-CG2 4.29Å; L263-V301 HydrophobicContact CD2-CG2 3.8Å; L297-V301 HydrophobicContact CB-CB 3.93Å; L297-V301 HydrophobicContact CB-CG2 3.84Å; L297-V301 HydrophobicContact CD1-CG2 4.13Å; L297-V301 PolarHBondContact O-N 3.43Å; Q298-V301 CarbonylContact C-O 3.56Å; V301-V329 HydrophobicContact CG1-CG1 3.25Å; V301-C330 CarbonylContact C-O 3.48Å; V301-C330 VanDerWaalsContact CA-O 3.27Å; V301-C330 WeakPolarHBondContact CA-O 3.21Å; V301-L331 HydrophobicContact CG2-CD2 4.49Å
302	K	75.2	Confident	59.3	Low	77 Å²	77	65.6 Å²	65.6	34%	0.335	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.8	180	-179.8	176.2	-175.6	174.3	0	110.7	C330 N360	K302-C330 PolarHBondContact N-O 2.95Å; K302-C330 WeakPolarHBondContact O-CB 3.2Å; K302-C330 PolarHBondContact O-N 2.85Å; K302-N360 PolarHBondContact NZ-O 2.82Å
303	V	70.9	Confident	57.6	Low	46 Å²	46	67.7 Å²	67.7	28%	0.279	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	132.7	169.7	-173.5	0	0	0	0	109.7	I294 E327 I328	I294-V303 HydrophobicContact CD1-CG2 4.16Å; I294-V303 HydrophobicContact CG2-CG2 3.59Å; V303-E327 HydrophobicContact CG1-CB 4.03Å; V303-E327 HydrophobicContact CG1-CG 4.49Å; V303-I328 CarbonylContact C-O 3.59Å; V303-I328 WeakPolarHBondContact CA-O 3.27Å
304	R	63.5	Low	55.8	Low	120 Å²	120	72.7 Å²	72.7	45%	0.453	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	150.6	161.9	-57.5	-179.9	-167	175.2	8.7	107.3	E327 I328 C330	R304-E327 CarbonylContact O-C 3.46Å; R304-E327 WeakPolarHBondContact O-CA 3.26Å; R304-I328 PolarHBondContact N-O 3.34Å; R304-I328 PolarHBondContact O-N 3.47Å; R304-C330 WeakPolarHBondContact CD-SG 3.3Å; R304-C330 PolarHBondContact NE-SG 3.18Å
305	T	52.1	Low	53.8	Low	44 Å²	44	78.5 Å²	78.5	27%	0.27	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	111.3	169	-43.9	0	0	0	0	107.9	Q325 E327	T305-Q325 HydrophobicContact CG2-CB 4.06Å; T305-E327 HydrophobicContact CG2-CG 4.27Å
306	E	51.6	Low	52.3	Low	87 Å²	87	84.8 Å²	84.8	41%	0.407	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	148.6	172.9	-63.5	-161.5	177.3	0	0	110.2	M326 I328	E306-M326 PolarHBondContact N-O 3.07Å; E306-M326 PolarHBondContact O-N 3.24Å; E306-I328 HydrophobicContact CB-CD1 3.94Å; E306-I328 HydrophobicContact CG-CD1 3.79Å; E306-I328 HydrophobicContact CG-CG1 4.48Å
307	I	42.3	Very low	50.7	Low	54 Å²	54	91.7 Å²	91.7	28%	0.277	46%	0.456	S	S	.	.			trans	-122.8	94.5	-178.6	-53.5	176.2	0	0	0	105.2	Y309 P322	I307-Y309 HydrophobicContact CB-CE2 4.01Å; I307-Y309 HydrophobicContact CG2-CD2 4.16Å; I307-Y309 HydrophobicContact CG2-CE2 3.5Å; I307-Y309 VanDerWaalsContact CG2-CE2 3.5Å; I307-Y309 WeakPolarHBondContact O-CD2 3.49Å; I307-Y309 WeakPolarHBondContact O-CE2 3.17Å; I307-P322 HydrophobicContact CG2-CB 3.96Å; I307-P322 HydrophobicContact CG2-CG 4.31Å
308	Q	39.6	Very low	48.6	Very low	121 Å²	121	100.7 Å²	100.7	57%	0.565	49%	0.494	S	S	*	.			trans	-68.8	145.4	171.1	-70.6	-175.5	-10.9	0	0	109.4
309	Y	38.1	Very low	47	Very low	85 Å²	85	102.1 Å²	102.1	33%	0.333	51%	0.509	S	S	.	.			trans	-122.7	101.9	179.6	-78.1	-98.5	0	0	0	108.5	I307 R311 K373	I307-Y309 HydrophobicContact CB-CE2 4.01Å; I307-Y309 HydrophobicContact CG2-CD2 4.16Å; I307-Y309 HydrophobicContact CG2-CE2 3.5Å; I307-Y309 VanDerWaalsContact CG2-CE2 3.5Å; I307-Y309 WeakPolarHBondContact O-CD2 3.49Å; I307-Y309 WeakPolarHBondContact O-CE2 3.17Å; Y309-R311 PolarHBondContact O-N 3.04Å; Y309-K373 VanDerWaalsContact CZ-NZ 3.26Å
310	T	38.2	Very low	45.2	Very low	80 Å²	80	104.9 Å²	104.9	49%	0.491	52%	0.515	S	S	.	.			trans	-81.5	117	177.6	57.9	0	0	0	0	108.3	E1181	T310-E1181 VanDerWaalsContact CB-N 3.28Å; T310-E1181 VanDerWaalsContact CB-OE1 3.23Å; T310-E1181 WeakPolarHBondContact CB-OE1 3.39Å; T310-E1181 WeakPolarHBondContact CG2-OE1 3.29Å
311	R	31.2	Very low	43.3	Very low	178 Å²	178	106.8 Å²	106.8	67%	0.672	53%	0.53	S	S	*	.			trans	-109.8	5.5	-156.8	-157.9	-154.8	-168.6	174	7.7	117.9	Y309 E1181 E1182 T1183	Y309-R311 PolarHBondContact O-N 3.04Å; R311-E1181 CarbonylContact C-O 3.56Å; R311-E1181 WeakPolarHBondContact CA-O 3.37Å; R311-E1181 PolarHBondContact N-O 2.84Å; R311-E1182 WeakPolarHBondContact CD-O 3.29Å; R311-E1182 PolarHBondContact NH1-O 2.82Å; R311-T1183 PolarHBondContact NH1-O 3.14Å
312	K	32.2	Very low	41.5	Very low	110 Å²	110	107.4 Å²	107.4	48%	0.478	54%	0.535	S	S	.	.			trans	-93.6	136	-173.9	-110.2	170.6	-162.7	164.1	0	108.4	A1180 E1181 E1182	K312-A1180 VanDerWaalsContact CB-C 3.5Å; K312-A1180 WeakPolarHBondContact CB-O 3.42Å; K312-A1180 CarbonylContact O-C 3.58Å; K312-A1180 PolarHBondContact O-N 2.73Å; K312-E1181 VanDerWaalsContact CA-O 3.28Å; K312-E1181 WeakPolarHBondContact CA-O 3.31Å; K312-E1181 HydrophobicContact CB-CB 4.1Å; K312-E1181 WeakPolarHBondContact CB-O 3.07Å; K312-E1181 HydrophobicContact CD-CB 3.87Å; K312-E1181 HydrophobicContact CG-CB 4.42Å; K312-E1181 VanDerWaalsContact CG-O 3.3Å; K312-E1181 WeakPolarHBondContact CG-O 3.03Å; K312-E1181 VanDerWaalsContact N-C 3.33Å; K312-E1181 VanDerWaalsContact N-N 3.11Å; K312-E1181 PolarHBondContact N-O 3.37Å; K312-E1182 WeakPolarHBondContact CE-OE1 3.22Å; K312-E1182 WeakPolarHBondContact CE-OE2 3.24Å; K312-E1182 IonicContact NZ-OE1 3.21Å; K312-E1182 PolarHBondContact NZ-OE1 2.68Å; K312-E1182 IonicContact NZ-OE2 2.92Å; K312-E1182 PolarHBondContact NZ-OE2 3.37Å
313	G	30.6	Very low	39.8	Very low	73 Å²	73	111.1 Å²	111.1	75%	0.753	55%	0.547	S	S	*	.	S	Bend	trans	110.1	87.5	177.9	0	0	0	0	0	115.3
314	N	33.9	Very low	38.5	Very low	110 Å²	110	114.8 Å²	114.8	59%	0.588	57%	0.565	S	S	*	*			trans	53.4	107.5	154	-160.2	-36.3	0	0	0	118.6	L316	N314-L316 VanDerWaalsContact C-N 3.25Å; N314-L316 PolarHBondContact O-N 3.35Å; N314-L316 PolarHBondContact OD1-N 3.45Å
315	P	34.7	Very low	37.8	Very low	134 Å²	134	113.3 Å²	113.3	87%	0.87	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	-20.3	-177.6	-26.1	35.2	0	0	0	117.3
316	L	36.3	Very low	38	Very low	162 Å²	162	114 Å²	114	85%	0.848	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	8.3	-166.3	-68.5	170.1	0	0	0	115	N314	N314-L316 VanDerWaalsContact C-N 3.25Å; N314-L316 PolarHBondContact O-N 3.35Å; N314-L316 PolarHBondContact OD1-N 3.45Å
317	K	34.1	Very low	38.7	Very low	176 Å²	176	112.3 Å²	112.3	77%	0.765	56%	0.556	S	S	*	*	S	Bend	trans	-126.9	137	174	-71.1	179.1	-178.8	171.9	0	111.2
318	K	28.7	Very low	40.4	Very low	194 Å²	194	110.3 Å²	110.3	84%	0.843	55%	0.546	S	S	*	.			trans	-31	117.2	-172.2	-68.4	167.1	-178.2	161.9	0	113.4	R320	K318-R320 PolarHBondContact O-N 3.03Å
319	P	33.5	Very low	42.3	Very low	94 Å²	94	104.6 Å²	104.6	61%	0.61	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-60.8	128.2	-179.3	25.9	-34.9	0	0	0	110	Y394	P319-Y394 HydrophobicContact CB-CE2 3.94Å; P319-Y394 HydrophobicContact CG-CD2 4.21Å; P319-Y394 HydrophobicContact CG-CE2 3.61Å
320	R	31.9	Very low	44.4	Very low	167 Å²	167	100.7 Å²	100.7	63%	0.63	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-75.9	156.5	-169.8	-79.2	173.4	163.1	-179.9	-11.9	112.2	K318 S1177 D1178	K318-R320 PolarHBondContact O-N 3.03Å; R320-S1177 PolarHBondContact NH1-O 2.93Å; R320-S1177 VanDerWaalsContact NH1-O 3.11Å; R320-S1177 PolarHBondContact NH2-O 2.93Å; R320-D1178 PolarHBondContact NH1-O 3.01Å
321	I	34.4	Very low	46.4	Very low	126 Å²	126	98.5 Å²	98.5	65%	0.646	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-62.5	139.1	-175.5	-58.4	171.1	0	0	0	109	R323	I321-R323 PolarHBondContact O-N 2.85Å
322	P	38.2	Very low	48.3	Very low	18 Å²	18	93 Å²	93	12%	0.117	47%	0.473	C	S	.	.			trans	-57.3	107	168.3	-21	31.7	0	0	0	109.1	I307 R396	I307-P322 HydrophobicContact CG2-CB 3.96Å; I307-P322 HydrophobicContact CG2-CG 4.31Å; P322-R396 PolarHBondContact O-NH2 2.86Å
323	R	40.6	Very low	49.5	Very low	154 Å²	154	94.1 Å²	94.1	58%	0.581	48%	0.48	S	S	*	.			trans	-68.9	-50.5	179.8	-81.4	-176.1	168	-179.9	-2.3	109.3	I321 D1178	I321-R323 PolarHBondContact O-N 2.85Å; R323-D1178 IonicContact CZ-OD1 3.14Å; R323-D1178 IonicContact NH1-OD1 3.97Å; R323-D1178 PolarHBondContact NH1-OD1 3.05Å; R323-D1178 IonicContact NH2-OD1 3.38Å; R323-D1178 PolarHBondContact NH2-OD1 3.22Å
324	D	42.4	Very low	50.4	Low	124 Å²	124	99.8 Å²	99.8	66%	0.663	48%	0.484	S	S	*	.			trans	-109.1	119.2	-168.3	-52.8	-69.3	0	0	0	111.1
325	Q	48.9	Very low	50.3	Low	89 Å²	89	99.2 Å²	99.2	42%	0.416	49%	0.487	S	S	.	.			trans	-95.5	98.9	167.1	-68.1	-176.1	-98.7	0	0	106.5	T305 E327	T305-Q325 HydrophobicContact CG2-CB 4.06Å; Q325-E327 PolarHBondContact O-N 2.81Å; Q325-E327 VanDerWaalsContact O-N 3.1Å
326	M	56.5	Low	50.1	Low	57 Å²	57	96.9 Å²	96.9	28%	0.281	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	102.5	-177.6	-165.5	159.3	104.7	0	0	108.9	E306 I328	E306-M326 PolarHBondContact N-O 3.07Å; E306-M326 PolarHBondContact O-N 3.24Å; M326-I328 HydrophobicContact CE-CD1 3.67Å; M326-I328 HydrophobicContact CE-CG1 3.91Å; M326-I328 HydrophobicContact CG-CG1 4.1Å; M326-I328 PolarHBondContact O-N 3.48Å
327	E	65.4	Low	49.8	Very low	52 Å²	52	98.7 Å²	98.7	24%	0.243	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	114.3	171.7	-66.5	-169.6	90.5	0	0	109	S275 K276 V303 R304 T305 Q325	S275-E327 CarbonylContact C-O 3.56Å; K276-E327 HydrophobicContact CB-CB 4.36Å; K276-E327 HydrophobicContact CD-CB 3.7Å; K276-E327 HydrophobicContact CD-CG 4.45Å; K276-E327 WeakPolarHBondContact CD-OE2 3.46Å; K276-E327 WeakPolarHBondContact CE-OE2 3.04Å; K276-E327 HydrophobicContact CG-CB 3.82Å; K276-E327 PolarHBondContact N-O 2.99Å; K276-E327 IonicContact NZ-OE1 3.64Å; K276-E327 PolarHBondContact NZ-OE1 3.1Å; K276-E327 IonicContact NZ-OE2 3.24Å; K276-E327 PolarHBondContact NZ-OE2 3.17Å; V303-E327 HydrophobicContact CG1-CB 4.03Å; V303-E327 HydrophobicContact CG1-CG 4.49Å; R304-E327 CarbonylContact O-C 3.46Å; R304-E327 WeakPolarHBondContact O-CA 3.26Å; T305-E327 HydrophobicContact CG2-CG 4.27Å; Q325-E327 PolarHBondContact O-N 2.81Å; Q325-E327 VanDerWaalsContact O-N 3.1Å
328	I	78	Confident	49.4	Very low	13 Å²	13	101.8 Å²	101.8	7%	0.067	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	122.5	-177.1	-61.5	-176.6	0	0	0	109.2	C273 C274 V303 R304 E306 M326	C273-I328 HydrophobicContact CB-CG2 3.57Å; C274-I328 CarbonylContact O-C 3.55Å; C274-I328 WeakPolarHBondContact O-CA 3.47Å; V303-I328 CarbonylContact C-O 3.59Å; V303-I328 WeakPolarHBondContact CA-O 3.27Å; R304-I328 PolarHBondContact N-O 3.34Å; R304-I328 PolarHBondContact O-N 3.47Å; E306-I328 HydrophobicContact CB-CD1 3.94Å; E306-I328 HydrophobicContact CG-CD1 3.79Å; E306-I328 HydrophobicContact CG-CG1 4.48Å; M326-I328 HydrophobicContact CE-CD1 3.67Å; M326-I328 HydrophobicContact CE-CG1 3.91Å; M326-I328 HydrophobicContact CG-CG1 4.1Å; M326-I328 PolarHBondContact O-N 3.48Å
329	V	80	Confident	49.4	Very low	0 Å²	0	99 Å²	99	0%	0	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.9	-177.6	-172.6	0	0	0	0	108.3	I266 C273 C274 K276 L279 I294 V301	I266-V329 HydrophobicContact CD1-CB 4.11Å; I266-V329 HydrophobicContact CD1-CG1 3.66Å; C273-V329 CarbonylContact C-O 3.55Å; C273-V329 WeakPolarHBondContact CA-O 3.46Å; C273-V329 WeakPolarHBondContact CB-O 3.43Å; C274-V329 PolarHBondContact N-O 3.2Å; C274-V329 PolarHBondContact O-N 3.14Å; K276-V329 HydrophobicContact CG-CG2 3.61Å; L279-V329 HydrophobicContact CD1-CB 3.6Å; L279-V329 HydrophobicContact CD1-CG1 4.05Å; L279-V329 HydrophobicContact CD1-CG2 3.67Å; I294-V329 HydrophobicContact CD1-CG1 4.23Å; I294-V329 HydrophobicContact CD1-CG2 3.7Å; I294-V329 HydrophobicContact CG1-CG1 4.12Å; I294-V329 HydrophobicContact CG1-CG2 4.47Å; V301-V329 HydrophobicContact CG1-CG1 3.25Å
330	C	82	Confident	49.1	Very low	3 Å²	3	100.2 Å²	100.2	2%	0.02	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	149.6	-172.9	-47.1	0	0	0	0	111.6	K272 C273 V301 K302 R304	K272-C330 WeakPolarHBondContact O-CA 3.5Å; C273-C330 HydrophobicContact CB-CB 3.87Å; C273-C330 WeakPolarHBondContact CB-SG 3.11Å; V301-C330 CarbonylContact C-O 3.48Å; V301-C330 VanDerWaalsContact CA-O 3.27Å; V301-C330 WeakPolarHBondContact CA-O 3.21Å; K302-C330 PolarHBondContact N-O 2.95Å; K302-C330 WeakPolarHBondContact O-CB 3.2Å; K302-C330 PolarHBondContact O-N 2.85Å; R304-C330 WeakPolarHBondContact CD-SG 3.3Å; R304-C330 PolarHBondContact NE-SG 3.18Å
331	L	81.5	Confident	49	Very low	35 Å²	35	98.4 Å²	98.4	18%	0.183	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	151.4	165.7	-76.7	158.6	0	0	0	112.1	L263 I266 R267 K272 V301	L263-L331 HydrophobicContact CD2-CD2 3.67Å; I266-L331 HydrophobicContact CB-CD1 4.32Å; I266-L331 HydrophobicContact CB-CG 4.4Å; I266-L331 HydrophobicContact CG2-CD1 3.81Å; I266-L331 HydrophobicContact CG2-CG 3.71Å; R267-L331 HydrophobicContact CG-CD1 3.8Å; K272-L331 HydrophobicContact CB-CB 4.41Å; K272-L331 HydrophobicContact CB-CD1 4.22Å; K272-L331 HydrophobicContact CG-CD1 4.41Å; K272-L331 PolarHBondContact O-N 2.92Å; V301-L331 HydrophobicContact CG2-CD2 4.49Å
332	N	70.7	Confident	48.7	Very low	62 Å²	62	99.8 Å²	99.8	33%	0.332	50%	0.498	S	S	.	.			trans	-115.7	90.7	-178.9	-175.2	43.1	0	0	0	110.5	H299 R300 K334	H299-N332 PolarHBondContact O-ND2 3.05Å; R300-N332 WeakPolarHBondContact O-CB 3.46Å; R300-N332 PolarHBondContact O-N 3.04Å; N332-K334 PolarHBondContact O-N 3.3Å
333	E	56.9	Low	48.1	Very low	133 Å²	133	108 Å²	108	62%	0.621	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	3.5	-163.1	-56.5	-169	116.3	0	0	116.5	K272 C335	K272-E333 VanDerWaalsContact CD-OE1 3.24Å; K272-E333 WeakPolarHBondContact CD-OE1 3.44Å; K272-E333 WeakPolarHBondContact CE-OE1 3.09Å; K272-E333 IonicContact NZ-OE1 3.63Å; K272-E333 PolarHBondContact NZ-OE1 2.81Å; E333-C335 PolarHBondContact O-N 3.02Å
334	K	49.3	Very low	47.4	Very low	193 Å²	193	110.2 Å²	110.2	84%	0.839	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.5	-171.1	-73.8	-162.7	168.5	-167.9	0	116.3	N332	N332-K334 PolarHBondContact O-N 3.3Å
335	C	32.8	Very low	46.8	Very low	97 Å²	97	115.7 Å²	115.7	66%	0.655	56%	0.557	S	S	*	*			trans	-103.7	39.5	-169.5	-60.2	0	0	0	0	114.3	E333	E333-C335 PolarHBondContact O-N 3.02Å
336	A	30	Very low	45.8	Very low	85 Å²	85	118.3 Å²	118.3	70%	0.702	57%	0.569	S	S	*	*			trans	-120.3	5.3	-165.4	0	0	0	0	0	116.9
337	K	29.3	Very low	44.4	Very low	201 Å²	201	121.1 Å²	121.1	87%	0.874	58%	0.58	S	S	*	*	S	Bend	trans	-142.6	133.5	-178.7	-71.7	-169.8	175.9	-178.1	0	114.8
338	R	26.7	Very low	42.6	Very low	240 Å²	240	121.7 Å²	121.7	91%	0.906	59%	0.59	S	S	*	*			trans	72.4	113.3	161.1	-66.5	-176.5	176.1	172.1	-2.6	119.6
339	V	28.3	Very low	40.2	Very low	137 Å²	137	127.5 Å²	127.5	83%	0.83	62%	0.617	S	S	*	*			trans	-92.2	167.4	142.8	-179.9	0	0	0	0	107
340	V	27.6	Very low	37.6	Very low	119 Å²	119	132.6 Å²	132.6	72%	0.721	64%	0.641	S	S	*	*			trans	81.5	150.1	179.5	-166.6	0	0	0	0	114.4
341	D	29.7	Very low	35.1	Very low	129 Å²	129	137.5 Å²	137.5	69%	0.69	67%	0.666	S	S	*	*			trans	65	113.9	-173.6	-62	-34.8	0	0	0	116.7
342	Q	27.2	Very low	32.4	Very low	155 Å²	155	140.2 Å²	140.2	72%	0.724	68%	0.68	S	S	*	*			cis	98.4	131.6	49.1	-82.5	-159.6	62.9	0	0	113
343	K	26.8	Very low	30.3	Very low	189 Å²	189	143.1 Å²	143.1	82%	0.822	71%	0.706	S	S	*	*	S	Bend	trans	21.4	128.3	156.6	-61.8	171.9	179.4	173.8	0	118.6
344	K	26.4	Very low	28.9	Very low	201 Å²	201	140.7 Å²	140.7	87%	0.874	70%	0.703	S	S	*	*			trans	85.8	79.7	174.7	-56	179.6	177.5	178.7	0	117.4
345	R	29.5	Very low	28	Very low	240 Å²	240	135.4 Å²	135.4	91%	0.906	69%	0.691	S	S	*	*			trans	-170.6	106.5	131.2	-103.1	156.8	-178.2	168.1	1.8	107.7
346	E	27.6	Very low	27.7	Very low	143 Å²	143	138 Å²	138	67%	0.668	70%	0.698	S	S	*	*				58.3	106.4	74.2	-68.3	-151.8	103.1	0	0	114.4
347	K	26	Very low	27.7	Very low	116 Å²	116	141.1 Å²	141.1	50%	0.504	70%	0.698	S	S	.	*			trans	79.5	54.3	133.3	-58.5	178.7	175.2	148	0	118.1	H1199	K347-H1199 VanDerWaalsContact C-ND1 3.27Å; K347-H1199 VanDerWaalsContact CA-CE1 3.42Å; K347-H1199 WeakPolarHBondContact CA-CE1 3.28Å; K347-H1199 WeakPolarHBondContact CA-NE2 3.16Å; K347-H1199 HydrophobicContact CB-CB 4.06Å; K347-H1199 VanDerWaalsContact CB-CD2 3.48Å; K347-H1199 WeakPolarHBondContact CB-CD2 3.16Å; K347-H1199 VanDerWaalsContact CG-CD2 3.44Å; K347-H1199 WeakPolarHBondContact CG-CD2 3.47Å; K347-H1199 VanDerWaalsContact O-CA 3.28Å; K347-H1199 WeakPolarHBondContact O-CA 3.39Å; K347-H1199 PolarHBondContact O-N 2.92Å
348	S	28	Very low	27.6	Very low	65 Å²	65	140 Å²	140	46%	0.455	69%	0.693	S	S	.	*			trans	-166.9	161.4	157.2	-101.3	0	0	0	0	110	H1199 P1200	S348-H1199 PolarHBondContact N-ND1 3.43Å; S348-P1200 WeakPolarHBondContact OG-CD 3.33Å
349	E	27.2	Very low	27.6	Very low	135 Å²	135	132.7 Å²	132.7	63%	0.631	68%	0.677	S	S	*	*			cis	-148.6	137.1	1	-159.2	-171.4	150.9	0	0	111	I351 P1200	E349-I351 HydrophobicContact CG-CD1 4.32Å; E349-I351 HydrophobicContact CG-CG1 4.24Å; E349-P1200 HydrophobicContact CB-CG 4.16Å; E349-P1200 HydrophobicContact CG-CG 3.45Å; E349-P1200 VanDerWaalsContact CG-CG 3.45Å
350	E	26.5	Very low	27.6	Very low	107 Å²	107	133 Å²	133	50%	0.5	67%	0.673	S	S	.	*			trans	-142.3	85.4	167.4	-93.1	-162.5	170.5	0	0	112.4	F1201	E350-F1201 HydrophobicContact CB-CD1 3.73Å; E350-F1201 HydrophobicContact CB-CE1 3.87Å; E350-F1201 HydrophobicContact CG-CD1 4.05Å; E350-F1201 HydrophobicContact CG-CE1 3.68Å
351	I	29	Very low	27.7	Very low	105 Å²	105	130.8 Å²	130.8	54%	0.538	65%	0.652	S	S	.	*			trans	-111.9	105.7	-178.6	-60	-178.6	0	0	0	112.4	E349 S353 P1200	E349-I351 HydrophobicContact CG-CD1 4.32Å; E349-I351 HydrophobicContact CG-CG1 4.24Å; I351-S353 PolarHBondContact O-N 2.94Å; I351-P1200 HydrophobicContact CD1-CB 3.77Å; I351-P1200 HydrophobicContact CD1-CG 4.03Å; I351-P1200 HydrophobicContact CG1-CB 3.73Å; I351-P1200 HydrophobicContact CG1-CG 4Å
352	D	25.6	Very low	27.7	Very low	92 Å²	92	128.9 Å²	128.9	49%	0.492	65%	0.647	S	S	.	*			trans	35.9	85.7	136.9	-166.5	-7.1	0	0	0	116.8	S354	D352-S354 PolarHBondContact O-N 3.2Å; D352-S354 VanDerWaalsContact OD1-CB 3.23Å; D352-S354 WeakPolarHBondContact OD1-CB 3.19Å; D352-S354 PolarHBondContact OD1-N 3.04Å; D352-S354 VanDerWaalsContact OD1-N 3.07Å; D352-S354 PolarHBondContact OD1-OG 3.33Å
353	S	26.8	Very low	28.1	Very low	124 Å²	124	126.7 Å²	126.7	87%	0.867	64%	0.637	S	S	*	*	S	Bend	trans	-75.8	31.4	172.8	79.3	0	0	0	0	114.1	I351 S355	I351-S353 PolarHBondContact O-N 2.94Å; S353-S355 VanDerWaalsContact C-N 3.28Å
354	S	26.9	Very low	28.4	Very low	82 Å²	82	122 Å²	122	57%	0.573	63%	0.627	S	S	*	*			trans	-95	25.5	162.8	77	0	0	0	0	112.7	D352 D356	D352-S354 PolarHBondContact O-N 3.2Å; D352-S354 VanDerWaalsContact OD1-CB 3.23Å; D352-S354 WeakPolarHBondContact OD1-CB 3.19Å; D352-S354 PolarHBondContact OD1-N 3.04Å; D352-S354 VanDerWaalsContact OD1-N 3.07Å; D352-S354 PolarHBondContact OD1-OG 3.33Å; S354-D356 PolarHBondContact O-N 2.9Å
355	S	29.6	Very low	28.9	Very low	82 Å²	82	118.4 Å²	118.4	57%	0.573	62%	0.618	S	S	*	*			trans	-62.2	96.4	-174.4	58.1	0	0	0	0	113.8	S353 E357	S353-S355 VanDerWaalsContact C-N 3.28Å; S355-E357 PolarHBondContact O-N 2.58Å
356	D	27.8	Very low	29.2	Very low	152 Å²	152	110.7 Å²	110.7	81%	0.813	59%	0.59	S	S	*	*				-44.4	101.8	123.8	-84.7	-25.3	0	0	0	106.3	S354 K358	S354-D356 PolarHBondContact O-N 2.9Å; D356-K358 PolarHBondContact O-N 2.71Å
357	E	29.5	Very low	30	Very low	150 Å²	150	107 Å²	107	70%	0.701	57%	0.571	S	S	*	*			trans	-59.7	102.6	177.3	-83.2	-171.4	160.2	0	0	108.5	S355 P359	S355-E357 PolarHBondContact O-N 2.58Å; E357-P359 VanDerWaalsContact O-CD 3.29Å; E357-P359 WeakPolarHBondContact O-CD 3.45Å; E357-P359 VanDerWaalsContact O-N 3.09Å
358	K	27.4	Very low	31.3	Very low	178 Å²	178	111.4 Å²	111.4	77%	0.774	59%	0.585	S	S	*	*			trans	-55.8	116	171.3	-64.1	168.9	-173.7	163.6	0	106.5	D356 N360	D356-K358 PolarHBondContact O-N 2.71Å; K358-N360 PolarHBondContact O-N 3.2Å; K358-N360 VanDerWaalsContact O-N 3.09Å
359	P	27.2	Very low	33	Very low	85 Å²	85	111.3 Å²	111.3	55%	0.552	59%	0.588	S	S	*	*			trans	-63.2	122.8	-178	24.3	-32.8	0	0	0	108.5	E357 W361	E357-P359 VanDerWaalsContact O-CD 3.29Å; E357-P359 WeakPolarHBondContact O-CD 3.45Å; E357-P359 VanDerWaalsContact O-N 3.09Å; P359-W361 VanDerWaalsContact O-CD1 3.27Å; P359-W361 PolarHBondContact O-N 2.99Å
360	N	27.5	Very low	35	Very low	143 Å²	143	106.3 Å²	106.3	77%	0.765	57%	0.565	S	S	*	*			trans	-77.3	57.8	-170.3	-116	-16.5	0	0	0	111.4	K302 K358	K302-N360 PolarHBondContact NZ-O 2.82Å; K358-N360 PolarHBondContact O-N 3.2Å; K358-N360 VanDerWaalsContact O-N 3.09Å
361	W	29.4	Very low	37.5	Very low	74 Å²	74	102.9 Å²	102.9	28%	0.28	55%	0.55	S	S	.	*			trans	-64.3	139.6	170.7	-65.5	98.3	0	0	0	110	P359 Q363 Y366	P359-W361 VanDerWaalsContact O-CD1 3.27Å; P359-W361 PolarHBondContact O-N 2.99Å; W361-Q363 VanDerWaalsContact C-N 3.34Å; W361-Q363 HydrophobicContact CB-CG 4.39Å; W361-Q363 VanDerWaalsContact O-CG 3.25Å; W361-Q363 WeakPolarHBondContact O-CG 3.48Å; W361-Q363 PolarHBondContact O-N 3.25Å; W361-Y366 AromaticContact CD2-CD1 3.88Å; W361-Y366 HydrophobicContact CD2-CD1 3.88Å; W361-Y366 AromaticContact CD2-CE1 3.9Å; W361-Y366 HydrophobicContact CD2-CE1 3.9Å; W361-Y366 HydrophobicContact CD2-CG 4.22Å; W361-Y366 AromaticContact CE2-CE1 3.99Å; W361-Y366 AromaticContact CE3-CD1 3.82Å; W361-Y366 HydrophobicContact CE3-CD1 3.82Å; W361-Y366 AromaticContact CE3-CD2 3.72Å; W361-Y366 HydrophobicContact CE3-CD2 3.72Å; W361-Y366 AromaticContact CE3-CE1 3.95Å; W361-Y366 HydrophobicContact CE3-CE1 3.95Å; W361-Y366 AromaticContact CE3-CE2 3.85Å; W361-Y366 HydrophobicContact CE3-CE2 3.85Å; W361-Y366 AromaticContact CE3-CG 3.7Å; W361-Y366 HydrophobicContact CE3-CG 3.7Å; W361-Y366 AromaticContact CE3-CZ 3.96Å; W361-Y366 HydrophobicContact CG-CD1 4.22Å; W361-Y366 HydrophobicContact CG-CE1 4.5Å; W361-Y366 HydrophobicContact CH2-CD2 4.48Å; W361-Y366 HydrophobicContact CH2-CE1 4.25Å; W361-Y366 AromaticContact CH2-CE2 3.79Å; W361-Y366 HydrophobicContact CH2-CE2 3.79Å; W361-Y366 AromaticContact CH2-CZ 3.65Å; W361-Y366 HydrophobicContact CZ2-CE1 4.18Å; W361-Y366 AromaticContact CZ2-CZ 3.95Å; W361-Y366 HydrophobicContact CZ3-CD1 4.35Å; W361-Y366 AromaticContact CZ3-CD2 3.67Å; W361-Y366 HydrophobicContact CZ3-CD2 3.67Å; W361-Y366 HydrophobicContact CZ3-CE1 4.13Å; W361-Y366 AromaticContact CZ3-CE2 3.4Å; W361-Y366 HydrophobicContact CZ3-CE2 3.4Å; W361-Y366 VanDerWaalsContact CZ3-CE2 3.4Å; W361-Y366 HydrophobicContact CZ3-CG 4.14Å; W361-Y366 AromaticContact CZ3-CZ 3.66Å
362	P	30.2	Very low	40	Very low	89 Å²	89	105.3 Å²	105.3	58%	0.578	55%	0.554	S	S	*	*			trans	-65.4	95.8	160.9	-12.3	28.4	0	0	0	108	S364	P362-S364 PolarHBondContact O-N 3.39Å
363	Q	35.8	Very low	42.8	Very low	109 Å²	109	103.5 Å²	103.5	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-70	-28.1	-159.9	-63	-159.5	-7.9	0	0	114.1	W361 N365 F367	W361-Q363 VanDerWaalsContact C-N 3.34Å; W361-Q363 HydrophobicContact CB-CG 4.39Å; W361-Q363 VanDerWaalsContact O-CG 3.25Å; W361-Q363 WeakPolarHBondContact O-CG 3.48Å; W361-Q363 PolarHBondContact O-N 3.25Å; Q363-N365 PolarHBondContact O-N 2.8Å; Q363-F367 HydrophobicContact CB-CD2 3.91Å; Q363-F367 HydrophobicContact CB-CE2 3.7Å; Q363-F367 HydrophobicContact CB-CG 4.42Å; Q363-F367 HydrophobicContact CB-CZ 4.04Å; Q363-F367 HydrophobicContact CG-CD2 4.38Å; Q363-F367 HydrophobicContact CG-CE2 3.67Å; Q363-F367 HydrophobicContact CG-CZ 3.87Å; Q363-F367 WeakPolarHBondContact O-CB 3.25Å; Q363-F367 WeakPolarHBondContact O-CD2 3.36Å; Q363-F367 WeakPolarHBondContact O-CG 3.46Å; Q363-F367 PolarHBondContact O-N 2.79Å
364	S	33.4	Very low	45.6	Very low	89 Å²	89	97.6 Å²	97.6	62%	0.622	50%	0.5	S	S	*	.	H	α-helix	trans	-55.7	-52.3	-178	50.3	0	0	0	0	113.4	P362	P362-S364 PolarHBondContact O-N 3.39Å
365	N	36.6	Very low	48.4	Very low	126 Å²	126	95.1 Å²	95.1	67%	0.674	48%	0.48	S	S	*	.	H	α-helix	trans	-89.2	-38.8	-169.9	-65.1	7	0	0	0	112.6	Q363 F367	Q363-N365 PolarHBondContact O-N 2.8Å; N365-F367 PolarHBondContact O-N 2.99Å
366	Y	35.1	Very low	51.1	Low	79 Å²	79	95.9 Å²	95.9	31%	0.31	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-26.9	176.6	-173.6	-103.8	0	0	0	112	W361 L370	W361-Y366 AromaticContact CD2-CD1 3.88Å; W361-Y366 HydrophobicContact CD2-CD1 3.88Å; W361-Y366 AromaticContact CD2-CE1 3.9Å; W361-Y366 HydrophobicContact CD2-CE1 3.9Å; W361-Y366 HydrophobicContact CD2-CG 4.22Å; W361-Y366 AromaticContact CE2-CE1 3.99Å; W361-Y366 AromaticContact CE3-CD1 3.82Å; W361-Y366 HydrophobicContact CE3-CD1 3.82Å; W361-Y366 AromaticContact CE3-CD2 3.72Å; W361-Y366 HydrophobicContact CE3-CD2 3.72Å; W361-Y366 AromaticContact CE3-CE1 3.95Å; W361-Y366 HydrophobicContact CE3-CE1 3.95Å; W361-Y366 AromaticContact CE3-CE2 3.85Å; W361-Y366 HydrophobicContact CE3-CE2 3.85Å; W361-Y366 AromaticContact CE3-CG 3.7Å; W361-Y366 HydrophobicContact CE3-CG 3.7Å; W361-Y366 AromaticContact CE3-CZ 3.96Å; W361-Y366 HydrophobicContact CG-CD1 4.22Å; W361-Y366 HydrophobicContact CG-CE1 4.5Å; W361-Y366 HydrophobicContact CH2-CD2 4.48Å; W361-Y366 HydrophobicContact CH2-CE1 4.25Å; W361-Y366 AromaticContact CH2-CE2 3.79Å; W361-Y366 HydrophobicContact CH2-CE2 3.79Å; W361-Y366 AromaticContact CH2-CZ 3.65Å; W361-Y366 HydrophobicContact CZ2-CE1 4.18Å; W361-Y366 AromaticContact CZ2-CZ 3.95Å; W361-Y366 HydrophobicContact CZ3-CD1 4.35Å; W361-Y366 AromaticContact CZ3-CD2 3.67Å; W361-Y366 HydrophobicContact CZ3-CD2 3.67Å; W361-Y366 HydrophobicContact CZ3-CE1 4.13Å; W361-Y366 AromaticContact CZ3-CE2 3.4Å; W361-Y366 HydrophobicContact CZ3-CE2 3.4Å; W361-Y366 VanDerWaalsContact CZ3-CE2 3.4Å; W361-Y366 HydrophobicContact CZ3-CG 4.14Å; W361-Y366 AromaticContact CZ3-CZ 3.66Å; Y366-L370 HydrophobicContact CE1-CD2 3.93Å; Y366-L370 WeakPolarHBondContact O-CB 3.31Å; Y366-L370 PolarHBondContact O-N 3.41Å
367	F	44.5	Very low	54	Low	64 Å²	64	88.8 Å²	88.8	28%	0.281	44%	0.437	S	S	.	.	H	α-helix	trans	-74.3	-49.9	-176.9	-77.5	-139	0	0	0	110.9	Q363 N365 A369 L370 D371 R405	Q363-F367 HydrophobicContact CB-CD2 3.91Å; Q363-F367 HydrophobicContact CB-CE2 3.7Å; Q363-F367 HydrophobicContact CB-CG 4.42Å; Q363-F367 HydrophobicContact CB-CZ 4.04Å; Q363-F367 HydrophobicContact CG-CD2 4.38Å; Q363-F367 HydrophobicContact CG-CE2 3.67Å; Q363-F367 HydrophobicContact CG-CZ 3.87Å; Q363-F367 WeakPolarHBondContact O-CB 3.25Å; Q363-F367 WeakPolarHBondContact O-CD2 3.36Å; Q363-F367 WeakPolarHBondContact O-CG 3.46Å; Q363-F367 PolarHBondContact O-N 2.79Å; N365-F367 PolarHBondContact O-N 2.99Å; F367-A369 PolarHBondContact O-N 2.8Å; F367-L370 CarbonylContact O-C 3.54Å; F367-L370 PolarHBondContact O-N 3.08Å; F367-L370 VanDerWaalsContact O-N 3.1Å; F367-D371 WeakPolarHBondContact O-CB 3.41Å; F367-D371 PolarHBondContact O-N 3.45Å; F367-R405 PolarHBondContact O-NH1 3.01Å; F367-R405 VanDerWaalsContact O-NH1 3.17Å
368	R	53	Low	56.8	Low	210 Å²	210	81.7 Å²	81.7	79%	0.792	40%	0.404	S	S	*	.	H	α-helix	trans	-51.2	-49.2	175.5	-81.4	-173.6	171.5	179.9	-2.2	113.2	L370 D371 Y372	R368-L370 VanDerWaalsContact C-N 3.34Å; R368-L370 PolarHBondContact O-N 3.42Å; R368-D371 PolarHBondContact O-N 3.3Å; R368-Y372 WeakPolarHBondContact O-CB 3.47Å; R368-Y372 PolarHBondContact O-N 3.27Å
369	A	64.1	Low	59.6	Low	63 Å²	63	75.9 Å²	75.9	52%	0.521	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-41	180	0	0	0	0	0	112.3	F367 K373	F367-A369 PolarHBondContact O-N 2.8Å; A369-K373 WeakPolarHBondContact O-CB 3.31Å; A369-K373 PolarHBondContact O-N 3.11Å
370	L	69.5	Low	62.4	Low	30 Å²	30	76.2 Å²	76.2	16%	0.157	39%	0.386	C	S	.	.	H	α-helix	trans	-75.9	-30	178.4	-164.9	73	0	0	0	112.5	Y366 F367 R368 I374 I397	Y366-L370 HydrophobicContact CE1-CD2 3.93Å; Y366-L370 WeakPolarHBondContact O-CB 3.31Å; Y366-L370 PolarHBondContact O-N 3.41Å; F367-L370 CarbonylContact O-C 3.54Å; F367-L370 PolarHBondContact O-N 3.08Å; F367-L370 VanDerWaalsContact O-N 3.1Å; R368-L370 VanDerWaalsContact C-N 3.34Å; R368-L370 PolarHBondContact O-N 3.42Å; L370-I374 WeakPolarHBondContact O-CD1 3.36Å; L370-I374 VanDerWaalsContact O-CG1 3.23Å; L370-I374 WeakPolarHBondContact O-CG1 3.42Å; L370-I374 PolarHBondContact O-N 3.05Å; L370-I397 HydrophobicContact CD1-CD1 3.57Å; L370-I397 HydrophobicContact CD1-CG1 4.08Å; L370-I397 HydrophobicContact CD2-CD1 3.89Å; L370-I397 HydrophobicContact CD2-CG1 4.24Å; L370-I397 HydrophobicContact CG-CD1 3.67Å; L370-I397 HydrophobicContact CG-CG1 4.42Å
371	D	79.8	Confident	65	Low	35 Å²	35	70.8 Å²	70.8	19%	0.187	36%	0.359	C	S	.	.	H	α-helix	trans	-68.2	-51.8	174.4	-71.2	-38.6	0	0	0	110.2	F367 R368 K373 I374 I375 R405 F409	F367-D371 WeakPolarHBondContact O-CB 3.41Å; F367-D371 PolarHBondContact O-N 3.45Å; R368-D371 PolarHBondContact O-N 3.3Å; D371-K373 VanDerWaalsContact C-N 3.27Å; D371-K373 PolarHBondContact O-N 2.77Å; D371-I374 PolarHBondContact O-N 3.48Å; D371-I375 WeakPolarHBondContact O-CG1 3.34Å; D371-I375 PolarHBondContact O-N 2.58Å; D371-R405 WeakPolarHBondContact OD1-CD 3.07Å; D371-R405 IonicContact OD1-CZ 3.16Å; D371-R405 VanDerWaalsContact OD1-CZ 3.24Å; D371-R405 IonicContact OD1-NE 2.75Å; D371-R405 PolarHBondContact OD1-NE 3.45Å; D371-R405 IonicContact OD1-NH1 2.69Å; D371-R405 PolarHBondContact OD1-NH1 2.85Å; D371-R405 IonicContact OD2-NH1 2.63Å; D371-F409 HydrophobicContact CB-CE1 3.92Å; D371-F409 HydrophobicContact CB-CZ 3.66Å; D371-F409 VanDerWaalsContact OD1-CZ 3.22Å; D371-F409 WeakPolarHBondContact OD1-CZ 3.5Å
372	Y	81.5	Confident	67.5	Low	155 Å²	155	68.6 Å²	68.6	61%	0.608	36%	0.359	S	S	*	.	H	α-helix	trans	-53.8	-44.2	172.2	180	-97.7	0	0	0	111.5	R368 I374 I375 Q376	R368-Y372 WeakPolarHBondContact O-CB 3.47Å; R368-Y372 PolarHBondContact O-N 3.27Å; Y372-I374 VanDerWaalsContact C-N 3.33Å; Y372-I374 PolarHBondContact O-N 3.12Å; Y372-I375 PolarHBondContact O-N 3.37Å; Y372-Q376 HydrophobicContact CE1-CB 4.45Å; Y372-Q376 VanDerWaalsContact O-CB 3.29Å; Y372-Q376 WeakPolarHBondContact O-CB 3.16Å; Y372-Q376 PolarHBondContact O-N 2.67Å
373	K	83	Confident	70	Confident	54 Å²	54	68.5 Å²	68.5	24%	0.235	35%	0.354	C	S	.	.	H	α-helix	trans	-69	-27	179.5	-158.7	157.8	-168.6	156.8	0	113.5	Y309 A369 D371 T377 L395	Y309-K373 VanDerWaalsContact CZ-NZ 3.26Å; A369-K373 WeakPolarHBondContact O-CB 3.31Å; A369-K373 PolarHBondContact O-N 3.11Å; D371-K373 VanDerWaalsContact C-N 3.27Å; D371-K373 PolarHBondContact O-N 2.77Å; K373-T377 WeakPolarHBondContact O-CB 3.03Å; K373-T377 PolarHBondContact O-N 3.09Å; K373-T377 VanDerWaalsContact O-N 3.08Å; K373-T377 PolarHBondContact O-OG1 3.25Å; K373-L395 HydrophobicContact CD-CD2 4.5Å; K373-L395 HydrophobicContact CG-CD2 3.99Å
374	I	86.3	Confident	72.2	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-71.4	-45.5	169.7	-64.8	157	0	0	0	110.6	L370 D371 Y372 T377 V378 I391 L395 I397 L402 R405 L406 F409	L370-I374 WeakPolarHBondContact O-CD1 3.36Å; L370-I374 VanDerWaalsContact O-CG1 3.23Å; L370-I374 WeakPolarHBondContact O-CG1 3.42Å; L370-I374 PolarHBondContact O-N 3.05Å; D371-I374 PolarHBondContact O-N 3.48Å; Y372-I374 VanDerWaalsContact C-N 3.33Å; Y372-I374 PolarHBondContact O-N 3.12Å; I374-T377 WeakPolarHBondContact O-CB 3.49Å; I374-T377 PolarHBondContact O-N 3.06Å; I374-V378 PolarHBondContact O-N 3.35Å; I374-I391 HydrophobicContact CG2-CG2 4.49Å; I374-L395 HydrophobicContact CB-CD1 4.26Å; I374-L395 HydrophobicContact CG1-CD1 3.56Å; I374-I397 HydrophobicContact CD1-CD1 3.96Å; I374-I397 HydrophobicContact CG1-CD1 3.91Å; I374-L402 HydrophobicContact CD1-CD2 3.82Å; I374-L402 HydrophobicContact CG1-CD2 3.88Å; I374-R405 HydrophobicContact CD1-CB 4.16Å; I374-L406 HydrophobicContact CG2-CD2 3.81Å; I374-L406 HydrophobicContact CG2-CG 4.26Å; I374-F409 HydrophobicContact CB-CE2 3.82Å; I374-F409 HydrophobicContact CD1-CE2 4.15Å; I374-F409 HydrophobicContact CD1-CZ 4.49Å; I374-F409 HydrophobicContact CG2-CD2 4.13Å; I374-F409 HydrophobicContact CG2-CE2 3.63Å
375	I	86	Confident	74.6	Confident	30 Å²	30	66.4 Å²	66.4	15%	0.154	34%	0.336	C	S	.	.	H	α-helix	trans	-61.7	-51.4	177.6	-63.9	164.2	0	0	0	109.7	D371 Y372 T377 V378 N379 F409 Y414	D371-I375 WeakPolarHBondContact O-CG1 3.34Å; D371-I375 PolarHBondContact O-N 2.58Å; Y372-I375 PolarHBondContact O-N 3.37Å; I375-T377 PolarHBondContact O-N 3.1Å; I375-V378 CarbonylContact O-C 3.45Å; I375-V378 WeakPolarHBondContact O-CA 3.49Å; I375-V378 WeakPolarHBondContact O-CB 3.22Å; I375-V378 PolarHBondContact O-N 2.82Å; I375-N379 PolarHBondContact O-N 3.36Å; I375-N379 PolarHBondContact O-OD1 2.99Å; I375-F409 HydrophobicContact CD1-CD1 4.1Å; I375-F409 HydrophobicContact CD1-CE1 4.12Å; I375-F409 HydrophobicContact CD1-CG 4.41Å; I375-F409 HydrophobicContact CD1-CZ 4.44Å; I375-F409 HydrophobicContact CG1-CD1 4.35Å; I375-F409 HydrophobicContact CG1-CD2 4.09Å; I375-F409 HydrophobicContact CG1-CE1 4.44Å; I375-F409 HydrophobicContact CG1-CE2 4.2Å; I375-F409 HydrophobicContact CG1-CG 4.19Å; I375-F409 HydrophobicContact CG1-CZ 4.37Å; I375-Y414 HydrophobicContact CD1-CD1 4.44Å; I375-Y414 HydrophobicContact CD1-CD2 4.28Å; I375-Y414 HydrophobicContact CD1-CG 3.95Å
376	Q	85.9	Confident	77.1	Confident	98 Å²	98	61.7 Å²	61.7	46%	0.458	31%	0.31	S	S	.	.	H	α-helix	trans	-54.9	-38.4	174.5	-169.2	-176.8	27.1	0	0	112.6	Y372 N379 S380	Y372-Q376 HydrophobicContact CE1-CB 4.45Å; Y372-Q376 VanDerWaalsContact O-CB 3.29Å; Y372-Q376 WeakPolarHBondContact O-CB 3.16Å; Y372-Q376 PolarHBondContact O-N 2.67Å; Q376-N379 PolarHBondContact O-N 3.29Å; Q376-S380 WeakPolarHBondContact O-CB 3.28Å; Q376-S380 PolarHBondContact O-N 3.36Å; Q376-S380 PolarHBondContact O-OG 3.01Å
377	T	88.4	Confident	79.7	Confident	4 Å²	4	58.9 Å²	58.9	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-62.9	-41.4	173.6	-62	0	0	0	0	111.8	K373 I374 I375 S380 I386 I391 Y394	K373-T377 WeakPolarHBondContact O-CB 3.03Å; K373-T377 PolarHBondContact O-N 3.09Å; K373-T377 VanDerWaalsContact O-N 3.08Å; K373-T377 PolarHBondContact O-OG1 3.25Å; I374-T377 WeakPolarHBondContact O-CB 3.49Å; I374-T377 PolarHBondContact O-N 3.06Å; I375-T377 PolarHBondContact O-N 3.1Å; T377-S380 PolarHBondContact O-OG 3.45Å; T377-I386 HydrophobicContact CG2-CD1 3.76Å; T377-I391 HydrophobicContact CG2-CG1 4.35Å; T377-I391 HydrophobicContact CG2-CG2 4.47Å; T377-Y394 HydrophobicContact CG2-CD1 3.56Å; T377-Y394 HydrophobicContact CG2-CE1 4.1Å; T377-Y394 HydrophobicContact CG2-CG 4.45Å; T377-Y394 WeakPolarHBondContact OG1-CD1 3.47Å; T377-Y394 WeakPolarHBondContact OG1-CE1 3.32Å
378	V	88.5	Confident	81.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-50.6	175.7	169.7	0	0	0	0	110.9	I374 I375 S380 S381 I386 I391 L406 V415 Y431	I374-V378 PolarHBondContact O-N 3.35Å; I375-V378 CarbonylContact O-C 3.45Å; I375-V378 WeakPolarHBondContact O-CA 3.49Å; I375-V378 WeakPolarHBondContact O-CB 3.22Å; I375-V378 PolarHBondContact O-N 2.82Å; V378-S380 VanDerWaalsContact C-N 3.28Å; V378-S380 PolarHBondContact O-N 3.19Å; V378-S381 WeakPolarHBondContact O-CB 3.28Å; V378-S381 PolarHBondContact O-N 3.17Å; V378-S381 PolarHBondContact O-OG 2.53Å; V378-I386 HydrophobicContact CB-CG2 4.46Å; V378-I386 HydrophobicContact CG2-CG2 3.99Å; V378-I391 HydrophobicContact CG2-CD1 4.13Å; V378-L406 HydrophobicContact CG2-CD2 4.14Å; V378-V415 HydrophobicContact CB-CG2 4.26Å; V378-V415 HydrophobicContact CG1-CG1 4.13Å; V378-V415 HydrophobicContact CG1-CG2 4.06Å; V378-V415 HydrophobicContact CG2-CG2 4.25Å; V378-Y431 WeakPolarHBondContact CG1-O 3.3Å
379	N	86.7	Confident	83.1	Confident	57 Å²	57	54.2 Å²	54.2	31%	0.305	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-35.4	-177.5	-59.1	31.9	0	0	0	111.4	I375 Q376 S381 G382 D432	I375-N379 PolarHBondContact O-N 3.36Å; I375-N379 PolarHBondContact O-OD1 2.99Å; Q376-N379 PolarHBondContact O-N 3.29Å; N379-S381 PolarHBondContact O-N 3.45Å; N379-G382 PolarHBondContact O-N 3.37Å; N379-G382 VanDerWaalsContact O-N 3.08Å; N379-D432 HydrophobicContact CB-CB 4.32Å; N379-D432 WeakPolarHBondContact CB-OD2 3.32Å; N379-D432 PolarHBondContact ND2-OD2 2.65Å
380	S	85	Confident	84.2	Confident	92 Å²	92	53.5 Å²	53.5	64%	0.643	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.9	173.5	73.1	0	0	0	0	115.2	Q376 T377 V378	Q376-S380 WeakPolarHBondContact O-CB 3.28Å; Q376-S380 PolarHBondContact O-N 3.36Å; Q376-S380 PolarHBondContact O-OG 3.01Å; T377-S380 PolarHBondContact O-OG 3.45Å; V378-S380 VanDerWaalsContact C-N 3.28Å; V378-S380 PolarHBondContact O-N 3.19Å
381	S	83.3	Confident	85	Confident	28 Å²	28	52 Å²	52	20%	0.196	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-3.8	174.1	72.4	0	0	0	0	114.7	V378 N379 E384 G385 I386	V378-S381 WeakPolarHBondContact O-CB 3.28Å; V378-S381 PolarHBondContact O-N 3.17Å; V378-S381 PolarHBondContact O-OG 2.53Å; N379-S381 PolarHBondContact O-N 3.45Å; S381-E384 PolarHBondContact O-N 3.24Å; S381-E384 VanDerWaalsContact O-N 3.16Å; S381-G385 PolarHBondContact O-N 3.03Å; S381-G385 WeakPolarHBondContact OG-CA 3.37Å; S381-I386 PolarHBondContact OG-N 2.79Å; S381-I386 VanDerWaalsContact OG-N 3.15Å
382	G	81.6	Confident	85.2	Confident	28 Å²	28	52.1 Å²	52.1	29%	0.289	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	-138.4	174.1	0	0	0	0	0	114	N379 E384 G385	N379-G382 PolarHBondContact O-N 3.37Å; N379-G382 VanDerWaalsContact O-N 3.08Å; G382-E384 PolarHBondContact O-N 3.18Å; G382-G385 PolarHBondContact O-N 3.36Å
383	N	82.7	Confident	85.1	Confident	88 Å²	88	52.9 Å²	52.9	47%	0.471	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.2	-179.4	-67.9	9.7	0	0	0	113.4	Y431 E436 P438	N383-Y431 WeakPolarHBondContact O-CE1 3.44Å; N383-E436 WeakPolarHBondContact CB-O 3.41Å; N383-E436 PolarHBondContact ND2-O 3.08Å; N383-E436 PolarHBondContact OD1-N 3.32Å; N383-P438 WeakPolarHBondContact O-CD 3.33Å
384	E	81.7	Confident	84.8	Confident	149 Å²	149	54.2 Å²	54.2	70%	0.696	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-44.8	173.4	-77.4	-150.9	166.3	0	0	112.2	S381 G382 K429 Y431	S381-E384 PolarHBondContact O-N 3.24Å; S381-E384 VanDerWaalsContact O-N 3.16Å; G382-E384 PolarHBondContact O-N 3.18Å; E384-K429 WeakPolarHBondContact O-CD 3.15Å; E384-K429 PolarHBondContact O-NZ 3.33Å; E384-Y431 VanDerWaalsContact C-CE1 3.45Å; E384-Y431 WeakPolarHBondContact O-CE1 2.98Å; E384-Y431 PolarHBondContact O-OH 3.04Å
385	G	84.2	Confident	84.4	Confident	5 Å²	5	54.7 Å²	54.7	5%	0.052	28%	0.277	C	S	.	.			trans	75.1	136.8	-175.5	0	0	0	0	0	114.8	S381 G382 K429 Y430	S381-G385 PolarHBondContact O-N 3.03Å; S381-G385 WeakPolarHBondContact OG-CA 3.37Å; G382-G385 PolarHBondContact O-N 3.36Å; G385-K429 VanDerWaalsContact O-CD 3.26Å; G385-K429 WeakPolarHBondContact O-CD 3.49Å; G385-K429 WeakPolarHBondContact O-CE 3.35Å; G385-K429 PolarHBondContact O-NZ 3.46Å; G385-Y430 CarbonylContact C-O 3.37Å; G385-Y430 WeakPolarHBondContact CA-O 3.05Å
386	I	88.8	Confident	83.8	Confident	27 Å²	27	58.2 Å²	58.2	14%	0.138	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	144.5	-171.7	-167.2	172.2	0	0	0	113.3	T377 V378 S381 D390 I391 K429 Y430	T377-I386 HydrophobicContact CG2-CD1 3.76Å; V378-I386 HydrophobicContact CB-CG2 4.46Å; V378-I386 HydrophobicContact CG2-CG2 3.99Å; S381-I386 PolarHBondContact OG-N 2.79Å; S381-I386 VanDerWaalsContact OG-N 3.15Å; I386-D390 HydrophobicContact CD1-CB 4.12Å; I386-D390 HydrophobicContact CG1-CB 3.75Å; I386-I391 HydrophobicContact CB-CG1 4.43Å; I386-I391 HydrophobicContact CD1-CG1 3.89Å; I386-I391 HydrophobicContact CG1-CG1 3.96Å; I386-I391 HydrophobicContact CG2-CD1 3.93Å; I386-I391 HydrophobicContact CG2-CG1 3.71Å; I386-K429 CarbonylContact O-C 3.55Å; I386-K429 WeakPolarHBondContact O-CA 3.26Å; I386-Y430 PolarHBondContact N-O 2.69Å; I386-Y430 PolarHBondContact O-N 2.8Å
387	T	88.8	Confident	83.2	Confident	19 Å²	19	54.6 Å²	54.6	12%	0.117	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	156	179.7	92.9	0	0	0	0	112.8	K389 D390 I391 M427 K429	T387-K389 PolarHBondContact O-N 3.23Å; T387-K389 WeakPolarHBondContact OG1-CB 3.45Å; T387-K389 PolarHBondContact OG1-N 2.89Å; T387-K389 VanDerWaalsContact OG1-N 3.13Å; T387-D390 WeakPolarHBondContact CB-OD2 3.32Å; T387-D390 WeakPolarHBondContact CG2-OD2 3.48Å; T387-D390 PolarHBondContact O-N 3.28Å; T387-D390 PolarHBondContact OG1-N 2.96Å; T387-D390 PolarHBondContact OG1-OD2 3.2Å; T387-I391 WeakPolarHBondContact O-CG1 3.36Å; T387-I391 PolarHBondContact O-N 3.24Å; T387-M427 HydrophobicContact CG2-CE 3.51Å; T387-K429 HydrophobicContact CG2-CG 4.19Å
388	L	86.2	Confident	82.4	Confident	44 Å²	44	57.3 Å²	57.3	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-53.4	-29.6	171.8	-175.8	67.3	0	0	0	113.5	N392 L402 A403 L406 Y430	L388-N392 VanDerWaalsContact O-CB 3.22Å; L388-N392 WeakPolarHBondContact O-CB 3.47Å; L388-N392 PolarHBondContact O-N 3.19Å; L388-N392 VanDerWaalsContact O-N 3.17Å; L388-L402 HydrophobicContact CD1-CB 3.6Å; L388-A403 HydrophobicContact CD1-CB 4.38Å; L388-A403 HydrophobicContact CD2-CB 4.19Å; L388-L406 HydrophobicContact CD1-CD1 3.61Å; L388-Y430 HydrophobicContact CB-CE2 4.15Å
389	K	83.6	Confident	81.8	Confident	133 Å²	133	64.7 Å²	64.7	58%	0.578	32%	0.319	S	S	*	.	H	α-helix	trans	-74.1	-33.6	178	179.5	-172.5	171.3	-167.2	0	111.3	T387 R393	T387-K389 PolarHBondContact O-N 3.23Å; T387-K389 WeakPolarHBondContact OG1-CB 3.45Å; T387-K389 PolarHBondContact OG1-N 2.89Å; T387-K389 VanDerWaalsContact OG1-N 3.13Å; K389-R393 WeakPolarHBondContact O-CB 3.01Å; K389-R393 PolarHBondContact O-N 3.48Å
390	D	86.4	Confident	81	Confident	47 Å²	47	69.7 Å²	69.7	25%	0.251	34%	0.338	S	S	.	.	H	α-helix	trans	-85.8	-36.1	-177.2	-60.1	-61.6	0	0	0	111.5	I386 T387 N392 R393 Y394	I386-D390 HydrophobicContact CD1-CB 4.12Å; I386-D390 HydrophobicContact CG1-CB 3.75Å; T387-D390 WeakPolarHBondContact CB-OD2 3.32Å; T387-D390 WeakPolarHBondContact CG2-OD2 3.48Å; T387-D390 PolarHBondContact O-N 3.28Å; T387-D390 PolarHBondContact OG1-N 2.96Å; T387-D390 PolarHBondContact OG1-OD2 3.2Å; D390-N392 VanDerWaalsContact C-N 3.29Å; D390-N392 PolarHBondContact O-N 2.96Å; D390-R393 WeakPolarHBondContact O-CB 3.24Å; D390-R393 PolarHBondContact O-N 3.02Å; D390-R393 VanDerWaalsContact O-N 3.1Å; D390-R393 IonicContact OD1-CZ 2.71Å; D390-R393 IonicContact OD1-NH1 3.21Å; D390-R393 PolarHBondContact OD1-NH1 3.2Å; D390-Y394 WeakPolarHBondContact O-CB 3.09Å; D390-Y394 PolarHBondContact O-N 2.76Å
391	I	86.5	Confident	80.5	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.3	-42.4	164.5	-54.5	167.1	0	0	0	110.2	I374 T377 V378 I386 T387 R393 Y394 L395 L402 L406 Y430	I374-I391 HydrophobicContact CG2-CG2 4.49Å; T377-I391 HydrophobicContact CG2-CG1 4.35Å; T377-I391 HydrophobicContact CG2-CG2 4.47Å; V378-I391 HydrophobicContact CG2-CD1 4.13Å; I386-I391 HydrophobicContact CB-CG1 4.43Å; I386-I391 HydrophobicContact CD1-CG1 3.89Å; I386-I391 HydrophobicContact CG1-CG1 3.96Å; I386-I391 HydrophobicContact CG2-CD1 3.93Å; I386-I391 HydrophobicContact CG2-CG1 3.71Å; T387-I391 WeakPolarHBondContact O-CG1 3.36Å; T387-I391 PolarHBondContact O-N 3.24Å; I391-R393 VanDerWaalsContact C-N 3.32Å; I391-R393 PolarHBondContact O-N 3.3Å; I391-Y394 PolarHBondContact O-N 3.18Å; I391-L395 HydrophobicContact CG2-CD1 3.81Å; I391-L395 HydrophobicContact CG2-CG 4.35Å; I391-L395 PolarHBondContact O-N 2.65Å; I391-L402 HydrophobicContact CB-CD1 4.17Å; I391-L402 HydrophobicContact CG2-CD1 3.8Å; I391-L402 HydrophobicContact CG2-CD2 3.6Å; I391-L402 HydrophobicContact CG2-CG 4.33Å; I391-L406 HydrophobicContact CD1-CD1 3.62Å; I391-L406 HydrophobicContact CD1-CD2 3.99Å; I391-L406 HydrophobicContact CD1-CG 4.46Å; I391-Y430 HydrophobicContact CD1-CD2 4.02Å
392	N	83.5	Confident	80.5	Confident	36 Å²	36	66.3 Å²	66.3	19%	0.193	31%	0.312	C	S	.	.	H	α-helix	trans	-64.2	-33.1	175	172.3	-132.6	0	0	0	113.2	L388 D390 R396 I397 R399 L402	L388-N392 VanDerWaalsContact O-CB 3.22Å; L388-N392 WeakPolarHBondContact O-CB 3.47Å; L388-N392 PolarHBondContact O-N 3.19Å; L388-N392 VanDerWaalsContact O-N 3.17Å; D390-N392 VanDerWaalsContact C-N 3.29Å; D390-N392 PolarHBondContact O-N 2.96Å; N392-R396 VanDerWaalsContact O-CA 3.27Å; N392-R396 WeakPolarHBondContact O-CA 3.46Å; N392-R396 PolarHBondContact O-N 2.88Å; N392-I397 PolarHBondContact ND2-O 2.73Å; N392-R399 HydrophobicContact CB-CG 3.67Å; N392-R399 PolarHBondContact OD1-NE 3.5Å; N392-L402 HydrophobicContact CB-CD1 3.8Å
393	R	79.2	Confident	80.5	Confident	172 Å²	172	66.6 Å²	66.6	65%	0.649	31%	0.312	S	S	*	.	H	α-helix	trans	-73.2	-41.5	175.6	176.3	-173.2	-82.1	156.3	-25	111.7	K389 D390 I391	K389-R393 WeakPolarHBondContact O-CB 3.01Å; K389-R393 PolarHBondContact O-N 3.48Å; D390-R393 WeakPolarHBondContact O-CB 3.24Å; D390-R393 PolarHBondContact O-N 3.02Å; D390-R393 VanDerWaalsContact O-N 3.1Å; D390-R393 IonicContact OD1-CZ 2.71Å; D390-R393 IonicContact OD1-NH1 3.21Å; D390-R393 PolarHBondContact OD1-NH1 3.2Å; I391-R393 VanDerWaalsContact C-N 3.32Å; I391-R393 PolarHBondContact O-N 3.3Å
394	Y	78.1	Confident	80.2	Confident	81 Å²	81	71 Å²	71	32%	0.318	32%	0.322	S	S	.	.	H	α-helix	trans	-74.5	-49.5	-176.7	-175.6	-116.3	0	0	0	112.4	P319 T377 D390 I391	P319-Y394 HydrophobicContact CB-CE2 3.94Å; P319-Y394 HydrophobicContact CG-CD2 4.21Å; P319-Y394 HydrophobicContact CG-CE2 3.61Å; T377-Y394 HydrophobicContact CG2-CD1 3.56Å; T377-Y394 HydrophobicContact CG2-CE1 4.1Å; T377-Y394 HydrophobicContact CG2-CG 4.45Å; T377-Y394 WeakPolarHBondContact OG1-CD1 3.47Å; T377-Y394 WeakPolarHBondContact OG1-CE1 3.32Å; D390-Y394 WeakPolarHBondContact O-CB 3.09Å; D390-Y394 PolarHBondContact O-N 2.76Å; I391-Y394 PolarHBondContact O-N 3.18Å
395	L	77.8	Confident	80.3	Confident	10 Å²	10	65 Å²	65	5%	0.052	29%	0.293	C	S	.	.	H	α-helix	trans	-93.9	-6.8	-174.7	-58.5	-179.3	0	0	0	114.3	K373 I374 I391 I397	K373-L395 HydrophobicContact CD-CD2 4.5Å; K373-L395 HydrophobicContact CG-CD2 3.99Å; I374-L395 HydrophobicContact CB-CD1 4.26Å; I374-L395 HydrophobicContact CG1-CD1 3.56Å; I391-L395 HydrophobicContact CG2-CD1 3.81Å; I391-L395 HydrophobicContact CG2-CG 4.35Å; I391-L395 PolarHBondContact O-N 2.65Å; L395-I397 HydrophobicContact CB-CD1 3.69Å; L395-I397 HydrophobicContact CB-CG1 3.83Å; L395-I397 HydrophobicContact CD1-CD1 3.79Å; L395-I397 HydrophobicContact CG-CD1 4.38Å; L395-I397 PolarHBondContact O-N 3.14Å
396	R	72.9	Confident	80.4	Confident	104 Å²	104	64.7 Å²	64.7	39%	0.392	29%	0.29	S	S	.	.			trans	56.5	-4.5	-171	-63.1	-172.9	175	179.6	6.2	116.3	P322 N392	P322-R396 PolarHBondContact O-NH2 2.86Å; N392-R396 VanDerWaalsContact O-CA 3.27Å; N392-R396 WeakPolarHBondContact O-CA 3.46Å; N392-R396 PolarHBondContact O-N 2.88Å
397	I	73.4	Confident	80	Confident	22 Å²	22	66.8 Å²	66.8	11%	0.113	30%	0.304	C	S	.	.			trans	-58.7	136.1	178.7	-54.4	164.4	0	0	0	110.8	L370 I374 N392 L395 R399 V401 L402	L370-I397 HydrophobicContact CD1-CD1 3.57Å; L370-I397 HydrophobicContact CD1-CG1 4.08Å; L370-I397 HydrophobicContact CD2-CD1 3.89Å; L370-I397 HydrophobicContact CD2-CG1 4.24Å; L370-I397 HydrophobicContact CG-CD1 3.67Å; L370-I397 HydrophobicContact CG-CG1 4.42Å; I374-I397 HydrophobicContact CD1-CD1 3.96Å; I374-I397 HydrophobicContact CG1-CD1 3.91Å; N392-I397 PolarHBondContact ND2-O 2.73Å; L395-I397 HydrophobicContact CB-CD1 3.69Å; L395-I397 HydrophobicContact CB-CG1 3.83Å; L395-I397 HydrophobicContact CD1-CD1 3.79Å; L395-I397 HydrophobicContact CG-CD1 4.38Å; L395-I397 PolarHBondContact O-N 3.14Å; I397-R399 PolarHBondContact O-N 3.32Å; I397-V401 HydrophobicContact CG2-CB 3.9Å; I397-V401 HydrophobicContact CG2-CG1 3.85Å; I397-L402 HydrophobicContact CB-CD1 4.17Å; I397-L402 HydrophobicContact CB-CD2 3.95Å; I397-L402 HydrophobicContact CB-CG 3.8Å; I397-L402 HydrophobicContact CD1-CD2 3.84Å; I397-L402 HydrophobicContact CG2-CD2 4.03Å; I397-L402 HydrophobicContact CG2-CG 3.79Å; I397-L402 WeakPolarHBondContact O-CD1 3.36Å
398	S	72.1	Confident	79.7	Confident	62 Å²	62	73.4 Å²	73.4	43%	0.434	33%	0.327	S	S	.	.			trans	-49.4	132.2	175.9	173.5	0	0	0	0	113	K400 V401 L402	S398-K400 PolarHBondContact O-N 2.83Å; S398-K400 VanDerWaalsContact O-N 3.11Å; S398-K400 PolarHBondContact OG-N 2.54Å; S398-V401 WeakPolarHBondContact O-CA 3.44Å; S398-V401 WeakPolarHBondContact O-CB 3.47Å; S398-V401 PolarHBondContact O-N 3.05Å; S398-L402 PolarHBondContact O-N 3.33Å
399	R	74.8	Confident	79.8	Confident	155 Å²	155	71.7 Å²	71.7	59%	0.585	32%	0.318	S	S	*	.	H	α-helix	trans	-56	-28.5	176.2	-78.7	-178.9	-98.2	147.7	0.1	113.7	N392 I397 V401 A403	N392-R399 HydrophobicContact CB-CG 3.67Å; N392-R399 PolarHBondContact OD1-NE 3.5Å; I397-R399 PolarHBondContact O-N 3.32Å; R399-V401 VanDerWaalsContact C-N 3.32Å; R399-A403 VanDerWaalsContact O-CB 3.26Å; R399-A403 WeakPolarHBondContact O-CB 3.3Å; R399-A403 PolarHBondContact O-N 3.48Å
400	K	71.1	Confident	79.8	Confident	161 Å²	161	69 Å²	69	70%	0.7	31%	0.307	S	S	*	.	H	α-helix	trans	-74.5	-18	174	-69.1	-173.3	-177.6	175.1	0	113.8	S398 R404	S398-K400 PolarHBondContact O-N 2.83Å; S398-K400 VanDerWaalsContact O-N 3.11Å; S398-K400 PolarHBondContact OG-N 2.54Å; K400-R404 PolarHBondContact O-NE 2.92Å; K400-R404 PolarHBondContact O-NH2 2.57Å
401	V	74.8	Confident	79.6	Confident	49 Å²	49	75.2 Å²	75.2	30%	0.297	33%	0.332	S	S	.	.	H	α-helix	trans	-93.6	-48.6	175.8	176.4	0	0	0	0	109.1	I397 S398 R399 A403 R404 R405	I397-V401 HydrophobicContact CG2-CB 3.9Å; I397-V401 HydrophobicContact CG2-CG1 3.85Å; S398-V401 WeakPolarHBondContact O-CA 3.44Å; S398-V401 WeakPolarHBondContact O-CB 3.47Å; S398-V401 PolarHBondContact O-N 3.05Å; R399-V401 VanDerWaalsContact C-N 3.32Å; V401-A403 PolarHBondContact O-N 3.4Å; V401-R404 PolarHBondContact O-N 3.24Å; V401-R404 VanDerWaalsContact O-N 3.08Å; V401-R405 PolarHBondContact O-N 3.25Å
402	L	83.4	Confident	79.4	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-53.7	-49.7	174.3	-75.7	175.8	0	0	0	112.5	I374 L388 I391 N392 I397 S398 R404 R405 L406	I374-L402 HydrophobicContact CD1-CD2 3.82Å; I374-L402 HydrophobicContact CG1-CD2 3.88Å; L388-L402 HydrophobicContact CD1-CB 3.6Å; I391-L402 HydrophobicContact CB-CD1 4.17Å; I391-L402 HydrophobicContact CG2-CD1 3.8Å; I391-L402 HydrophobicContact CG2-CD2 3.6Å; I391-L402 HydrophobicContact CG2-CG 4.33Å; N392-L402 HydrophobicContact CB-CD1 3.8Å; I397-L402 HydrophobicContact CB-CD1 4.17Å; I397-L402 HydrophobicContact CB-CD2 3.95Å; I397-L402 HydrophobicContact CB-CG 3.8Å; I397-L402 HydrophobicContact CD1-CD2 3.84Å; I397-L402 HydrophobicContact CG2-CD2 4.03Å; I397-L402 HydrophobicContact CG2-CG 3.79Å; I397-L402 WeakPolarHBondContact O-CD1 3.36Å; S398-L402 PolarHBondContact O-N 3.33Å; L402-R404 PolarHBondContact O-N 2.87Å; L402-R405 PolarHBondContact O-N 2.91Å; L402-R405 VanDerWaalsContact O-N 3.16Å; L402-L406 HydrophobicContact CB-CD1 4.27Å; L402-L406 WeakPolarHBondContact O-CB 3.32Å; L402-L406 WeakPolarHBondContact O-CD1 3.39Å; L402-L406 WeakPolarHBondContact O-CG 3.33Å; L402-L406 PolarHBondContact O-N 3.25Å
403	A	80.4	Confident	79.4	Confident	34 Å²	34	79.2 Å²	79.2	28%	0.281	37%	0.365	S	S	.	.	H	α-helix	trans	-61	-32	179.3	0	0	0	0	0	113.1	L388 R399 V401 T407	L388-A403 HydrophobicContact CD1-CB 4.38Å; L388-A403 HydrophobicContact CD2-CB 4.19Å; R399-A403 VanDerWaalsContact O-CB 3.26Å; R399-A403 WeakPolarHBondContact O-CB 3.3Å; R399-A403 PolarHBondContact O-N 3.48Å; V401-A403 PolarHBondContact O-N 3.4Å; A403-T407 WeakPolarHBondContact O-CB 3.37Å; A403-T407 PolarHBondContact O-N 2.87Å; A403-T407 PolarHBondContact O-OG1 3.26Å
404	R	77.1	Confident	79.6	Confident	181 Å²	181	77.3 Å²	77.3	68%	0.683	36%	0.359	S	S	*	.	H	α-helix	trans	-77.8	-32.1	176.6	-79.6	-174.9	-73.8	169.9	-0.6	113.1	K400 V401 L402 R408	K400-R404 PolarHBondContact O-NE 2.92Å; K400-R404 PolarHBondContact O-NH2 2.57Å; V401-R404 PolarHBondContact O-N 3.24Å; V401-R404 VanDerWaalsContact O-N 3.08Å; L402-R404 PolarHBondContact O-N 2.87Å; R404-R408 PolarHBondContact O-N 2.81Å
405	R	82.4	Confident	80.1	Confident	22 Å²	22	73.7 Å²	73.7	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-76.6	-41.9	174.5	-73.8	-177.3	176.5	-145.1	8.6	112	F367 D371 I374 V401 L402 R408 F409	F367-R405 PolarHBondContact O-NH1 3.01Å; F367-R405 VanDerWaalsContact O-NH1 3.17Å; D371-R405 WeakPolarHBondContact OD1-CD 3.07Å; D371-R405 IonicContact OD1-CZ 3.16Å; D371-R405 VanDerWaalsContact OD1-CZ 3.24Å; D371-R405 IonicContact OD1-NE 2.75Å; D371-R405 PolarHBondContact OD1-NE 3.45Å; D371-R405 IonicContact OD1-NH1 2.69Å; D371-R405 PolarHBondContact OD1-NH1 2.85Å; D371-R405 IonicContact OD2-NH1 2.63Å; I374-R405 HydrophobicContact CD1-CB 4.16Å; V401-R405 PolarHBondContact O-N 3.25Å; L402-R405 PolarHBondContact O-N 2.91Å; L402-R405 VanDerWaalsContact O-N 3.16Å; R405-R408 CarbonylContact O-C 3.54Å; R405-R408 WeakPolarHBondContact O-CA 3.29Å; R405-R408 VanDerWaalsContact O-CB 3.31Å; R405-R408 WeakPolarHBondContact O-CB 3.2Å; R405-R408 PolarHBondContact O-N 2.88Å; R405-F409 HydrophobicContact CB-CE2 3.9Å; R405-F409 HydrophobicContact CB-CZ 4.01Å; R405-F409 VanDerWaalsContact O-CD2 3.3Å; R405-F409 WeakPolarHBondContact O-CD2 3.27Å; R405-F409 VanDerWaalsContact O-CG 3.3Å; R405-F409 WeakPolarHBondContact O-CG 3.16Å; R405-F409 PolarHBondContact O-N 3.16Å
406	L	87.1	Confident	80.5	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-64.7	-45.2	178.2	-71.9	158	0	0	0	112.1	I374 V378 L388 I391 L402 R408 F409 E410 V415 Y430	I374-L406 HydrophobicContact CG2-CD2 3.81Å; I374-L406 HydrophobicContact CG2-CG 4.26Å; V378-L406 HydrophobicContact CG2-CD2 4.14Å; L388-L406 HydrophobicContact CD1-CD1 3.61Å; I391-L406 HydrophobicContact CD1-CD1 3.62Å; I391-L406 HydrophobicContact CD1-CD2 3.99Å; I391-L406 HydrophobicContact CD1-CG 4.46Å; L402-L406 HydrophobicContact CB-CD1 4.27Å; L402-L406 WeakPolarHBondContact O-CB 3.32Å; L402-L406 WeakPolarHBondContact O-CD1 3.39Å; L402-L406 WeakPolarHBondContact O-CG 3.33Å; L402-L406 PolarHBondContact O-N 3.25Å; L406-R408 PolarHBondContact O-N 2.82Å; L406-R408 VanDerWaalsContact O-N 3.17Å; L406-F409 HydrophobicContact CD2-CD2 4.29Å; L406-F409 PolarHBondContact O-N 3.05Å; L406-F409 VanDerWaalsContact O-N 3.12Å; L406-E410 VanDerWaalsContact O-CB 3.26Å; L406-E410 WeakPolarHBondContact O-CB 3.45Å; L406-E410 PolarHBondContact O-N 3.12Å; L406-V415 HydrophobicContact CD2-CG1 4.5Å; L406-Y430 HydrophobicContact CB-CD1 4.28Å; L406-Y430 HydrophobicContact CB-CE1 3.76Å; L406-Y430 HydrophobicContact CD1-CD2 4.24Å; L406-Y430 HydrophobicContact CD1-CE1 4.4Å; L406-Y430 HydrophobicContact CD1-CE2 3.93Å; L406-Y430 HydrophobicContact CD2-CD1 4Å; L406-Y430 HydrophobicContact CD2-CD2 4.45Å; L406-Y430 HydrophobicContact CD2-CE1 4.31Å; L406-Y430 HydrophobicContact CD2-CG 4.06Å; L406-Y430 HydrophobicContact CG-CE1 4.37Å
407	T	81	Confident	81.1	Confident	71 Å²	71	73.8 Å²	73.8	44%	0.436	35%	0.351	S	S	.	.	H	α-helix	trans	-67.9	-10.3	172	-60.2	0	0	0	0	113.5	A403 E410	A403-T407 WeakPolarHBondContact O-CB 3.37Å; A403-T407 PolarHBondContact O-N 2.87Å; A403-T407 PolarHBondContact O-OG1 3.26Å; T407-E410 WeakPolarHBondContact CA-OE2 3.3Å
408	R	81.9	Confident	81.6	Confident	158 Å²	158	73.7 Å²	73.7	60%	0.596	35%	0.351	S	S	*	.	H	α-helix	trans	-83.5	-51.3	164.4	178.4	177.7	175.1	164.1	7	110.6	R404 R405 L406 E410 K411 D412	R404-R408 PolarHBondContact O-N 2.81Å; R405-R408 CarbonylContact O-C 3.54Å; R405-R408 WeakPolarHBondContact O-CA 3.29Å; R405-R408 VanDerWaalsContact O-CB 3.31Å; R405-R408 WeakPolarHBondContact O-CB 3.2Å; R405-R408 PolarHBondContact O-N 2.88Å; L406-R408 PolarHBondContact O-N 2.82Å; L406-R408 VanDerWaalsContact O-N 3.17Å; R408-E410 PolarHBondContact O-N 3.45Å; R408-K411 CarbonylContact O-C 3.5Å; R408-K411 WeakPolarHBondContact O-CA 3.44Å; R408-K411 WeakPolarHBondContact O-CB 3.46Å; R408-K411 PolarHBondContact O-N 2.88Å; R408-D412 VanDerWaalsContact CG-OD2 3.26Å; R408-D412 WeakPolarHBondContact CG-OD2 3.45Å; R408-D412 IonicContact CZ-OD2 3.26Å; R408-D412 IonicContact NE-OD1 3.99Å; R408-D412 IonicContact NE-OD2 2.67Å; R408-D412 PolarHBondContact NE-OD2 3.29Å; R408-D412 IonicContact NH2-OD2 2.81Å; R408-D412 PolarHBondContact NH2-OD2 2.79Å; R408-D412 WeakPolarHBondContact O-CB 3.47Å; R408-D412 VanDerWaalsContact O-CG 3.31Å; R408-D412 PolarHBondContact O-N 3.33Å
409	F	88.9	Confident	82	Confident	7 Å²	7	71.9 Å²	71.9	3%	0.031	34%	0.336	C	S	.	.	H	α-helix	trans	-59.5	-29.7	177.7	-55.5	-35.5	0	0	0	114.1	D371 I374 I375 R405 L406 G413 Y414 V415	D371-F409 HydrophobicContact CB-CE1 3.92Å; D371-F409 HydrophobicContact CB-CZ 3.66Å; D371-F409 VanDerWaalsContact OD1-CZ 3.22Å; D371-F409 WeakPolarHBondContact OD1-CZ 3.5Å; I374-F409 HydrophobicContact CB-CE2 3.82Å; I374-F409 HydrophobicContact CD1-CE2 4.15Å; I374-F409 HydrophobicContact CD1-CZ 4.49Å; I374-F409 HydrophobicContact CG2-CD2 4.13Å; I374-F409 HydrophobicContact CG2-CE2 3.63Å; I375-F409 HydrophobicContact CD1-CD1 4.1Å; I375-F409 HydrophobicContact CD1-CE1 4.12Å; I375-F409 HydrophobicContact CD1-CG 4.41Å; I375-F409 HydrophobicContact CD1-CZ 4.44Å; I375-F409 HydrophobicContact CG1-CD1 4.35Å; I375-F409 HydrophobicContact CG1-CD2 4.09Å; I375-F409 HydrophobicContact CG1-CE1 4.44Å; I375-F409 HydrophobicContact CG1-CE2 4.2Å; I375-F409 HydrophobicContact CG1-CG 4.19Å; I375-F409 HydrophobicContact CG1-CZ 4.37Å; R405-F409 HydrophobicContact CB-CE2 3.9Å; R405-F409 HydrophobicContact CB-CZ 4.01Å; R405-F409 VanDerWaalsContact O-CD2 3.3Å; R405-F409 WeakPolarHBondContact O-CD2 3.27Å; R405-F409 VanDerWaalsContact O-CG 3.3Å; R405-F409 WeakPolarHBondContact O-CG 3.16Å; R405-F409 PolarHBondContact O-N 3.16Å; L406-F409 HydrophobicContact CD2-CD2 4.29Å; L406-F409 PolarHBondContact O-N 3.05Å; L406-F409 VanDerWaalsContact O-N 3.12Å; F409-G413 CarbonylContact O-C 3.48Å; F409-G413 PolarHBondContact O-N 3.1Å; F409-G413 VanDerWaalsContact O-N 3.09Å; F409-Y414 HydrophobicContact CD1-CD2 4.32Å; F409-Y414 PolarHBondContact O-N 2.89Å; F409-V415 HydrophobicContact CB-CB 3.93Å; F409-V415 HydrophobicContact CB-CG2 3.78Å; F409-V415 HydrophobicContact CD2-CG2 4.39Å; F409-V415 HydrophobicContact CG-CG2 4.47Å; F409-V415 PolarHBondContact O-N 2.99Å
410	E	84.2	Confident	82.2	Confident	76 Å²	76	65.8 Å²	65.8	36%	0.355	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-35.8	171.6	-175.8	-178.6	-171.1	0	0	112.4	L406 T407 R408 V415 A417	L406-E410 VanDerWaalsContact O-CB 3.26Å; L406-E410 WeakPolarHBondContact O-CB 3.45Å; L406-E410 PolarHBondContact O-N 3.12Å; T407-E410 WeakPolarHBondContact CA-OE2 3.3Å; R408-E410 PolarHBondContact O-N 3.45Å; E410-V415 WeakPolarHBondContact CA-O 3.27Å; E410-A417 HydrophobicContact CG-CB 4.14Å
411	K	81.4	Confident	82.3	Confident	178 Å²	178	59.5 Å²	59.5	77%	0.774	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-39.3	173.3	-74.9	-175.5	161.4	-140.9	0	113	R408 G413	R408-K411 CarbonylContact O-C 3.5Å; R408-K411 WeakPolarHBondContact O-CA 3.44Å; R408-K411 WeakPolarHBondContact O-CB 3.46Å; R408-K411 PolarHBondContact O-N 2.88Å; K411-G413 PolarHBondContact O-N 3.31Å
412	D	82.1	Confident	82	Confident	69 Å²	69	59.7 Å²	59.7	37%	0.369	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	4.9	-177.9	-60.7	12.3	0	0	0	111.5	R408 Y414	R408-D412 VanDerWaalsContact CG-OD2 3.26Å; R408-D412 WeakPolarHBondContact CG-OD2 3.45Å; R408-D412 IonicContact CZ-OD2 3.26Å; R408-D412 IonicContact NE-OD1 3.99Å; R408-D412 IonicContact NE-OD2 2.67Å; R408-D412 PolarHBondContact NE-OD2 3.29Å; R408-D412 IonicContact NH2-OD2 2.81Å; R408-D412 PolarHBondContact NH2-OD2 2.79Å; R408-D412 WeakPolarHBondContact O-CB 3.47Å; R408-D412 VanDerWaalsContact O-CG 3.31Å; R408-D412 PolarHBondContact O-N 3.33Å; D412-Y414 VanDerWaalsContact C-N 3.34Å; D412-Y414 HydrophobicContact CB-CD2 3.69Å; D412-Y414 HydrophobicContact CB-CE2 3.72Å; D412-Y414 PolarHBondContact O-N 3.11Å
413	G	83.1	Confident	81.4	Confident	51 Å²	51	61 Å²	61	53%	0.526	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-3.2	172.5	0	0	0	0	0	116.8	F409 K411 P433	F409-G413 CarbonylContact O-C 3.48Å; F409-G413 PolarHBondContact O-N 3.1Å; F409-G413 VanDerWaalsContact O-N 3.09Å; K411-G413 PolarHBondContact O-N 3.31Å; G413-P433 WeakPolarHBondContact O-CG 2.97Å
414	Y	84.7	Confident	80.7	Confident	133 Å²	133	68.5 Å²	68.5	52%	0.522	33%	0.33	S	S	.	.	S	Bend	trans	-79.7	-15.2	-175.1	-59.9	-67.2	0	0	0	115.3	I375 F409 D412 P433	I375-Y414 HydrophobicContact CD1-CD1 4.44Å; I375-Y414 HydrophobicContact CD1-CD2 4.28Å; I375-Y414 HydrophobicContact CD1-CG 3.95Å; F409-Y414 HydrophobicContact CD1-CD2 4.32Å; F409-Y414 PolarHBondContact O-N 2.89Å; D412-Y414 VanDerWaalsContact C-N 3.34Å; D412-Y414 HydrophobicContact CB-CD2 3.69Å; D412-Y414 HydrophobicContact CB-CE2 3.72Å; D412-Y414 PolarHBondContact O-N 3.11Å; Y414-P433 VanDerWaalsContact O-CD 3.29Å; Y414-P433 WeakPolarHBondContact O-CD 3.45Å
415	V	87.8	Confident	80.1	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.03	32%	0.321	C	S	.	.			trans	-145.1	130.7	-174.6	168	0	0	0	0	110.7	V378 L406 F409 E410 Y430	V378-V415 HydrophobicContact CB-CG2 4.26Å; V378-V415 HydrophobicContact CG1-CG1 4.13Å; V378-V415 HydrophobicContact CG1-CG2 4.06Å; V378-V415 HydrophobicContact CG2-CG2 4.25Å; L406-V415 HydrophobicContact CD2-CG1 4.5Å; F409-V415 HydrophobicContact CB-CB 3.93Å; F409-V415 HydrophobicContact CB-CG2 3.78Å; F409-V415 HydrophobicContact CD2-CG2 4.39Å; F409-V415 HydrophobicContact CG-CG2 4.47Å; F409-V415 PolarHBondContact O-N 2.99Å; E410-V415 WeakPolarHBondContact CA-O 3.27Å; V415-Y430 HydrophobicContact CG1-CD1 3.71Å; V415-Y430 HydrophobicContact CG1-CG 4.18Å
416	K	86.1	Confident	79.6	Confident	98 Å²	98	69.9 Å²	69.9	43%	0.426	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.6	174.2	-170.8	173.4	-174.6	176.5	0	109.9	Y431	K416-Y431 PolarHBondContact N-O 2.89Å; K416-Y431 PolarHBondContact O-N 3.48Å
417	A	86.2	Confident	79.2	Confident	17 Å²	17	72.7 Å²	72.7	14%	0.14	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.8	179.9	0	0	0	0	0	111.2	E410 W428 Y430	E410-A417 HydrophobicContact CG-CB 4.14Å; A417-W428 HydrophobicContact CB-CE3 3.98Å; A417-W428 HydrophobicContact CB-CZ3 4.09Å; A417-Y430 HydrophobicContact CB-CD1 3.76Å; A417-Y430 HydrophobicContact CB-CE1 3.78Å
418	L	82.4	Confident	79.4	Confident	21 Å²	21	74.6 Å²	74.6	11%	0.11	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	147.1	-179.2	-70.6	172.5	0	0	0	111.9	F420 W428 K429 Y431 P437 Y443	L418-F420 HydrophobicContact CB-CD2 4.39Å; L418-F420 HydrophobicContact CB-CE2 3.7Å; L418-W428 WeakPolarHBondContact O-CA 2.94Å; L418-K429 PolarHBondContact N-O 2.84Å; L418-K429 PolarHBondContact O-N 2.75Å; L418-Y431 HydrophobicContact CB-CD2 4.38Å; L418-Y431 HydrophobicContact CB-CE2 4.04Å; L418-Y431 HydrophobicContact CD1-CD2 4.26Å; L418-Y431 HydrophobicContact CD1-CE2 4.25Å; L418-P437 HydrophobicContact CD1-CB 4.08Å; L418-P437 HydrophobicContact CD1-CG 3.62Å; L418-Y443 HydrophobicContact CD2-CE2 4.49Å
419	M	81.7	Confident	79.6	Confident	24 Å²	24	69.1 Å²	69.1	12%	0.118	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.9	-173.8	-172.9	78.9	77.3	0	0	111.7	R426 W428 T463	M419-R426 HydrophobicContact CG-CB 4.26Å; M419-R426 HydrophobicContact SD-CB 3.79Å; M419-W428 HydrophobicContact CB-CE3 4.32Å; M419-W428 HydrophobicContact CB-CZ3 4.33Å; M419-W428 HydrophobicContact CE-CD2 3.88Å; M419-W428 HydrophobicContact CE-CE3 4.47Å; M419-W428 HydrophobicContact CE-CG 4.38Å; M419-W428 HydrophobicContact CE-CH2 4.16Å; M419-W428 HydrophobicContact CE-CZ2 3.49Å; M419-W428 VanDerWaalsContact CE-CZ2 3.49Å; M419-W428 HydrophobicContact SD-CD2 4.19Å; M419-W428 HydrophobicContact SD-CG 4.33Å; M419-T463 HydrophobicContact CB-CG2 4.06Å; M419-T463 HydrophobicContact CG-CG2 3.61Å; M419-T463 WeakPolarHBondContact O-CA 3.33Å; M419-T463 WeakPolarHBondContact O-CB 3.29Å
420	F	77.8	Confident	79.6	Confident	26 Å²	26	69.3 Å²	69.3	11%	0.114	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	156.4	-179.4	-73.4	-93.3	0	0	0	112.7	L418 R426 M427 K429 Y431 P437 S439 D464	L418-F420 HydrophobicContact CB-CD2 4.39Å; L418-F420 HydrophobicContact CB-CE2 3.7Å; F420-R426 WeakPolarHBondContact O-CA 2.9Å; F420-M427 PolarHBondContact N-O 2.68Å; F420-M427 PolarHBondContact O-N 3.07Å; F420-K429 HydrophobicContact CD2-CB 4.06Å; F420-K429 HydrophobicContact CD2-CD 4.17Å; F420-K429 HydrophobicContact CD2-CG 4.31Å; F420-K429 HydrophobicContact CE2-CB 4.32Å; F420-K429 HydrophobicContact CE2-CD 4.48Å; F420-Y431 AromaticContact CE2-CE2 3.76Å; F420-Y431 HydrophobicContact CE2-CE2 3.76Å; F420-Y431 AromaticContact CE2-CZ 3.79Å; F420-Y431 WeakPolarHBondContact CE2-OH 2.99Å; F420-Y431 HydrophobicContact CZ-CE2 4.44Å; F420-Y431 VanDerWaalsContact CZ-OH 3.28Å; F420-Y431 WeakPolarHBondContact CZ-OH 3.29Å; F420-P437 HydrophobicContact CZ-CB 4.39Å; F420-S439 VanDerWaalsContact CE1-OG 3.3Å; F420-S439 WeakPolarHBondContact CE1-OG 3.19Å; F420-S439 WeakPolarHBondContact CZ-OG 3.28Å; F420-D464 HydrophobicContact CD1-CB 4.27Å
421	T	73.6	Confident	79.9	Confident	29 Å²	29	65.7 Å²	65.7	18%	0.178	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	82.2	-175	-47.6	0	0	0	0	111.9	G423 T463 D464	T421-G423 VanDerWaalsContact C-N 3.32Å; T421-G423 PolarHBondContact O-N 3.26Å; T421-T463 PolarHBondContact OG1-OG1 2.98Å; T421-D464 VanDerWaalsContact CB-OD1 3.24Å; T421-D464 WeakPolarHBondContact CB-OD1 3.17Å; T421-D464 PolarHBondContact N-OD1 3.03Å; T421-D464 PolarHBondContact N-OD2 3.48Å; T421-D464 PolarHBondContact OG1-OD1 3.1Å
422	A	69.5	Low	80.1	Confident	53 Å²	53	58.7 Å²	58.7	44%	0.438	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	85.9	171.2	0	0	0	0	0	110.8	R424 V425 M427	A422-R424 PolarHBondContact O-N 3.27Å; A422-V425 PolarHBondContact N-O 2.98Å; A422-V425 PolarHBondContact O-N 2.99Å; A422-M427 HydrophobicContact CB-CG 4.03Å; A422-M427 HydrophobicContact CB-SD 3.49Å; A422-M427 WeakPolarHBondContact CB-SD 3.44Å
423	G	70.1	Confident	80.2	Confident	27 Å²	27	58 Å²	58	28%	0.278	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	-100.5	179	0	0	0	0	0	113	T421 Y503	T421-G423 VanDerWaalsContact C-N 3.32Å; T421-G423 PolarHBondContact O-N 3.26Å; G423-Y503 WeakPolarHBondContact CA-OH 3.13Å; G423-Y503 PolarHBondContact O-OH 2.71Å
424	R	64.9	Low	80.2	Confident	193 Å²	193	64.7 Å²	64.7	73%	0.728	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	13.9	173.6	-57.3	-172.3	-169.2	174.8	3.9	113	A422 D502 Y503	A422-R424 PolarHBondContact O-N 3.27Å; R424-D502 PolarHBondContact NH2-O 3.03Å; R424-Y503 HydrophobicContact CG-CD1 3.71Å; R424-Y503 HydrophobicContact CG-CE1 4.14Å; R424-Y503 HydrophobicContact CG-CG 4.08Å
425	V	64.9	Low	80	Confident	81 Å²	81	58.9 Å²	58.9	49%	0.491	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.3	-178.5	-178.1	0	0	0	0	109.5	A422	A422-V425 PolarHBondContact N-O 2.98Å; A422-V425 PolarHBondContact O-N 2.99Å
426	R	72.4	Confident	79.5	Confident	151 Å²	151	65.6 Å²	65.6	57%	0.57	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.4	165.3	-68.7	-171.7	-176	168.9	3.4	109.4	M419 F420 S461	M419-R426 HydrophobicContact CG-CB 4.26Å; M419-R426 HydrophobicContact SD-CB 3.79Å; F420-R426 WeakPolarHBondContact O-CA 2.9Å; R426-S461 PolarHBondContact NH1-OG 3.5Å
427	M	78.8	Confident	79.1	Confident	58 Å²	58	61.2 Å²	61.2	29%	0.286	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	136.2	-179.5	47.2	174.5	-107.2	0	0	111.9	T387 F420 A422 K429	T387-M427 HydrophobicContact CG2-CE 3.51Å; F420-M427 PolarHBondContact N-O 2.68Å; F420-M427 PolarHBondContact O-N 3.07Å; A422-M427 HydrophobicContact CB-CG 4.03Å; A422-M427 HydrophobicContact CB-SD 3.49Å; A422-M427 WeakPolarHBondContact CB-SD 3.44Å; M427-K429 HydrophobicContact CE-CG 4.27Å
428	W	84.2	Confident	78.5	Confident	111 Å²	111	65.5 Å²	65.5	42%	0.42	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	126.3	171.7	-67.4	107.1	0	0	0	110.8	A417 L418 M419 Y430	A417-W428 HydrophobicContact CB-CE3 3.98Å; A417-W428 HydrophobicContact CB-CZ3 4.09Å; L418-W428 WeakPolarHBondContact O-CA 2.94Å; M419-W428 HydrophobicContact CB-CE3 4.32Å; M419-W428 HydrophobicContact CB-CZ3 4.33Å; M419-W428 HydrophobicContact CE-CD2 3.88Å; M419-W428 HydrophobicContact CE-CE3 4.47Å; M419-W428 HydrophobicContact CE-CG 4.38Å; M419-W428 HydrophobicContact CE-CH2 4.16Å; M419-W428 HydrophobicContact CE-CZ2 3.49Å; M419-W428 VanDerWaalsContact CE-CZ2 3.49Å; M419-W428 HydrophobicContact SD-CD2 4.19Å; M419-W428 HydrophobicContact SD-CG 4.33Å; W428-Y430 HydrophobicContact CB-CE2 4.09Å
429	K	87.5	Confident	78.1	Confident	44 Å²	44	64.7 Å²	64.7	19%	0.191	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	147.3	157.7	-80.3	-173.8	161	-159.3	0	108.8	E384 G385 I386 T387 L418 F420 M427 Y431	E384-K429 WeakPolarHBondContact O-CD 3.15Å; E384-K429 PolarHBondContact O-NZ 3.33Å; G385-K429 VanDerWaalsContact O-CD 3.26Å; G385-K429 WeakPolarHBondContact O-CD 3.49Å; G385-K429 WeakPolarHBondContact O-CE 3.35Å; G385-K429 PolarHBondContact O-NZ 3.46Å; I386-K429 CarbonylContact O-C 3.55Å; I386-K429 WeakPolarHBondContact O-CA 3.26Å; T387-K429 HydrophobicContact CG2-CG 4.19Å; L418-K429 PolarHBondContact N-O 2.84Å; L418-K429 PolarHBondContact O-N 2.75Å; F420-K429 HydrophobicContact CD2-CB 4.06Å; F420-K429 HydrophobicContact CD2-CD 4.17Å; F420-K429 HydrophobicContact CD2-CG 4.31Å; F420-K429 HydrophobicContact CE2-CB 4.32Å; F420-K429 HydrophobicContact CE2-CD 4.48Å; M427-K429 HydrophobicContact CE-CG 4.27Å; K429-Y431 HydrophobicContact CB-CD2 4.38Å; K429-Y431 HydrophobicContact CB-CE2 3.47Å; K429-Y431 VanDerWaalsContact CB-CE2 3.47Å; K429-Y431 VanDerWaalsContact CD-OH 3.24Å; K429-Y431 WeakPolarHBondContact CD-OH 3.46Å
430	Y	89.2	Confident	77.8	Confident	10 Å²	10	64.7 Å²	64.7	4%	0.039	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.8	178.5	-60.3	-86	0	0	0	108.6	G385 I386 L388 I391 L406 V415 A417 W428	G385-Y430 CarbonylContact C-O 3.37Å; G385-Y430 WeakPolarHBondContact CA-O 3.05Å; I386-Y430 PolarHBondContact N-O 2.69Å; I386-Y430 PolarHBondContact O-N 2.8Å; L388-Y430 HydrophobicContact CB-CE2 4.15Å; I391-Y430 HydrophobicContact CD1-CD2 4.02Å; L406-Y430 HydrophobicContact CB-CD1 4.28Å; L406-Y430 HydrophobicContact CB-CE1 3.76Å; L406-Y430 HydrophobicContact CD1-CD2 4.24Å; L406-Y430 HydrophobicContact CD1-CE1 4.4Å; L406-Y430 HydrophobicContact CD1-CE2 3.93Å; L406-Y430 HydrophobicContact CD2-CD1 4Å; L406-Y430 HydrophobicContact CD2-CD2 4.45Å; L406-Y430 HydrophobicContact CD2-CE1 4.31Å; L406-Y430 HydrophobicContact CD2-CG 4.06Å; L406-Y430 HydrophobicContact CG-CE1 4.37Å; V415-Y430 HydrophobicContact CG1-CD1 3.71Å; V415-Y430 HydrophobicContact CG1-CG 4.18Å; A417-Y430 HydrophobicContact CB-CD1 3.76Å; A417-Y430 HydrophobicContact CB-CE1 3.78Å; W428-Y430 HydrophobicContact CB-CE2 4.09Å
431	Y	89.1	Confident	77.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	156.6	-172.6	-64	-97.1	0	0	0	110.6	V378 N383 E384 K416 L418 F420 K429 P437	V378-Y431 WeakPolarHBondContact CG1-O 3.3Å; N383-Y431 WeakPolarHBondContact O-CE1 3.44Å; E384-Y431 VanDerWaalsContact C-CE1 3.45Å; E384-Y431 WeakPolarHBondContact O-CE1 2.98Å; E384-Y431 PolarHBondContact O-OH 3.04Å; K416-Y431 PolarHBondContact N-O 2.89Å; K416-Y431 PolarHBondContact O-N 3.48Å; L418-Y431 HydrophobicContact CB-CD2 4.38Å; L418-Y431 HydrophobicContact CB-CE2 4.04Å; L418-Y431 HydrophobicContact CD1-CD2 4.26Å; L418-Y431 HydrophobicContact CD1-CE2 4.25Å; F420-Y431 AromaticContact CE2-CE2 3.76Å; F420-Y431 HydrophobicContact CE2-CE2 3.76Å; F420-Y431 AromaticContact CE2-CZ 3.79Å; F420-Y431 WeakPolarHBondContact CE2-OH 2.99Å; F420-Y431 HydrophobicContact CZ-CE2 4.44Å; F420-Y431 VanDerWaalsContact CZ-OH 3.28Å; F420-Y431 WeakPolarHBondContact CZ-OH 3.29Å; K429-Y431 HydrophobicContact CB-CD2 4.38Å; K429-Y431 HydrophobicContact CB-CE2 3.47Å; K429-Y431 VanDerWaalsContact CB-CE2 3.47Å; K429-Y431 VanDerWaalsContact CD-OH 3.24Å; K429-Y431 WeakPolarHBondContact CD-OH 3.46Å; Y431-P437 HydrophobicContact CD1-CB 4.15Å; Y431-P437 HydrophobicContact CE1-CB 3.67Å; Y431-P437 HydrophobicContact CE2-CB 4.49Å
432	D	86.6	Confident	78.4	Confident	32 Å²	32	70.9 Å²	70.9	17%	0.171	35%	0.353	C	S	.	.			trans	-56.5	136.1	158.6	-166.6	-51.8	0	0	0	108.4	N379 K434 A435	N379-D432 HydrophobicContact CB-CB 4.32Å; N379-D432 WeakPolarHBondContact CB-OD2 3.32Å; N379-D432 PolarHBondContact ND2-OD2 2.65Å; D432-K434 PolarHBondContact O-N 3.18Å; D432-K434 VanDerWaalsContact O-N 3.1Å; D432-K434 WeakPolarHBondContact OD1-CB 3.24Å; D432-K434 PolarHBondContact OD1-N 3.27Å; D432-A435 HydrophobicContact CB-CB 3.92Å; D432-A435 WeakPolarHBondContact O-CB 3.19Å; D432-A435 PolarHBondContact O-N 3.34Å
433	P	84.1	Confident	79	Confident	54 Å²	54	69.4 Å²	69.4	35%	0.351	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-27.3	171.8	-27.6	35.4	0	0	0	114.5	G413 Y414	G413-P433 WeakPolarHBondContact O-CG 2.97Å; Y414-P433 VanDerWaalsContact O-CD 3.29Å; Y414-P433 WeakPolarHBondContact O-CD 3.45Å
434	K	82.5	Confident	79.7	Confident	192 Å²	192	72.4 Å²	72.4	84%	0.835	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-8.7	177.1	-57.9	-175.9	178	-173.3	0	114.7	D432	D432-K434 PolarHBondContact O-N 3.18Å; D432-K434 VanDerWaalsContact O-N 3.1Å; D432-K434 WeakPolarHBondContact OD1-CB 3.24Å; D432-K434 PolarHBondContact OD1-N 3.27Å
435	A	80.1	Confident	80.7	Confident	10 Å²	10	67.6 Å²	67.6	8%	0.083	33%	0.332	C	S	.	.			trans	-80.2	139.6	-179	0	0	0	0	0	111.5	D432 P437	D432-A435 HydrophobicContact CB-CB 3.92Å; D432-A435 WeakPolarHBondContact O-CB 3.19Å; D432-A435 PolarHBondContact O-N 3.34Å; A435-P437 WeakPolarHBondContact O-CD 3.13Å
436	E	78.2	Confident	81.7	Confident	146 Å²	146	63.8 Å²	63.8	68%	0.682	31%	0.309	S	S	*	.			trans	-91.8	104	173.8	-69.8	-176.3	162.8	0	0	109.2	N383	N383-E436 WeakPolarHBondContact CB-O 3.41Å; N383-E436 PolarHBondContact ND2-O 3.08Å; N383-E436 PolarHBondContact OD1-N 3.32Å
437	P	76.5	Confident	82.4	Confident	7 Å²	7	62.5 Å²	62.5	5%	0.045	31%	0.305	C	S	.	.			trans	-67.4	149.4	177	29.8	-36.9	0	0	0	110.2	L418 F420 Y431 A435 S439 A440	L418-P437 HydrophobicContact CD1-CB 4.08Å; L418-P437 HydrophobicContact CD1-CG 3.62Å; F420-P437 HydrophobicContact CZ-CB 4.39Å; Y431-P437 HydrophobicContact CD1-CB 4.15Å; Y431-P437 HydrophobicContact CE1-CB 3.67Å; Y431-P437 HydrophobicContact CE2-CB 4.49Å; A435-P437 WeakPolarHBondContact O-CD 3.13Å; P437-S439 PolarHBondContact O-N 3.4Å; P437-A440 HydrophobicContact CG-CB 4.12Å; P437-A440 VanDerWaalsContact O-CB 3.32Å; P437-A440 WeakPolarHBondContact O-CB 3.5Å; P437-A440 PolarHBondContact O-N 3.02Å
438	P	74.4	Confident	82.8	Confident	107 Å²	107	68.2 Å²	68.2	70%	0.695	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	19.2	178	30.1	-39	0	0	0	114.6	N383	N383-P438 WeakPolarHBondContact O-CD 3.33Å
439	S	74.8	Confident	82.9	Confident	3 Å²	3	67.4 Å²	67.4	2%	0.021	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	5.2	167.6	61.4	0	0	0	0	113.2	F420 P437 L442 Y443	F420-S439 VanDerWaalsContact CE1-OG 3.3Å; F420-S439 WeakPolarHBondContact CE1-OG 3.19Å; F420-S439 WeakPolarHBondContact CZ-OG 3.28Å; P437-S439 PolarHBondContact O-N 3.4Å; S439-L442 PolarHBondContact O-N 3.39Å; S439-Y443 WeakPolarHBondContact O-CD2 3.38Å; S439-Y443 VanDerWaalsContact O-CG 3.26Å; S439-Y443 PolarHBondContact O-N 3.01Å; S439-Y443 WeakPolarHBondContact OG-CE2 3.42Å; S439-Y443 PolarHBondContact OG-OH 2.89Å
440	A	74.5	Confident	82.8	Confident	24 Å²	24	66 Å²	66	20%	0.198	32%	0.322	C	S	.	.	H	α-helix	trans	-56.7	-55.4	173.3	0	0	0	0	0	110.3	P437 L442 Y443 D444	P437-A440 HydrophobicContact CG-CB 4.12Å; P437-A440 VanDerWaalsContact O-CB 3.32Å; P437-A440 WeakPolarHBondContact O-CB 3.5Å; P437-A440 PolarHBondContact O-N 3.02Å; A440-L442 PolarHBondContact O-N 3.1Å; A440-L442 VanDerWaalsContact O-N 3.14Å; A440-Y443 CarbonylContact O-C 3.55Å; A440-Y443 WeakPolarHBondContact O-CA 3.49Å; A440-Y443 PolarHBondContact O-N 3.29Å; A440-D444 PolarHBondContact O-N 3.07Å
441	E	80	Confident	82.6	Confident	144 Å²	144	70.2 Å²	70.2	67%	0.673	35%	0.354	S	S	*	.	H	α-helix	trans	-50.4	-41.8	174.8	-64.1	179.3	-170.3	0	0	113.1	D444 Q445	E441-D444 PolarHBondContact O-N 2.95Å; E441-Q445 VanDerWaalsContact O-CB 3.24Å; E441-Q445 WeakPolarHBondContact O-CB 3.38Å; E441-Q445 WeakPolarHBondContact O-CG 3.42Å; E441-Q445 PolarHBondContact O-N 3.42Å
442	L	83.2	Confident	82.3	Confident	42 Å²	42	71.3 Å²	71.3	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-66.9	-39.4	178.9	-76	168.6	0	0	0	112	S439 A440 L446 C467 K468 M471	S439-L442 PolarHBondContact O-N 3.39Å; A440-L442 PolarHBondContact O-N 3.1Å; A440-L442 VanDerWaalsContact O-N 3.14Å; L442-L446 PolarHBondContact O-N 2.8Å; L442-C467 PolarHBondContact O-SG 3.17Å; L442-K468 HydrophobicContact CD2-CG 4.41Å; L442-M471 HydrophobicContact CD2-CE 4.02Å
443	Y	83.9	Confident	82.2	Confident	22 Å²	22	73 Å²	73	9%	0.086	37%	0.369	C	S	.	.	H	α-helix	trans	-71.5	-38.6	176.2	-57.4	-35.4	0	0	0	111.2	L418 S439 A440 L446 Y447 L462 D464 C467	L418-Y443 HydrophobicContact CD2-CE2 4.49Å; S439-Y443 WeakPolarHBondContact O-CD2 3.38Å; S439-Y443 VanDerWaalsContact O-CG 3.26Å; S439-Y443 PolarHBondContact O-N 3.01Å; S439-Y443 WeakPolarHBondContact OG-CE2 3.42Å; S439-Y443 PolarHBondContact OG-OH 2.89Å; A440-Y443 CarbonylContact O-C 3.55Å; A440-Y443 WeakPolarHBondContact O-CA 3.49Å; A440-Y443 PolarHBondContact O-N 3.29Å; Y443-L446 PolarHBondContact O-N 3.47Å; Y443-Y447 WeakPolarHBondContact O-CB 3.23Å; Y443-Y447 PolarHBondContact O-N 2.87Å; Y443-L462 HydrophobicContact CD1-CD2 3.53Å; Y443-L462 HydrophobicContact CD1-CG 4.14Å; Y443-L462 HydrophobicContact CE1-CD2 3.82Å; Y443-L462 HydrophobicContact CE1-CG 3.94Å; Y443-L462 HydrophobicContact CG-CD2 4.18Å; Y443-D464 PolarHBondContact OH-N 2.9Å; Y443-C467 HydrophobicContact CD1-CB 3.99Å; Y443-C467 HydrophobicContact CE1-CB 4.02Å
444	D	83.2	Confident	82.1	Confident	89 Å²	89	70.5 Å²	70.5	48%	0.476	35%	0.352	S	S	.	.	H	α-helix	trans	-70.1	-35.5	177	-65.1	-18.8	0	0	0	112.1	A440 E441 Y447 K448	A440-D444 PolarHBondContact O-N 3.07Å; E441-D444 PolarHBondContact O-N 2.95Å; D444-Y447 PolarHBondContact O-N 2.83Å; D444-K448 VanDerWaalsContact O-CB 3.29Å; D444-K448 WeakPolarHBondContact O-CB 3.49Å; D444-K448 WeakPolarHBondContact O-CG 3.1Å; D444-K448 PolarHBondContact O-N 2.73Å
445	Q	86.2	Confident	81.7	Confident	92 Å²	92	65 Å²	65	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-62.4	-45.4	170.6	-77.2	164.8	22.6	0	0	111	E441 K449 M471	E441-Q445 VanDerWaalsContact O-CB 3.24Å; E441-Q445 WeakPolarHBondContact O-CB 3.38Å; E441-Q445 WeakPolarHBondContact O-CG 3.42Å; E441-Q445 PolarHBondContact O-N 3.42Å; Q445-K449 WeakPolarHBondContact O-CB 3.03Å; Q445-K449 PolarHBondContact O-N 2.93Å; Q445-M471 HydrophobicContact CB-SD 4.06Å
446	L	86.4	Confident	81.4	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-63.9	-42.4	174.9	176.6	64.7	0	0	0	111.4	L442 Y443 K449 T450 F454 L462 C467 L470 M471 I474	L442-L446 PolarHBondContact O-N 2.8Å; Y443-L446 PolarHBondContact O-N 3.47Å; L446-K449 PolarHBondContact O-N 3.35Å; L446-T450 HydrophobicContact CD1-CG2 3.82Å; L446-T450 WeakPolarHBondContact O-CB 3.43Å; L446-T450 WeakPolarHBondContact O-CG2 3.31Å; L446-T450 PolarHBondContact O-N 2.6Å; L446-T450 VanDerWaalsContact O-N 3.1Å; L446-T450 PolarHBondContact O-OG1 2.98Å; L446-F454 HydrophobicContact CD1-CD2 4.37Å; L446-F454 HydrophobicContact CD1-CE2 3.92Å; L446-F454 HydrophobicContact CD2-CB 4.44Å; L446-F454 HydrophobicContact CD2-CD2 3.52Å; L446-F454 HydrophobicContact CD2-CE2 3.91Å; L446-F454 HydrophobicContact CD2-CG 4.06Å; L446-F454 HydrophobicContact CG-CD2 3.84Å; L446-F454 HydrophobicContact CG-CE2 3.87Å; L446-L462 HydrophobicContact CD2-CD1 4.2Å; L446-C467 WeakPolarHBondContact CB-SG 3.41Å; L446-C467 WeakPolarHBondContact CD2-SG 3.48Å; L446-L470 HydrophobicContact CD1-CB 3.95Å; L446-L470 HydrophobicContact CD2-CB 4.29Å; L446-L470 HydrophobicContact CD2-CD1 3.75Å; L446-M471 HydrophobicContact CB-CG 4.23Å; L446-M471 HydrophobicContact CB-SD 4.25Å; L446-M471 HydrophobicContact CD1-CG 3.82Å; L446-I474 HydrophobicContact CD1-CD1 4.45Å
447	Y	86.8	Confident	81.2	Confident	124 Å²	124	62.8 Å²	62.8	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-52.4	176.8	-175.1	-102.6	0	0	0	111.2	Y443 D444 K449 T450 S451 D453	Y443-Y447 WeakPolarHBondContact O-CB 3.23Å; Y443-Y447 PolarHBondContact O-N 2.87Å; D444-Y447 PolarHBondContact O-N 2.83Å; Y447-K449 PolarHBondContact O-N 2.82Å; Y447-T450 PolarHBondContact O-N 2.83Å; Y447-T450 VanDerWaalsContact O-N 3.08Å; Y447-S451 WeakPolarHBondContact O-CA 3.24Å; Y447-S451 PolarHBondContact O-N 3.43Å; Y447-D453 HydrophobicContact CD2-CB 4.43Å; Y447-D453 HydrophobicContact CE2-CB 4.4Å
448	K	87.6	Confident	80.7	Confident	178 Å²	178	67.7 Å²	67.7	77%	0.774	36%	0.362	S	S	*	.	H	α-helix	trans	-56.2	-35.1	175.1	-73.2	169.3	-179	176	0	112.7	D444	D444-K448 VanDerWaalsContact O-CB 3.29Å; D444-K448 WeakPolarHBondContact O-CB 3.49Å; D444-K448 WeakPolarHBondContact O-CG 3.1Å; D444-K448 PolarHBondContact O-N 2.73Å
449	K	86.3	Confident	80.3	Confident	94 Å²	94	71 Å²	71	41%	0.409	37%	0.374	S	S	.	.	H	α-helix	trans	-81	-11.5	-179.9	-169.2	164	-172.3	167.9	0	114.6	Q445 L446 Y447 D475	Q445-K449 WeakPolarHBondContact O-CB 3.03Å; Q445-K449 PolarHBondContact O-N 2.93Å; L446-K449 PolarHBondContact O-N 3.35Å; Y447-K449 PolarHBondContact O-N 2.82Å; K449-D475 WeakPolarHBondContact CE-OD1 3.46Å; K449-D475 IonicContact NZ-OD1 3.46Å; K449-D475 PolarHBondContact NZ-OD1 3.13Å; K449-D475 IonicContact NZ-OD2 2.62Å; K449-D475 PolarHBondContact NZ-OD2 2.7Å
450	T	85.6	Confident	80.4	Confident	14 Å²	14	72.2 Å²	72.2	9%	0.086	38%	0.379	C	S	.	.	H	α-helix	trans	-135.2	-18.5	-172.6	60.1	0	0	0	0	115.6	L446 Y447 V452 F454 I474 L522	L446-T450 HydrophobicContact CD1-CG2 3.82Å; L446-T450 WeakPolarHBondContact O-CB 3.43Å; L446-T450 WeakPolarHBondContact O-CG2 3.31Å; L446-T450 PolarHBondContact O-N 2.6Å; L446-T450 VanDerWaalsContact O-N 3.1Å; L446-T450 PolarHBondContact O-OG1 2.98Å; Y447-T450 PolarHBondContact O-N 2.83Å; Y447-T450 VanDerWaalsContact O-N 3.08Å; T450-V452 PolarHBondContact O-N 2.73Å; T450-V452 PolarHBondContact OG1-N 2.89Å; T450-F454 HydrophobicContact CG2-CE2 4.1Å; T450-F454 HydrophobicContact CG2-CZ 4.48Å; T450-I474 HydrophobicContact CG2-CD1 3.56Å; T450-L522 HydrophobicContact CG2-CD1 3.78Å; T450-L522 HydrophobicContact CG2-CD2 4.35Å
451	S	84.6	Confident	80.3	Confident	99 Å²	99	73 Å²	73	69%	0.692	38%	0.383	S	S	*	.	S	Bend	trans	55.8	25	-166.5	-54.3	0	0	0	0	114.8	Y447	Y447-S451 WeakPolarHBondContact O-CA 3.24Å; Y447-S451 PolarHBondContact O-N 3.43Å
452	V	83.4	Confident	80.3	Confident	22 Å²	22	66.6 Å²	66.6	13%	0.133	35%	0.354	C	S	.	.			trans	-124.5	123.4	-176.7	173.6	0	0	0	0	111.1	T450 F454 Q520	T450-V452 PolarHBondContact O-N 2.73Å; T450-V452 PolarHBondContact OG1-N 2.89Å; V452-F454 HydrophobicContact CB-CD2 4.24Å; V452-F454 HydrophobicContact CB-CE2 3.87Å; V452-F454 HydrophobicContact CB-CZ 4.4Å; V452-F454 HydrophobicContact CG1-CD2 3.95Å; V452-F454 HydrophobicContact CG1-CE2 3.87Å; V452-F454 HydrophobicContact CG1-CG 4.33Å; V452-F454 HydrophobicContact CG1-CZ 4.17Å; V452-F454 VanDerWaalsContact O-CD2 3.27Å; V452-F454 WeakPolarHBondContact O-CD2 3.43Å; V452-F454 PolarHBondContact O-N 2.74Å; V452-Q520 HydrophobicContact CG1-CB 4.5Å; V452-Q520 HydrophobicContact CG1-CG 4.02Å; V452-Q520 HydrophobicContact CG2-CB 4.29Å
453	D	83.6	Confident	80.3	Confident	67 Å²	67	64.8 Å²	64.8	36%	0.358	34%	0.344	S	S	.	.			trans	-79	99.4	167	174.5	37.9	0	0	0	111.2	Y447 N455 S456	Y447-D453 HydrophobicContact CD2-CB 4.43Å; Y447-D453 HydrophobicContact CE2-CB 4.4Å; D453-N455 PolarHBondContact O-N 2.78Å; D453-N455 VanDerWaalsContact OD1-CB 3.27Å; D453-N455 WeakPolarHBondContact OD1-CB 3.23Å; D453-N455 PolarHBondContact OD1-N 2.67Å; D453-N455 PolarHBondContact OD1-ND2 3.2Å; D453-S456 PolarHBondContact O-N 2.76Å; D453-S456 PolarHBondContact O-OG 3.18Å; D453-S456 VanDerWaalsContact OD2-CB 3.31Å; D453-S456 WeakPolarHBondContact OD2-CB 3.46Å; D453-S456 PolarHBondContact OD2-N 2.88Å
454	F	82.4	Confident	80.2	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.009	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.5	175.6	-70.9	-96.2	0	0	0	114	L446 T450 V452 L457 F460 L462 L470 T516 L517 L522	L446-F454 HydrophobicContact CD1-CD2 4.37Å; L446-F454 HydrophobicContact CD1-CE2 3.92Å; L446-F454 HydrophobicContact CD2-CB 4.44Å; L446-F454 HydrophobicContact CD2-CD2 3.52Å; L446-F454 HydrophobicContact CD2-CE2 3.91Å; L446-F454 HydrophobicContact CD2-CG 4.06Å; L446-F454 HydrophobicContact CG-CD2 3.84Å; L446-F454 HydrophobicContact CG-CE2 3.87Å; T450-F454 HydrophobicContact CG2-CE2 4.1Å; T450-F454 HydrophobicContact CG2-CZ 4.48Å; V452-F454 HydrophobicContact CB-CD2 4.24Å; V452-F454 HydrophobicContact CB-CE2 3.87Å; V452-F454 HydrophobicContact CB-CZ 4.4Å; V452-F454 HydrophobicContact CG1-CD2 3.95Å; V452-F454 HydrophobicContact CG1-CE2 3.87Å; V452-F454 HydrophobicContact CG1-CG 4.33Å; V452-F454 HydrophobicContact CG1-CZ 4.17Å; V452-F454 VanDerWaalsContact O-CD2 3.27Å; V452-F454 WeakPolarHBondContact O-CD2 3.43Å; V452-F454 PolarHBondContact O-N 2.74Å; F454-L457 HydrophobicContact CB-CD1 4.32Å; F454-L457 HydrophobicContact CD1-CD1 3.64Å; F454-L457 HydrophobicContact CE1-CD1 4.32Å; F454-L457 HydrophobicContact CG-CD1 4.2Å; F454-F460 HydrophobicContact CB-CE1 4.3Å; F454-F460 HydrophobicContact CD1-CE1 4.25Å; F454-L462 HydrophobicContact CB-CD1 4.02Å; F454-L462 HydrophobicContact CB-CD2 4.05Å; F454-L462 HydrophobicContact CB-CG 4.44Å; F454-L470 HydrophobicContact CD1-CD1 3.64Å; F454-L470 HydrophobicContact CD2-CD1 4.48Å; F454-L470 HydrophobicContact CE1-CD1 3.76Å; F454-L470 HydrophobicContact CE1-CD2 4.19Å; F454-L470 HydrophobicContact CG-CD1 4.03Å; F454-L470 HydrophobicContact CZ-CD1 4.24Å; F454-T516 HydrophobicContact CD1-CG2 3.91Å; F454-T516 HydrophobicContact CE1-CG2 3.86Å; F454-L517 HydrophobicContact CE1-CD2 4.41Å; F454-L517 HydrophobicContact CZ-CD2 4.12Å; F454-L522 HydrophobicContact CZ-CD1 3.84Å
455	N	74.4	Confident	80.3	Confident	76 Å²	76	62.3 Å²	62.3	41%	0.406	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-33.6	174.5	-57.8	-80	0	0	0	112.3	D453 L457 L462	D453-N455 PolarHBondContact O-N 2.78Å; D453-N455 VanDerWaalsContact OD1-CB 3.27Å; D453-N455 WeakPolarHBondContact OD1-CB 3.23Å; D453-N455 PolarHBondContact OD1-N 2.67Å; D453-N455 PolarHBondContact OD1-ND2 3.2Å; N455-L457 PolarHBondContact O-N 2.84Å; N455-L462 WeakPolarHBondContact OD1-CD2 3Å
456	S	73.3	Confident	80.3	Confident	84 Å²	84	58.3 Å²	58.3	59%	0.587	31%	0.313	S	S	*	.	S	Bend	trans	-64.7	-19.8	175.9	71.7	0	0	0	0	114.4	D453	D453-S456 PolarHBondContact O-N 2.76Å; D453-S456 PolarHBondContact O-OG 3.18Å; D453-S456 VanDerWaalsContact OD2-CB 3.31Å; D453-S456 WeakPolarHBondContact OD2-CB 3.46Å; D453-S456 PolarHBondContact OD2-N 2.88Å
457	L	75.2	Confident	80.3	Confident	26 Å²	26	58.2 Å²	58.2	14%	0.136	31%	0.312	C	S	.	.	S	Bend	trans	-71.6	119.6	-165.9	-66.9	179.3	0	0	0	113.1	F454 N455 N459 F460 T516 Q520	F454-L457 HydrophobicContact CB-CD1 4.32Å; F454-L457 HydrophobicContact CD1-CD1 3.64Å; F454-L457 HydrophobicContact CE1-CD1 4.32Å; F454-L457 HydrophobicContact CG-CD1 4.2Å; N455-L457 PolarHBondContact O-N 2.84Å; L457-N459 PolarHBondContact O-N 3.15Å; L457-F460 HydrophobicContact CB-CB 3.96Å; L457-F460 PolarHBondContact O-N 2.85Å; L457-F460 VanDerWaalsContact O-N 3.07Å; L457-T516 HydrophobicContact CD1-CG2 3.7Å; L457-Q520 HydrophobicContact CD1-CG 4.26Å
458	P	65.9	Low	80.4	Confident	110 Å²	110	56.3 Å²	56.3	71%	0.714	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	133.6	-177.1	24.6	-33.7	0	0	0	111.9	F460	P458-F460 PolarHBondContact O-N 3.11Å
459	N	65.9	Low	80.5	Confident	178 Å²	178	49.5 Å²	49.5	95%	0.952	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	0.4	-174.5	-50.3	-68.4	0	0	0	116.3	L457	L457-N459 PolarHBondContact O-N 3.15Å
460	F	75.2	Confident	80.7	Confident	27 Å²	27	45 Å²	45	12%	0.118	26%	0.256	C	S	.	.			trans	-105.1	99.3	175.2	-171.3	-93.8	0	0	0	111.1	F454 L457 P458 L462 L470 T512 L513 T516	F454-F460 HydrophobicContact CB-CE1 4.3Å; F454-F460 HydrophobicContact CD1-CE1 4.25Å; L457-F460 HydrophobicContact CB-CB 3.96Å; L457-F460 PolarHBondContact O-N 2.85Å; L457-F460 VanDerWaalsContact O-N 3.07Å; P458-F460 PolarHBondContact O-N 3.11Å; F460-L462 HydrophobicContact CD1-CB 4.47Å; F460-L462 HydrophobicContact CE1-CB 4.21Å; F460-L462 HydrophobicContact CE1-CD1 3.92Å; F460-L462 PolarHBondContact O-N 2.65Å; F460-L470 HydrophobicContact CE1-CD1 4.23Å; F460-L470 HydrophobicContact CZ-CD1 4.02Å; F460-T512 HydrophobicContact CD2-CG2 4.35Å; F460-T512 HydrophobicContact CE2-CG2 4.41Å; F460-L513 HydrophobicContact CE2-CD2 4.05Å; F460-L513 HydrophobicContact CZ-CD2 3.95Å; F460-T516 HydrophobicContact CD2-CG2 4.03Å; F460-T516 WeakPolarHBondContact CD2-OG1 3.33Å; F460-T516 HydrophobicContact CE2-CG2 4.13Å; F460-T516 WeakPolarHBondContact CE2-OG1 3.21Å; F460-T516 HydrophobicContact CG-CG2 4.26Å; F460-T516 HydrophobicContact CZ-CG2 4.45Å
461	S	72.2	Confident	81	Confident	42 Å²	42	45.4 Å²	45.4	29%	0.294	26%	0.258	S	S	.	.			trans	-79.4	99.6	171.7	68.7	0	0	0	0	109.9	R426	R426-S461 PolarHBondContact NH1-OG 3.5Å
462	L	81.7	Confident	81.3	Confident	9 Å²	9	41.3 Å²	41.3	5%	0.047	23%	0.229	C	C	.	.			trans	-58.9	144.3	169	-171.6	68.3	0	0	0	110	Y443 L446 F454 N455 F460 C467 L470	Y443-L462 HydrophobicContact CD1-CD2 3.53Å; Y443-L462 HydrophobicContact CD1-CG 4.14Å; Y443-L462 HydrophobicContact CE1-CD2 3.82Å; Y443-L462 HydrophobicContact CE1-CG 3.94Å; Y443-L462 HydrophobicContact CG-CD2 4.18Å; L446-L462 HydrophobicContact CD2-CD1 4.2Å; F454-L462 HydrophobicContact CB-CD1 4.02Å; F454-L462 HydrophobicContact CB-CD2 4.05Å; F454-L462 HydrophobicContact CB-CG 4.44Å; N455-L462 WeakPolarHBondContact OD1-CD2 3Å; F460-L462 HydrophobicContact CD1-CB 4.47Å; F460-L462 HydrophobicContact CE1-CB 4.21Å; F460-L462 HydrophobicContact CE1-CD1 3.92Å; F460-L462 PolarHBondContact O-N 2.65Å; L462-C467 HydrophobicContact CD1-CB 4.29Å; L462-L470 HydrophobicContact CD1-CD1 4.09Å
463	T	83	Confident	81.6	Confident	4 Å²	4	40.2 Å²	40.2	3%	0.025	22%	0.223	C	C	.	.			trans	-146.4	149.8	174.6	78.1	0	0	0	0	109.1	M419 T421 R465 S466 C467	M419-T463 HydrophobicContact CB-CG2 4.06Å; M419-T463 HydrophobicContact CG-CG2 3.61Å; M419-T463 WeakPolarHBondContact O-CA 3.33Å; M419-T463 WeakPolarHBondContact O-CB 3.29Å; T421-T463 PolarHBondContact OG1-OG1 2.98Å; T463-R465 VanDerWaalsContact C-N 3.26Å; T463-R465 PolarHBondContact O-N 2.87Å; T463-S466 PolarHBondContact N-OG 3.4Å; T463-S466 CarbonylContact O-C 3.48Å; T463-S466 WeakPolarHBondContact O-CA 3.42Å; T463-S466 PolarHBondContact O-N 2.81Å; T463-S466 PolarHBondContact O-OG 3.42Å; T463-S466 PolarHBondContact OG1-N 3.4Å; T463-S466 PolarHBondContact OG1-OG 2.78Å; T463-C467 PolarHBondContact O-N 2.99Å
464	D	81.8	Confident	81.9	Confident	33 Å²	33	37.8 Å²	37.8	18%	0.176	21%	0.21	C	C	.	.	H	α-helix	trans	-12.3	-65.6	159.3	51.4	9	0	0	0	115.6	F420 T421 Y443 C467 K468	F420-D464 HydrophobicContact CD1-CB 4.27Å; T421-D464 VanDerWaalsContact CB-OD1 3.24Å; T421-D464 WeakPolarHBondContact CB-OD1 3.17Å; T421-D464 PolarHBondContact N-OD1 3.03Å; T421-D464 PolarHBondContact N-OD2 3.48Å; T421-D464 PolarHBondContact OG1-OD1 3.1Å; Y443-D464 PolarHBondContact OH-N 2.9Å; D464-C467 VanDerWaalsContact O-CB 3.27Å; D464-C467 WeakPolarHBondContact O-CB 3.44Å; D464-C467 PolarHBondContact O-N 2.94Å; D464-K468 PolarHBondContact O-N 3.45Å
465	R	84.5	Confident	82.4	Confident	25 Å²	25	40.6 Å²	40.6	9%	0.094	23%	0.225	C	C	.	.	H	α-helix	trans	-78.7	-30.7	-174.3	-176.2	175.7	170	-165.1	4	113.5	T463 C467 R469 E496	T463-R465 VanDerWaalsContact C-N 3.26Å; T463-R465 PolarHBondContact O-N 2.87Å; R465-C467 VanDerWaalsContact C-N 3.29Å; R465-R469 WeakPolarHBondContact O-CB 3.26Å; R465-R469 WeakPolarHBondContact O-CD 3.31Å; R465-R469 WeakPolarHBondContact O-CG 3.4Å; R465-R469 PolarHBondContact O-N 3.27Å; R465-R469 VanDerWaalsContact O-N 3.14Å; R465-E496 IonicContact CZ-OE1 2.68Å; R465-E496 VanDerWaalsContact CZ-OE1 3.27Å; R465-E496 IonicContact CZ-OE2 3.87Å; R465-E496 IonicContact NE-OE1 3.25Å; R465-E496 PolarHBondContact NE-OE1 3.46Å; R465-E496 IonicContact NE-OE2 3.12Å; R465-E496 IonicContact NH2-OE1 3.67Å; R465-E496 PolarHBondContact NH2-OE1 3.26Å; R465-E496 IonicContact NH2-OE2 2.67Å; R465-E496 PolarHBondContact NH2-OE2 3.18Å
466	S	87	Confident	83.2	Confident	9 Å²	9	37.2 Å²	37.2	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-70.3	-29.8	169.7	61	0	0	0	0	111.8	T463 R469 L470	T463-S466 PolarHBondContact N-OG 3.4Å; T463-S466 CarbonylContact O-C 3.48Å; T463-S466 WeakPolarHBondContact O-CA 3.42Å; T463-S466 PolarHBondContact O-N 2.81Å; T463-S466 PolarHBondContact O-OG 3.42Å; T463-S466 PolarHBondContact OG1-N 3.4Å; T463-S466 PolarHBondContact OG1-OG 2.78Å; S466-R469 PolarHBondContact O-N 3.09Å; S466-L470 VanDerWaalsContact O-CG 3.31Å; S466-L470 WeakPolarHBondContact O-CG 3.42Å; S466-L470 PolarHBondContact O-N 2.95Å
467	C	86.2	Confident	84	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-56	173.9	-159.4	0	0	0	0	111.4	L442 Y443 L446 L462 T463 D464 R465 R469 L470 M471	L442-C467 PolarHBondContact O-SG 3.17Å; Y443-C467 HydrophobicContact CD1-CB 3.99Å; Y443-C467 HydrophobicContact CE1-CB 4.02Å; L446-C467 WeakPolarHBondContact CB-SG 3.41Å; L446-C467 WeakPolarHBondContact CD2-SG 3.48Å; L462-C467 HydrophobicContact CD1-CB 4.29Å; T463-C467 PolarHBondContact O-N 2.99Å; D464-C467 VanDerWaalsContact O-CB 3.27Å; D464-C467 WeakPolarHBondContact O-CB 3.44Å; D464-C467 PolarHBondContact O-N 2.94Å; R465-C467 VanDerWaalsContact C-N 3.29Å; C467-R469 PolarHBondContact O-N 2.79Å; C467-L470 PolarHBondContact O-N 3.39Å; C467-L470 VanDerWaalsContact O-N 3.08Å; C467-M471 PolarHBondContact O-N 3.1Å; C467-M471 VanDerWaalsContact O-N 3.14Å
468	K	87.7	Confident	84.6	Confident	83 Å²	83	35.8 Å²	35.8	36%	0.361	19%	0.193	S	C	.	.	H	α-helix	trans	-48.9	-46	171.6	-75.5	-165.9	173	-162	0	112.4	L442 D464 A472 E499	L442-K468 HydrophobicContact CD2-CG 4.41Å; D464-K468 PolarHBondContact O-N 3.45Å; K468-A472 WeakPolarHBondContact O-CB 3.36Å; K468-A472 PolarHBondContact O-N 3.22Å; K468-E499 VanDerWaalsContact NZ-CD 3.34Å; K468-E499 IonicContact NZ-OE1 4Å; K468-E499 IonicContact NZ-OE2 2.92Å; K468-E499 PolarHBondContact NZ-OE2 3.23Å
469	R	90.6	Very high	85.7	Confident	35 Å²	35	36.1 Å²	36.1	13%	0.132	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-40.4	178.8	-73.1	166.4	171	-169.3	-10.2	113.4	R465 S466 C467 A472 I473 I492 E496 L513	R465-R469 WeakPolarHBondContact O-CB 3.26Å; R465-R469 WeakPolarHBondContact O-CD 3.31Å; R465-R469 WeakPolarHBondContact O-CG 3.4Å; R465-R469 PolarHBondContact O-N 3.27Å; R465-R469 VanDerWaalsContact O-N 3.14Å; S466-R469 PolarHBondContact O-N 3.09Å; C467-R469 PolarHBondContact O-N 2.79Å; R469-A472 PolarHBondContact O-N 3.25Å; R469-I473 WeakPolarHBondContact O-CB 3.23Å; R469-I473 WeakPolarHBondContact O-CD1 3.18Å; R469-I473 WeakPolarHBondContact O-CG1 3.28Å; R469-I473 PolarHBondContact O-N 3.14Å; R469-I492 HydrophobicContact CG-CG2 4.07Å; R469-E496 IonicContact CZ-OE1 3.14Å; R469-E496 IonicContact CZ-OE2 3.88Å; R469-E496 IonicContact NE-OE1 3.32Å; R469-E496 PolarHBondContact NE-OE1 2.7Å; R469-E496 IonicContact NE-OE2 2.73Å; R469-E496 VanDerWaalsContact NH2-CD 3.26Å; R469-E496 IonicContact NH2-OE1 3.97Å; R469-E496 PolarHBondContact NH2-OE1 3.46Å; R469-E496 IonicContact NH2-OE2 3.96Å; R469-E496 PolarHBondContact NH2-OE2 3.44Å; R469-L513 HydrophobicContact CB-CD1 3.94Å
470	L	91	Very high	86.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.1	-48	178.3	-76	168.1	0	0	0	110.4	L446 F454 F460 L462 S466 C467 I473 I474 L513 L517	L446-L470 HydrophobicContact CD1-CB 3.95Å; L446-L470 HydrophobicContact CD2-CB 4.29Å; L446-L470 HydrophobicContact CD2-CD1 3.75Å; F454-L470 HydrophobicContact CD1-CD1 3.64Å; F454-L470 HydrophobicContact CD2-CD1 4.48Å; F454-L470 HydrophobicContact CE1-CD1 3.76Å; F454-L470 HydrophobicContact CE1-CD2 4.19Å; F454-L470 HydrophobicContact CG-CD1 4.03Å; F454-L470 HydrophobicContact CZ-CD1 4.24Å; F460-L470 HydrophobicContact CE1-CD1 4.23Å; F460-L470 HydrophobicContact CZ-CD1 4.02Å; L462-L470 HydrophobicContact CD1-CD1 4.09Å; S466-L470 VanDerWaalsContact O-CG 3.31Å; S466-L470 WeakPolarHBondContact O-CG 3.42Å; S466-L470 PolarHBondContact O-N 2.95Å; C467-L470 PolarHBondContact O-N 3.39Å; C467-L470 VanDerWaalsContact O-N 3.08Å; L470-I473 PolarHBondContact O-N 2.81Å; L470-I474 WeakPolarHBondContact O-CG1 3.23Å; L470-I474 PolarHBondContact O-N 2.89Å; L470-L513 HydrophobicContact CD2-CB 4.35Å; L470-L513 HydrophobicContact CD2-CD2 3.86Å; L470-L513 HydrophobicContact CG-CD2 3.99Å; L470-L517 HydrophobicContact CD2-CD1 4.26Å; L470-L517 HydrophobicContact CD2-CD2 3.81Å; L470-L517 HydrophobicContact CD2-CG 3.82Å
471	M	90.5	Very high	87.3	Confident	23 Å²	23	38 Å²	38	11%	0.113	18%	0.177	C	C	.	.	H	α-helix	trans	-58.3	-50.3	175.2	-62.9	-170.4	-74.9	0	0	111.3	L442 Q445 L446 C467 I473 I474 D475	L442-M471 HydrophobicContact CD2-CE 4.02Å; Q445-M471 HydrophobicContact CB-SD 4.06Å; L446-M471 HydrophobicContact CB-CG 4.23Å; L446-M471 HydrophobicContact CB-SD 4.25Å; L446-M471 HydrophobicContact CD1-CG 3.82Å; C467-M471 PolarHBondContact O-N 3.1Å; C467-M471 VanDerWaalsContact O-N 3.14Å; M471-I473 VanDerWaalsContact C-N 3.28Å; M471-I473 PolarHBondContact O-N 3.06Å; M471-I474 PolarHBondContact O-N 2.63Å; M471-I474 VanDerWaalsContact O-N 3.12Å; M471-D475 PolarHBondContact O-N 3Å
472	A	91.1	Very high	88.1	Confident	12 Å²	12	36 Å²	36	10%	0.099	16%	0.163	C	C	.	.	H	α-helix	trans	-60.5	-31.7	178.1	0	0	0	0	0	114.3	K468 R469 F476 M491	K468-A472 WeakPolarHBondContact O-CB 3.36Å; K468-A472 PolarHBondContact O-N 3.22Å; R469-A472 PolarHBondContact O-N 3.25Å; A472-F476 VanDerWaalsContact O-CB 3.27Å; A472-F476 WeakPolarHBondContact O-CB 3.27Å; A472-F476 PolarHBondContact O-N 3.12Å; A472-M491 HydrophobicContact CB-CE 4.31Å; A472-M491 HydrophobicContact CB-SD 4.29Å; A472-M491 VanDerWaalsContact O-CE 3.29Å; A472-M491 WeakPolarHBondContact O-CE 3.12Å
473	I	91.4	Very high	88.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-72	-43.7	174.4	-66.7	161.6	0	0	0	110.7	R469 L470 M471 F476 V477 T488 M491 I492 L513 L514 L517	R469-I473 WeakPolarHBondContact O-CB 3.23Å; R469-I473 WeakPolarHBondContact O-CD1 3.18Å; R469-I473 WeakPolarHBondContact O-CG1 3.28Å; R469-I473 PolarHBondContact O-N 3.14Å; L470-I473 PolarHBondContact O-N 2.81Å; M471-I473 VanDerWaalsContact C-N 3.28Å; M471-I473 PolarHBondContact O-N 3.06Å; I473-F476 PolarHBondContact O-N 2.98Å; I473-V477 HydrophobicContact CG2-CG2 4.14Å; I473-V477 WeakPolarHBondContact O-CB 3.46Å; I473-V477 VanDerWaalsContact O-CG2 3.26Å; I473-V477 WeakPolarHBondContact O-CG2 3.49Å; I473-V477 PolarHBondContact O-N 3.38Å; I473-T488 HydrophobicContact CB-CG2 4.39Å; I473-T488 HydrophobicContact CD1-CG2 4.27Å; I473-T488 HydrophobicContact CG1-CG2 3.7Å; I473-T488 HydrophobicContact CG2-CG2 3.93Å; I473-M491 HydrophobicContact CG1-CE 4.33Å; I473-I492 HydrophobicContact CD1-CD1 3.87Å; I473-I492 HydrophobicContact CG1-CD1 3.85Å; I473-L513 HydrophobicContact CD1-CB 3.67Å; I473-L513 HydrophobicContact CD1-CD1 3.98Å; I473-L513 HydrophobicContact CD1-CG 4.42Å; I473-L514 HydrophobicContact CG2-CD2 3.72Å; I473-L517 HydrophobicContact CB-CD1 3.93Å; I473-L517 HydrophobicContact CG2-CD1 3.43Å; I473-L517 VanDerWaalsContact CG2-CD1 3.43Å
474	I	89.9	Confident	88.8	Confident	16 Å²	16	36.4 Å²	36.4	8%	0.082	17%	0.167	C	C	.	.	H	α-helix	trans	-58.7	-49.4	177.7	-67.3	160.2	0	0	0	109.9	L446 T450 L470 M471 F476 V477 N478 L517	L446-I474 HydrophobicContact CD1-CD1 4.45Å; T450-I474 HydrophobicContact CG2-CD1 3.56Å; L470-I474 WeakPolarHBondContact O-CG1 3.23Å; L470-I474 PolarHBondContact O-N 2.89Å; M471-I474 PolarHBondContact O-N 2.63Å; M471-I474 VanDerWaalsContact O-N 3.12Å; I474-F476 VanDerWaalsContact C-N 3.34Å; I474-F476 PolarHBondContact O-N 2.88Å; I474-V477 PolarHBondContact O-N 3.35Å; I474-N478 VanDerWaalsContact O-CG 3.26Å; I474-N478 PolarHBondContact O-N 3.13Å; I474-N478 PolarHBondContact O-OD1 2.74Å; I474-L517 HydrophobicContact CD1-CD2 3.89Å; I474-L517 HydrophobicContact CG1-CD1 4.14Å; I474-L517 HydrophobicContact CG1-CD2 3.87Å
475	D	91.4	Very high	89	Confident	60 Å²	60	36.4 Å²	36.4	32%	0.321	17%	0.166	S	C	.	.	H	α-helix	trans	-57.7	-45	177.9	-69.1	-47.6	0	0	0	112.3	K449 M471 N478 E479	K449-D475 WeakPolarHBondContact CE-OD1 3.46Å; K449-D475 IonicContact NZ-OD1 3.46Å; K449-D475 PolarHBondContact NZ-OD1 3.13Å; K449-D475 IonicContact NZ-OD2 2.62Å; K449-D475 PolarHBondContact NZ-OD2 2.7Å; M471-D475 PolarHBondContact O-N 3Å; D475-N478 PolarHBondContact O-N 3.35Å; D475-E479 VanDerWaalsContact O-CB 3.26Å; D475-E479 WeakPolarHBondContact O-CB 3.46Å; D475-E479 PolarHBondContact O-N 3.02Å
476	F	92.6	Very high	89	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-71.1	-30.8	-179.4	-176.6	-108	0	0	0	114	A472 I473 I474 R480 V483 E487 M491	A472-F476 VanDerWaalsContact O-CB 3.27Å; A472-F476 WeakPolarHBondContact O-CB 3.27Å; A472-F476 PolarHBondContact O-N 3.12Å; I473-F476 PolarHBondContact O-N 2.98Å; I474-F476 VanDerWaalsContact C-N 3.34Å; I474-F476 PolarHBondContact O-N 2.88Å; F476-R480 HydrophobicContact CD2-CG 4.5Å; F476-R480 HydrophobicContact CE2-CG 4.41Å; F476-R480 VanDerWaalsContact CE2-CZ 3.49Å; F476-R480 VanDerWaalsContact CE2-NE 3.28Å; F476-R480 WeakPolarHBondContact O-CB 3.36Å; F476-R480 PolarHBondContact O-N 2.81Å; F476-V483 HydrophobicContact CD1-CB 4.42Å; F476-V483 HydrophobicContact CD1-CG1 3.96Å; F476-V483 HydrophobicContact CD1-CG2 4.4Å; F476-V483 HydrophobicContact CE1-CB 4.07Å; F476-V483 HydrophobicContact CE1-CG1 3.72Å; F476-V483 HydrophobicContact CE1-CG2 4.46Å; F476-V483 HydrophobicContact CZ-CG1 4.41Å; F476-E487 HydrophobicContact CE1-CB 4.21Å; F476-E487 HydrophobicContact CZ-CB 4.24Å; F476-M491 HydrophobicContact CB-CE 3.74Å; F476-M491 HydrophobicContact CB-CG 4.5Å; F476-M491 HydrophobicContact CD1-CB 4.42Å; F476-M491 HydrophobicContact CD1-CE 4.11Å; F476-M491 HydrophobicContact CD2-CB 4.03Å; F476-M491 HydrophobicContact CD2-CG 3.68Å; F476-M491 HydrophobicContact CE1-CB 4.17Å; F476-M491 HydrophobicContact CE2-CB 3.71Å; F476-M491 HydrophobicContact CE2-CG 3.85Å; F476-M491 HydrophobicContact CG-CB 4.35Å; F476-M491 HydrophobicContact CG-CE 3.91Å; F476-M491 HydrophobicContact CG-CG 4.03Å; F476-M491 HydrophobicContact CZ-CB 3.79Å; F476-M491 HydrophobicContact CZ-CG 4.38Å
477	V	89.5	Confident	89.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.9	-41.3	172.7	170.5	0	0	0	0	110.3	I473 I474 R481 V483 V523 C542	I473-V477 HydrophobicContact CG2-CG2 4.14Å; I473-V477 WeakPolarHBondContact O-CB 3.46Å; I473-V477 VanDerWaalsContact O-CG2 3.26Å; I473-V477 WeakPolarHBondContact O-CG2 3.49Å; I473-V477 PolarHBondContact O-N 3.38Å; I474-V477 PolarHBondContact O-N 3.35Å; V477-R481 VanDerWaalsContact O-CA 3.26Å; V477-R481 WeakPolarHBondContact O-CA 3.38Å; V477-R481 PolarHBondContact O-N 2.92Å; V477-V483 HydrophobicContact CG2-CG2 3.76Å; V477-V523 HydrophobicContact CG1-CG1 4.42Å; V477-V523 HydrophobicContact CG1-CG2 4.24Å; V477-V523 HydrophobicContact CG2-CG2 4.34Å; V477-C542 VanDerWaalsContact CG1-C 3.46Å
478	N	87.5	Confident	89.2	Confident	80 Å²	80	41.8 Å²	41.8	43%	0.428	19%	0.19	S	C	.	.	H	α-helix	trans	-68.6	-48	178.2	-66.5	0.2	0	0	0	111.2	I474 D475 R480	I474-N478 VanDerWaalsContact O-CG 3.26Å; I474-N478 PolarHBondContact O-N 3.13Å; I474-N478 PolarHBondContact O-OD1 2.74Å; D475-N478 PolarHBondContact O-N 3.35Å; N478-R480 PolarHBondContact O-N 2.75Å
479	E	88.8	Confident	89.3	Confident	117 Å²	117	38.1 Å²	38.1	55%	0.547	18%	0.176	S	C	.	.	H	α-helix	trans	-52.1	-52.1	175.6	179.2	-153.9	130.7	0	0	111.8	D475	D475-E479 VanDerWaalsContact O-CB 3.26Å; D475-E479 WeakPolarHBondContact O-CB 3.46Å; D475-E479 PolarHBondContact O-N 3.02Å
480	R	86.4	Confident	89.1	Confident	123 Å²	123	39.9 Å²	39.9	46%	0.464	19%	0.186	S	C	.	.	H	α-helix	trans	-97.3	-5	-170.1	-63.3	-166.8	175.5	-162.9	0.2	114.9	F476 N478 V482 V483	F476-R480 HydrophobicContact CD2-CG 4.5Å; F476-R480 HydrophobicContact CE2-CG 4.41Å; F476-R480 VanDerWaalsContact CE2-CZ 3.49Å; F476-R480 VanDerWaalsContact CE2-NE 3.28Å; F476-R480 WeakPolarHBondContact O-CB 3.36Å; F476-R480 PolarHBondContact O-N 2.81Å; N478-R480 PolarHBondContact O-N 2.75Å; R480-V482 PolarHBondContact O-N 2.83Å; R480-V483 HydrophobicContact CB-CG1 3.57Å; R480-V483 HydrophobicContact CG-CG1 4.4Å
481	R	88.5	Confident	89.2	Confident	120 Å²	120	40.5 Å²	40.5	45%	0.453	19%	0.189	S	C	.	.	S	Bend	trans	59.4	-39.3	-176.9	-59.3	171.7	65.6	91.4	-4.3	116.2	V477 C542 S543 V546	V477-R481 VanDerWaalsContact O-CA 3.26Å; V477-R481 WeakPolarHBondContact O-CA 3.38Å; V477-R481 PolarHBondContact O-N 2.92Å; R481-C542 WeakPolarHBondContact O-CA 3.14Å; R481-C542 WeakPolarHBondContact O-CB 3.48Å; R481-S543 PolarHBondContact O-N 3.19Å; R481-V546 HydrophobicContact CB-CG2 4.43Å
482	V	89	Confident	89.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	109.1	-177.9	-177.2	0	0	0	0	110.3	R480 F540 V546 T552 L553 R556	R480-V482 PolarHBondContact O-N 2.83Å; V482-F540 HydrophobicContact CG1-CB 4.33Å; V482-F540 HydrophobicContact CG1-CD1 4.06Å; V482-V546 HydrophobicContact CG2-CG1 4.38Å; V482-V546 HydrophobicContact CG2-CG2 4.48Å; V482-T552 HydrophobicContact CG2-CG2 4.35Å; V482-L553 HydrophobicContact CG1-CD1 4.14Å; V482-L553 HydrophobicContact CG2-CB 4.26Å; V482-R556 PolarHBondContact O-NH1 3.05Å
483	V	90.2	Very high	89	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	156.4	-178.7	-58.7	0	0	0	0	112.5	F476 V477 R480 F541	F476-V483 HydrophobicContact CD1-CB 4.42Å; F476-V483 HydrophobicContact CD1-CG1 3.96Å; F476-V483 HydrophobicContact CD1-CG2 4.4Å; F476-V483 HydrophobicContact CE1-CB 4.07Å; F476-V483 HydrophobicContact CE1-CG1 3.72Å; F476-V483 HydrophobicContact CE1-CG2 4.46Å; F476-V483 HydrophobicContact CZ-CG1 4.41Å; V477-V483 HydrophobicContact CG2-CG2 3.76Å; R480-V483 HydrophobicContact CB-CG1 3.57Å; R480-V483 HydrophobicContact CG-CG1 4.4Å; V483-F541 HydrophobicContact CG2-CB 4.18Å; V483-F541 PolarHBondContact N-O 3.04Å; V483-F541 PolarHBondContact O-N 3.19Å
484	T	88.4	Confident	88.8	Confident	23 Å²	23	47.3 Å²	47.3	14%	0.141	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	162.4	170.7	66.6	0	0	0	0	112	F486 E487 T488 F540	T484-F486 PolarHBondContact O-N 3.04Å; T484-E487 VanDerWaalsContact CB-OE2 3.27Å; T484-E487 WeakPolarHBondContact CB-OE2 3.16Å; T484-E487 WeakPolarHBondContact CG2-OE2 3.4Å; T484-E487 PolarHBondContact N-OE2 3.4Å; T484-E487 PolarHBondContact O-N 3.39Å; T484-E487 VanDerWaalsContact O-N 3.16Å; T484-E487 PolarHBondContact OG1-N 3.02Å; T484-E487 PolarHBondContact OG1-OE2 2.9Å; T484-T488 PolarHBondContact O-N 3.45Å; T484-T488 PolarHBondContact O-OG1 3.23Å; T484-F540 HydrophobicContact CG2-CD1 3.79Å; T484-F540 HydrophobicContact CG2-CE1 3.85Å
485	N	86.7	Confident	88.7	Confident	32 Å²	32	51 Å²	51	17%	0.171	23%	0.227	C	C	.	.	H	α-helix	trans	-53.7	-32.7	170.8	-172	-28.5	0	0	0	112.6	G489 A511 L514 F541	N485-G489 PolarHBondContact O-N 2.97Å; N485-A511 VanDerWaalsContact ND2-CB 3.31Å; N485-A511 WeakPolarHBondContact ND2-CB 3.42Å; N485-L514 HydrophobicContact CB-CD1 4.07Å; N485-F541 HydrophobicContact CB-CE2 4.05Å
486	F	85.6	Confident	88.5	Confident	113 Å²	113	48.6 Å²	48.6	50%	0.496	21%	0.214	S	C	.	.	H	α-helix	trans	-68.2	-47	176.3	179.3	-92.6	0	0	0	112.7	T484 G489 Q490	T484-F486 PolarHBondContact O-N 3.04Å; F486-G489 CarbonylContact O-C 3.55Å; F486-G489 PolarHBondContact O-N 2.93Å; F486-Q490 WeakPolarHBondContact O-CB 3.48Å; F486-Q490 PolarHBondContact O-N 2.9Å
487	E	87.8	Confident	88.1	Confident	35 Å²	35	56.4 Å²	56.4	16%	0.164	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-45.7	178.4	-71.5	155	112.5	0	0	111.3	F476 T484 G489 Q490 M491 R556	F476-E487 HydrophobicContact CE1-CB 4.21Å; F476-E487 HydrophobicContact CZ-CB 4.24Å; T484-E487 VanDerWaalsContact CB-OE2 3.27Å; T484-E487 WeakPolarHBondContact CB-OE2 3.16Å; T484-E487 WeakPolarHBondContact CG2-OE2 3.4Å; T484-E487 PolarHBondContact N-OE2 3.4Å; T484-E487 PolarHBondContact O-N 3.39Å; T484-E487 VanDerWaalsContact O-N 3.16Å; T484-E487 PolarHBondContact OG1-N 3.02Å; T484-E487 PolarHBondContact OG1-OE2 2.9Å; E487-G489 VanDerWaalsContact C-N 3.28Å; E487-G489 PolarHBondContact O-N 3.34Å; E487-Q490 CarbonylContact O-C 3.57Å; E487-Q490 WeakPolarHBondContact O-CA 3.13Å; E487-Q490 WeakPolarHBondContact O-CB 3.41Å; E487-Q490 PolarHBondContact O-N 2.69Å; E487-M491 PolarHBondContact O-N 2.79Å; E487-R556 IonicContact OE1-CZ 2.74Å; E487-R556 VanDerWaalsContact OE1-CZ 3.27Å; E487-R556 IonicContact OE1-NH1 2.85Å; E487-R556 PolarHBondContact OE1-NH1 3.07Å; E487-R556 IonicContact OE1-NH2 3.8Å; E487-R556 PolarHBondContact OE1-NH2 3.34Å; E487-R556 IonicContact OE2-CZ 2.94Å; E487-R556 IonicContact OE2-NH1 2.83Å; E487-R556 IonicContact OE2-NH2 3.14Å; E487-R556 PolarHBondContact OE2-NH2 2.98Å
488	T	89.8	Confident	87.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.2	-45.1	175.1	-49	0	0	0	0	110.7	I473 T484 Q490 I492 T510 L514	I473-T488 HydrophobicContact CB-CG2 4.39Å; I473-T488 HydrophobicContact CD1-CG2 4.27Å; I473-T488 HydrophobicContact CG1-CG2 3.7Å; I473-T488 HydrophobicContact CG2-CG2 3.93Å; T484-T488 PolarHBondContact O-N 3.45Å; T484-T488 PolarHBondContact O-OG1 3.23Å; T488-Q490 PolarHBondContact O-N 2.8Å; T488-I492 HydrophobicContact CG2-CD1 4.33Å; T488-I492 WeakPolarHBondContact O-CD1 3.19Å; T488-I492 VanDerWaalsContact O-CG1 3.32Å; T488-I492 WeakPolarHBondContact O-CG1 3.24Å; T488-I492 PolarHBondContact O-N 3.47Å; T488-T510 HydrophobicContact CG2-CG2 4.05Å; T488-L514 HydrophobicContact CG2-CD1 4.07Å; T488-L514 HydrophobicContact CG2-CD2 4.11Å; T488-L514 HydrophobicContact CG2-CG 4.2Å
489	G	88.5	Confident	87.6	Confident	6 Å²	6	64 Å²	64	6%	0.062	28%	0.281	C	S	.	.	H	α-helix	trans	-74.3	-2.7	175	0	0	0	0	0	114.4	N485 F486 E487 R493	N485-G489 PolarHBondContact O-N 2.97Å; F486-G489 CarbonylContact O-C 3.55Å; F486-G489 PolarHBondContact O-N 2.93Å; E487-G489 VanDerWaalsContact C-N 3.28Å; E487-G489 PolarHBondContact O-N 3.34Å; G489-R493 VanDerWaalsContact O-CZ 3.23Å; G489-R493 PolarHBondContact O-NE 3.4Å; G489-R493 PolarHBondContact O-NH2 3.47Å
490	Q	87.2	Confident	87.2	Confident	72 Å²	72	61.1 Å²	61.1	34%	0.336	28%	0.283	S	S	.	.	H	α-helix	trans	-95.8	-50	170.8	175	166	-14.8	0	0	110.6	F486 E487 T488 I492 R493 E494	F486-Q490 WeakPolarHBondContact O-CB 3.48Å; F486-Q490 PolarHBondContact O-N 2.9Å; E487-Q490 CarbonylContact O-C 3.57Å; E487-Q490 WeakPolarHBondContact O-CA 3.13Å; E487-Q490 WeakPolarHBondContact O-CB 3.41Å; E487-Q490 PolarHBondContact O-N 2.69Å; T488-Q490 PolarHBondContact O-N 2.8Å; Q490-I492 PolarHBondContact O-N 3.29Å; Q490-R493 WeakPolarHBondContact O-CA 3.4Å; Q490-R493 WeakPolarHBondContact O-CB 3.41Å; Q490-R493 PolarHBondContact O-N 2.59Å; Q490-E494 WeakPolarHBondContact CG-OE1 3.14Å; Q490-E494 PolarHBondContact NE2-OE1 2.85Å; Q490-E494 PolarHBondContact O-N 3.08Å
491	M	92.2	Very high	86.7	Confident	12 Å²	12	58.8 Å²	58.8	6%	0.059	28%	0.275	C	S	.	.	H	α-helix	trans	-50.5	-44.9	173.7	171.8	-79.3	-69.2	0	0	111.9	A472 I473 F476 E487 R493 E494 R495	A472-M491 HydrophobicContact CB-CE 4.31Å; A472-M491 HydrophobicContact CB-SD 4.29Å; A472-M491 VanDerWaalsContact O-CE 3.29Å; A472-M491 WeakPolarHBondContact O-CE 3.12Å; I473-M491 HydrophobicContact CG1-CE 4.33Å; F476-M491 HydrophobicContact CB-CE 3.74Å; F476-M491 HydrophobicContact CB-CG 4.5Å; F476-M491 HydrophobicContact CD1-CB 4.42Å; F476-M491 HydrophobicContact CD1-CE 4.11Å; F476-M491 HydrophobicContact CD2-CB 4.03Å; F476-M491 HydrophobicContact CD2-CG 3.68Å; F476-M491 HydrophobicContact CE1-CB 4.17Å; F476-M491 HydrophobicContact CE2-CB 3.71Å; F476-M491 HydrophobicContact CE2-CG 3.85Å; F476-M491 HydrophobicContact CG-CB 4.35Å; F476-M491 HydrophobicContact CG-CE 3.91Å; F476-M491 HydrophobicContact CG-CG 4.03Å; F476-M491 HydrophobicContact CZ-CB 3.79Å; F476-M491 HydrophobicContact CZ-CG 4.38Å; E487-M491 PolarHBondContact O-N 2.79Å; M491-R493 VanDerWaalsContact C-N 3.28Å; M491-R493 PolarHBondContact O-N 3.04Å; M491-E494 PolarHBondContact O-N 3.04Å; M491-E494 VanDerWaalsContact O-N 3.12Å; M491-R495 PolarHBondContact O-N 3.3Å; M491-R495 HydrophobicContact SD-CG 4.23Å
492	I	90.4	Very high	85.8	Confident	4 Å²	4	60 Å²	60	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-31.5	177.5	-62.6	166.2	0	0	0	111.8	R469 I473 T488 Q490 E494 E496 I505 T510	R469-I492 HydrophobicContact CG-CG2 4.07Å; I473-I492 HydrophobicContact CD1-CD1 3.87Å; I473-I492 HydrophobicContact CG1-CD1 3.85Å; T488-I492 HydrophobicContact CG2-CD1 4.33Å; T488-I492 WeakPolarHBondContact O-CD1 3.19Å; T488-I492 VanDerWaalsContact O-CG1 3.32Å; T488-I492 WeakPolarHBondContact O-CG1 3.24Å; T488-I492 PolarHBondContact O-N 3.47Å; Q490-I492 PolarHBondContact O-N 3.29Å; I492-E494 VanDerWaalsContact C-N 3.35Å; I492-E496 HydrophobicContact CG2-CG 4.07Å; I492-E496 WeakPolarHBondContact O-CB 3.48Å; I492-E496 WeakPolarHBondContact O-CG 3.19Å; I492-E496 PolarHBondContact O-N 3.14Å; I492-I505 HydrophobicContact CB-CG2 4.14Å; I492-I505 HydrophobicContact CD1-CD1 3.91Å; I492-I505 HydrophobicContact CG2-CB 4.07Å; I492-I505 HydrophobicContact CG2-CD1 4.01Å; I492-I505 HydrophobicContact CG2-CG2 3.89Å; I492-T510 HydrophobicContact CD1-CG2 4.48Å
493	R	86.9	Confident	85	Confident	90 Å²	90	62.1 Å²	62.1	34%	0.34	30%	0.299	S	S	.	.	H	α-helix	trans	-74	-26.4	175.3	-87.3	178.2	-76.9	140.4	5	112.9	G489 Q490 M491 K497 C504 I505	G489-R493 VanDerWaalsContact O-CZ 3.23Å; G489-R493 PolarHBondContact O-NE 3.4Å; G489-R493 PolarHBondContact O-NH2 3.47Å; Q490-R493 WeakPolarHBondContact O-CA 3.4Å; Q490-R493 WeakPolarHBondContact O-CB 3.41Å; Q490-R493 PolarHBondContact O-N 2.59Å; M491-R493 VanDerWaalsContact C-N 3.28Å; M491-R493 PolarHBondContact O-N 3.04Å; R493-K497 WeakPolarHBondContact O-CB 3.08Å; R493-K497 PolarHBondContact O-N 3.32Å; R493-C504 HydrophobicContact CG-CB 3.87Å; R493-I505 HydrophobicContact CG-CG2 4.28Å
494	E	87.4	Confident	84.2	Confident	84 Å²	84	66.7 Å²	66.7	39%	0.393	33%	0.329	S	S	.	.	H	α-helix	trans	-77.5	-56	176.4	-74.9	143.8	-176.5	0	0	109.4	Q490 M491 I492 E496 K497 E498	Q490-E494 WeakPolarHBondContact CG-OE1 3.14Å; Q490-E494 PolarHBondContact NE2-OE1 2.85Å; Q490-E494 PolarHBondContact O-N 3.08Å; M491-E494 PolarHBondContact O-N 3.04Å; M491-E494 VanDerWaalsContact O-N 3.12Å; I492-E494 VanDerWaalsContact C-N 3.35Å; E494-E496 VanDerWaalsContact C-N 3.34Å; E494-E496 PolarHBondContact O-N 3.48Å; E494-K497 WeakPolarHBondContact O-CA 3.46Å; E494-K497 WeakPolarHBondContact O-CB 3.19Å; E494-K497 PolarHBondContact O-N 2.81Å; E494-E498 PolarHBondContact O-N 3.2Å
495	R	87.9	Confident	83.8	Confident	94 Å²	94	66.2 Å²	66.2	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-57.3	-40	174	-66.4	-168.4	-174	-175.3	5.4	113.7	M491 K497 E498 E499	M491-R495 PolarHBondContact O-N 3.3Å; M491-R495 HydrophobicContact SD-CG 4.23Å; R495-K497 VanDerWaalsContact C-N 3.29Å; R495-K497 PolarHBondContact O-N 3.41Å; R495-E498 WeakPolarHBondContact CA-OE2 3.36Å; R495-E498 PolarHBondContact O-N 3.39Å; R495-E499 PolarHBondContact O-N 3.35Å
496	E	86.7	Confident	83.5	Confident	10 Å²	10	69 Å²	69	5%	0.047	34%	0.341	C	S	.	.	H	α-helix	trans	-71	-22.2	176.2	-71.9	-172.4	149.2	0	0	113.5	R465 R469 I492 E494 G500 Y501	R465-E496 IonicContact CZ-OE1 2.68Å; R465-E496 VanDerWaalsContact CZ-OE1 3.27Å; R465-E496 IonicContact CZ-OE2 3.87Å; R465-E496 IonicContact NE-OE1 3.25Å; R465-E496 PolarHBondContact NE-OE1 3.46Å; R465-E496 IonicContact NE-OE2 3.12Å; R465-E496 IonicContact NH2-OE1 3.67Å; R465-E496 PolarHBondContact NH2-OE1 3.26Å; R465-E496 IonicContact NH2-OE2 2.67Å; R465-E496 PolarHBondContact NH2-OE2 3.18Å; R469-E496 IonicContact CZ-OE1 3.14Å; R469-E496 IonicContact CZ-OE2 3.88Å; R469-E496 IonicContact NE-OE1 3.32Å; R469-E496 PolarHBondContact NE-OE1 2.7Å; R469-E496 IonicContact NE-OE2 2.73Å; R469-E496 VanDerWaalsContact NH2-CD 3.26Å; R469-E496 IonicContact NH2-OE1 3.97Å; R469-E496 PolarHBondContact NH2-OE1 3.46Å; R469-E496 IonicContact NH2-OE2 3.96Å; R469-E496 PolarHBondContact NH2-OE2 3.44Å; I492-E496 HydrophobicContact CG2-CG 4.07Å; I492-E496 WeakPolarHBondContact O-CB 3.48Å; I492-E496 WeakPolarHBondContact O-CG 3.19Å; I492-E496 PolarHBondContact O-N 3.14Å; E494-E496 VanDerWaalsContact C-N 3.34Å; E494-E496 PolarHBondContact O-N 3.48Å; E496-G500 PolarHBondContact O-N 3.12Å; E496-Y501 HydrophobicContact CB-CD2 3.91Å; E496-Y501 HydrophobicContact CG-CD2 4.07Å; E496-Y501 VanDerWaalsContact O-CB 3.23Å; E496-Y501 WeakPolarHBondContact O-CB 2.99Å; E496-Y501 WeakPolarHBondContact O-CD2 3.27Å; E496-Y501 PolarHBondContact O-N 3.23Å
497	K	84.1	Confident	83.2	Confident	170 Å²	170	70.8 Å²	70.8	74%	0.739	35%	0.348	S	S	*	.	H	α-helix	trans	-76.8	-37	171.9	-176	-165.7	170.8	-152.3	0	110.7	R493 E494 R495 G500	R493-K497 WeakPolarHBondContact O-CB 3.08Å; R493-K497 PolarHBondContact O-N 3.32Å; E494-K497 WeakPolarHBondContact O-CA 3.46Å; E494-K497 WeakPolarHBondContact O-CB 3.19Å; E494-K497 PolarHBondContact O-N 2.81Å; R495-K497 VanDerWaalsContact C-N 3.29Å; R495-K497 PolarHBondContact O-N 3.41Å; K497-G500 PolarHBondContact O-N 3.13Å; K497-G500 VanDerWaalsContact O-N 3.1Å
498	E	85.2	Confident	82.9	Confident	152 Å²	152	74.5 Å²	74.5	71%	0.71	37%	0.37	S	S	*	.	H	α-helix	trans	-65.3	-40.5	172.8	-68.9	146.2	-155.6	0	0	111.5	E494 R495 G500	E494-E498 PolarHBondContact O-N 3.2Å; R495-E498 WeakPolarHBondContact CA-OE2 3.36Å; R495-E498 PolarHBondContact O-N 3.39Å; E498-G500 PolarHBondContact O-N 3.14Å; E498-G500 VanDerWaalsContact O-N 3.12Å
499	E	82.9	Confident	82.5	Confident	86 Å²	86	75.9 Å²	75.9	40%	0.402	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	5.1	169.2	-70.4	-168.6	-132	0	0	114.2	K468 R495 Y501	K468-E499 VanDerWaalsContact NZ-CD 3.34Å; K468-E499 IonicContact NZ-OE1 4Å; K468-E499 IonicContact NZ-OE2 2.92Å; K468-E499 PolarHBondContact NZ-OE2 3.23Å; R495-E499 PolarHBondContact O-N 3.35Å; E499-Y501 HydrophobicContact CB-CD2 3.87Å; E499-Y501 HydrophobicContact CB-CE2 3.75Å
500	G	79.7	Confident	82.5	Confident	58 Å²	58	75.7 Å²	75.7	60%	0.598	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	24.8	172.5	0	0	0	0	0	116.1	E496 K497 E498	E496-G500 PolarHBondContact O-N 3.12Å; K497-G500 PolarHBondContact O-N 3.13Å; K497-G500 VanDerWaalsContact O-N 3.1Å; E498-G500 PolarHBondContact O-N 3.14Å; E498-G500 VanDerWaalsContact O-N 3.12Å
501	Y	75.1	Confident	82.4	Confident	74 Å²	74	72.7 Å²	72.7	29%	0.29	37%	0.366	S	S	.	.			trans	-93.5	118.7	-177.1	-64.1	-55.3	0	0	0	114.9	E496 E499 Y503	E496-Y501 HydrophobicContact CB-CD2 3.91Å; E496-Y501 HydrophobicContact CG-CD2 4.07Å; E496-Y501 VanDerWaalsContact O-CB 3.23Å; E496-Y501 WeakPolarHBondContact O-CB 2.99Å; E496-Y501 WeakPolarHBondContact O-CD2 3.27Å; E496-Y501 PolarHBondContact O-N 3.23Å; E499-Y501 HydrophobicContact CB-CD2 3.87Å; E499-Y501 HydrophobicContact CB-CE2 3.75Å; Y501-Y503 AromaticContact CD1-CE2 3.59Å; Y501-Y503 HydrophobicContact CD1-CE2 3.59Å; Y501-Y503 AromaticContact CD1-CZ 3.53Å; Y501-Y503 WeakPolarHBondContact CD1-OH 3.31Å; Y501-Y503 HydrophobicContact CD2-CE2 4.47Å; Y501-Y503 HydrophobicContact CE1-CE2 4.37Å; Y501-Y503 WeakPolarHBondContact CE1-OH 3.33Å; Y501-Y503 HydrophobicContact CG-CD2 4.4Å; Y501-Y503 AromaticContact CG-CE2 3.63Å; Y501-Y503 HydrophobicContact CG-CE2 3.63Å; Y501-Y503 PolarHBondContact O-N 3.45Å
502	D	70.1	Confident	82.1	Confident	144 Å²	144	75.7 Å²	75.7	77%	0.77	39%	0.385	S	S	*	.	S	Bend	trans	-64.1	24.3	173	-55.7	-30.6	0	0	0	115.7	R424	R424-D502 PolarHBondContact NH2-O 3.03Å
503	Y	72.2	Confident	82.1	Confident	45 Å²	45	75.9 Å²	75.9	18%	0.176	39%	0.386	C	S	.	.			trans	-155.4	128.3	-171.6	37.9	-108.6	0	0	0	115.3	G423 R424 Y501	G423-Y503 WeakPolarHBondContact CA-OH 3.13Å; G423-Y503 PolarHBondContact O-OH 2.71Å; R424-Y503 HydrophobicContact CG-CD1 3.71Å; R424-Y503 HydrophobicContact CG-CE1 4.14Å; R424-Y503 HydrophobicContact CG-CG 4.08Å; Y501-Y503 AromaticContact CD1-CE2 3.59Å; Y501-Y503 HydrophobicContact CD1-CE2 3.59Å; Y501-Y503 AromaticContact CD1-CZ 3.53Å; Y501-Y503 WeakPolarHBondContact CD1-OH 3.31Å; Y501-Y503 HydrophobicContact CD2-CE2 4.47Å; Y501-Y503 HydrophobicContact CE1-CE2 4.37Å; Y501-Y503 WeakPolarHBondContact CE1-OH 3.33Å; Y501-Y503 HydrophobicContact CG-CD2 4.4Å; Y501-Y503 AromaticContact CG-CE2 3.63Å; Y501-Y503 HydrophobicContact CG-CE2 3.63Å; Y501-Y503 PolarHBondContact O-N 3.45Å
504	C	73	Confident	82.2	Confident	96 Å²	96	71.6 Å²	71.6	65%	0.649	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-75.5	145.9	175	-56.3	0	0	0	0	112.8	R493	R493-C504 HydrophobicContact CG-CB 3.87Å
505	I	81.2	Confident	82.2	Confident	13 Å²	13	73.4 Å²	73.4	7%	0.067	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-57.3	143.1	155.4	-165.4	168.6	0	0	0	110.7	I492 R493 A509 T510 L513	I492-I505 HydrophobicContact CB-CG2 4.14Å; I492-I505 HydrophobicContact CD1-CD1 3.91Å; I492-I505 HydrophobicContact CG2-CB 4.07Å; I492-I505 HydrophobicContact CG2-CD1 4.01Å; I492-I505 HydrophobicContact CG2-CG2 3.89Å; R493-I505 HydrophobicContact CG-CG2 4.28Å; I505-A509 HydrophobicContact CD1-CB 4.23Å; I505-A509 HydrophobicContact CG1-CB 3.81Å; I505-T510 WeakPolarHBondContact CD1-OG1 3.48Å; I505-L513 HydrophobicContact CD1-CD1 4.03Å
506	D	78.9	Confident	82.2	Confident	92 Å²	92	69.6 Å²	69.6	49%	0.492	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-93.6	155.4	173.1	83.1	70.6	0	0	0	112	N508 A509 T510	D506-N508 PolarHBondContact O-N 3.3Å; D506-N508 WeakPolarHBondContact OD1-CA 3.37Å; D506-N508 VanDerWaalsContact OD1-CB 3.25Å; D506-N508 WeakPolarHBondContact OD1-CB 3.48Å; D506-N508 PolarHBondContact OD1-N 3.38Å; D506-A509 WeakPolarHBondContact O-CB 3.16Å; D506-A509 PolarHBondContact O-N 2.92Å; D506-A509 PolarHBondContact OD1-N 3.35Å; D506-T510 PolarHBondContact O-N 3.21Å; D506-T510 VanDerWaalsContact O-N 3.09Å; D506-T510 PolarHBondContact O-OG1 3.38Å
507	K	79.7	Confident	82.4	Confident	149 Å²	149	69.1 Å²	69.1	65%	0.648	36%	0.358	S	S	*	.	H	α-helix	trans	-62.6	-24.3	-174.6	-65.3	-169.1	175.7	-168.6	0	114.3	A511	K507-A511 VanDerWaalsContact O-CB 3.27Å; K507-A511 WeakPolarHBondContact O-CB 3.42Å; K507-A511 PolarHBondContact O-N 2.82Å
508	N	81.1	Confident	82.5	Confident	114 Å²	114	62.3 Å²	62.3	61%	0.61	33%	0.334	S	S	*	.	H	α-helix	trans	-76.4	-42.5	174.1	-60.7	-9.4	0	0	0	109.7	D506 T510 A511 T512	D506-N508 PolarHBondContact O-N 3.3Å; D506-N508 WeakPolarHBondContact OD1-CA 3.37Å; D506-N508 VanDerWaalsContact OD1-CB 3.25Å; D506-N508 WeakPolarHBondContact OD1-CB 3.48Å; D506-N508 PolarHBondContact OD1-N 3.38Å; N508-T510 PolarHBondContact O-N 2.89Å; N508-A511 CarbonylContact O-C 3.55Å; N508-A511 PolarHBondContact O-N 3.09Å; N508-A511 VanDerWaalsContact O-N 3.13Å; N508-T512 PolarHBondContact O-N 2.94Å; N508-T512 PolarHBondContact O-OG1 3.3Å
509	A	82.3	Confident	82.6	Confident	28 Å²	28	59 Å²	59	23%	0.231	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-43.9	177.7	0	0	0	0	0	112.5	I505 D506 A511 T512 L513	I505-A509 HydrophobicContact CD1-CB 4.23Å; I505-A509 HydrophobicContact CG1-CB 3.81Å; D506-A509 WeakPolarHBondContact O-CB 3.16Å; D506-A509 PolarHBondContact O-N 2.92Å; D506-A509 PolarHBondContact OD1-N 3.35Å; A509-A511 VanDerWaalsContact C-N 3.32Å; A509-A511 PolarHBondContact O-N 3.24Å; A509-T512 PolarHBondContact O-N 3.18Å; A509-L513 WeakPolarHBondContact O-CG 3.32Å; A509-L513 PolarHBondContact O-N 3.32Å; A509-L513 VanDerWaalsContact O-N 3.1Å
510	T	87.5	Confident	82.8	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-44.5	171.8	-47.1	0	0	0	0	111.3	T488 I492 I505 D506 N508 T512 L513 L514	T488-T510 HydrophobicContact CG2-CG2 4.05Å; I492-T510 HydrophobicContact CD1-CG2 4.48Å; I505-T510 WeakPolarHBondContact CD1-OG1 3.48Å; D506-T510 PolarHBondContact O-N 3.21Å; D506-T510 VanDerWaalsContact O-N 3.09Å; D506-T510 PolarHBondContact O-OG1 3.38Å; N508-T510 PolarHBondContact O-N 2.89Å; T510-T512 VanDerWaalsContact C-N 3.32Å; T510-T512 PolarHBondContact O-N 2.88Å; T510-L513 PolarHBondContact O-N 2.74Å; T510-L514 HydrophobicContact CG2-CD1 4.11Å; T510-L514 PolarHBondContact O-N 3.08Å
511	A	86.5	Confident	83.1	Confident	9 Å²	9	64 Å²	64	7%	0.074	33%	0.332	C	S	.	.	H	α-helix	trans	-70.1	-24.6	180	0	0	0	0	0	113.8	N485 K507 N508 A509 R515	N485-A511 VanDerWaalsContact ND2-CB 3.31Å; N485-A511 WeakPolarHBondContact ND2-CB 3.42Å; K507-A511 VanDerWaalsContact O-CB 3.27Å; K507-A511 WeakPolarHBondContact O-CB 3.42Å; K507-A511 PolarHBondContact O-N 2.82Å; N508-A511 CarbonylContact O-C 3.55Å; N508-A511 PolarHBondContact O-N 3.09Å; N508-A511 VanDerWaalsContact O-N 3.13Å; A509-A511 VanDerWaalsContact C-N 3.32Å; A509-A511 PolarHBondContact O-N 3.24Å; A511-R515 WeakPolarHBondContact O-CB 3.23Å; A511-R515 VanDerWaalsContact O-CG 3.31Å; A511-R515 WeakPolarHBondContact O-CG 3.39Å; A511-R515 PolarHBondContact O-N 3.1Å; A511-R515 PolarHBondContact O-NH1 2.66Å; A511-R515 VanDerWaalsContact O-NH1 3.13Å
512	T	85.6	Confident	83.7	Confident	75 Å²	75	62.3 Å²	62.3	46%	0.46	33%	0.328	S	S	.	.	H	α-helix	trans	-71.1	-51.6	170.6	-65	0	0	0	0	109.7	F460 N508 A509 T510 L514 R515 T516	F460-T512 HydrophobicContact CD2-CG2 4.35Å; F460-T512 HydrophobicContact CE2-CG2 4.41Å; N508-T512 PolarHBondContact O-N 2.94Å; N508-T512 PolarHBondContact O-OG1 3.3Å; A509-T512 PolarHBondContact O-N 3.18Å; T510-T512 VanDerWaalsContact C-N 3.32Å; T510-T512 PolarHBondContact O-N 2.88Å; T512-L514 PolarHBondContact O-N 2.76Å; T512-R515 PolarHBondContact O-N 3.04Å; T512-R515 VanDerWaalsContact O-N 3.12Å; T512-T516 PolarHBondContact O-N 3.37Å; T512-T516 PolarHBondContact O-OG1 2.99Å
513	L	89.7	Confident	84.6	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-57.9	-47.2	-179.8	-65.7	166.1	0	0	0	112	F460 R469 L470 I473 I505 A509 T510 R515 T516 L517	F460-L513 HydrophobicContact CE2-CD2 4.05Å; F460-L513 HydrophobicContact CZ-CD2 3.95Å; R469-L513 HydrophobicContact CB-CD1 3.94Å; L470-L513 HydrophobicContact CD2-CB 4.35Å; L470-L513 HydrophobicContact CD2-CD2 3.86Å; L470-L513 HydrophobicContact CG-CD2 3.99Å; I473-L513 HydrophobicContact CD1-CB 3.67Å; I473-L513 HydrophobicContact CD1-CD1 3.98Å; I473-L513 HydrophobicContact CD1-CG 4.42Å; I505-L513 HydrophobicContact CD1-CD1 4.03Å; A509-L513 WeakPolarHBondContact O-CG 3.32Å; A509-L513 PolarHBondContact O-N 3.32Å; A509-L513 VanDerWaalsContact O-N 3.1Å; T510-L513 PolarHBondContact O-N 2.74Å; L513-R515 VanDerWaalsContact C-N 3.34Å; L513-R515 PolarHBondContact O-N 2.74Å; L513-T516 PolarHBondContact O-N 3.29Å; L513-L517 PolarHBondContact O-N 3.12Å
514	L	89.8	Confident	85.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-37.4	176.3	-78.3	168.9	0	0	0	113.2	I473 N485 T488 T510 T512 A518 F541	I473-L514 HydrophobicContact CG2-CD2 3.72Å; N485-L514 HydrophobicContact CB-CD1 4.07Å; T488-L514 HydrophobicContact CG2-CD1 4.07Å; T488-L514 HydrophobicContact CG2-CD2 4.11Å; T488-L514 HydrophobicContact CG2-CG 4.2Å; T510-L514 HydrophobicContact CG2-CD1 4.11Å; T510-L514 PolarHBondContact O-N 3.08Å; T512-L514 PolarHBondContact O-N 2.76Å; L514-A518 WeakPolarHBondContact O-CB 3.46Å; L514-A518 PolarHBondContact O-N 3.03Å; L514-F541 HydrophobicContact CB-CD1 3.99Å; L514-F541 HydrophobicContact CB-CE1 3.71Å; L514-F541 HydrophobicContact CB-CZ 4.06Å; L514-F541 HydrophobicContact CD1-CD1 4.45Å; L514-F541 HydrophobicContact CD1-CD2 3.99Å; L514-F541 HydrophobicContact CD1-CE1 4.42Å; L514-F541 HydrophobicContact CD1-CE2 3.94Å; L514-F541 HydrophobicContact CD1-CG 4.25Å; L514-F541 HydrophobicContact CD1-CZ 4.17Å; L514-F541 HydrophobicContact CD2-CB 4.14Å; L514-F541 HydrophobicContact CD2-CD1 3.86Å; L514-F541 HydrophobicContact CD2-CD2 4.41Å; L514-F541 HydrophobicContact CD2-CE1 4.43Å; L514-F541 HydrophobicContact CD2-CG 3.86Å; L514-F541 HydrophobicContact CG-CD1 4.33Å; L514-F541 HydrophobicContact CG-CE1 4.42Å; L514-F541 HydrophobicContact CG-CG 4.47Å
515	R	86.5	Confident	86.1	Confident	121 Å²	121	55.2 Å²	55.2	46%	0.457	29%	0.286	S	S	.	.	H	α-helix	trans	-74.3	-28.1	174.9	-74.1	-171.2	-165.1	88.3	9.1	113.3	A511 T512 L513 S519 E539	A511-R515 WeakPolarHBondContact O-CB 3.23Å; A511-R515 VanDerWaalsContact O-CG 3.31Å; A511-R515 WeakPolarHBondContact O-CG 3.39Å; A511-R515 PolarHBondContact O-N 3.1Å; A511-R515 PolarHBondContact O-NH1 2.66Å; A511-R515 VanDerWaalsContact O-NH1 3.13Å; T512-R515 PolarHBondContact O-N 3.04Å; T512-R515 VanDerWaalsContact O-N 3.12Å; L513-R515 VanDerWaalsContact C-N 3.34Å; L513-R515 PolarHBondContact O-N 2.74Å; R515-S519 WeakPolarHBondContact O-CB 3.38Å; R515-S519 PolarHBondContact O-N 2.9Å; R515-S519 PolarHBondContact O-OG 3Å; R515-E539 IonicContact CZ-OE1 4Å; R515-E539 IonicContact NE-OE1 2.67Å; R515-E539 IonicContact NH2-OE1 3.71Å; R515-E539 PolarHBondContact NH2-OE1 2.86Å; R515-E539 IonicContact NH2-OE2 3.76Å; R515-E539 PolarHBondContact NH2-OE2 2.98Å
516	T	88.1	Confident	86.4	Confident	14 Å²	14	57 Å²	57	9%	0.086	29%	0.292	C	S	.	.	H	α-helix	trans	-67.5	-44.5	171.3	-50.9	0	0	0	0	110.4	F454 L457 F460 T512 L513 A518 S519 Q520	F454-T516 HydrophobicContact CD1-CG2 3.91Å; F454-T516 HydrophobicContact CE1-CG2 3.86Å; L457-T516 HydrophobicContact CD1-CG2 3.7Å; F460-T516 HydrophobicContact CD2-CG2 4.03Å; F460-T516 WeakPolarHBondContact CD2-OG1 3.33Å; F460-T516 HydrophobicContact CE2-CG2 4.13Å; F460-T516 WeakPolarHBondContact CE2-OG1 3.21Å; F460-T516 HydrophobicContact CG-CG2 4.26Å; F460-T516 HydrophobicContact CZ-CG2 4.45Å; T512-T516 PolarHBondContact O-N 3.37Å; T512-T516 PolarHBondContact O-OG1 2.99Å; L513-T516 PolarHBondContact O-N 3.29Å; T516-A518 PolarHBondContact O-N 3.31Å; T516-S519 PolarHBondContact O-N 3.35Å; T516-S519 PolarHBondContact O-OG 3.27Å; T516-S519 VanDerWaalsContact O-OG 3.08Å; T516-Q520 VanDerWaalsContact O-CG 3.3Å; T516-Q520 WeakPolarHBondContact O-CG 3.2Å; T516-Q520 PolarHBondContact O-N 3.2Å
517	L	90.4	Very high	86.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-42	174	-67.2	173.7	0	0	0	112.2	F454 L470 I473 I474 L513 Q520 K521 L522 V523	F454-L517 HydrophobicContact CE1-CD2 4.41Å; F454-L517 HydrophobicContact CZ-CD2 4.12Å; L470-L517 HydrophobicContact CD2-CD1 4.26Å; L470-L517 HydrophobicContact CD2-CD2 3.81Å; L470-L517 HydrophobicContact CD2-CG 3.82Å; I473-L517 HydrophobicContact CB-CD1 3.93Å; I473-L517 HydrophobicContact CG2-CD1 3.43Å; I473-L517 VanDerWaalsContact CG2-CD1 3.43Å; I474-L517 HydrophobicContact CD1-CD2 3.89Å; I474-L517 HydrophobicContact CG1-CD1 4.14Å; I474-L517 HydrophobicContact CG1-CD2 3.87Å; L513-L517 PolarHBondContact O-N 3.12Å; L517-Q520 CarbonylContact O-C 3.58Å; L517-Q520 PolarHBondContact O-N 2.86Å; L517-K521 PolarHBondContact O-N 2.95Å; L517-L522 HydrophobicContact CB-CB 4.44Å; L517-L522 HydrophobicContact CD2-CB 4.26Å; L517-L522 HydrophobicContact CD2-CD1 3.68Å; L517-L522 PolarHBondContact O-N 2.87Å; L517-V523 HydrophobicContact CB-CB 4.29Å; L517-V523 HydrophobicContact CB-CG2 3.83Å; L517-V523 HydrophobicContact CD1-CG2 4.21Å
518	A	88.2	Confident	86.5	Confident	28 Å²	28	51 Å²	51	23%	0.231	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-39.4	176.8	0	0	0	0	0	113.2	L514 T516 Q520 K521 V525	L514-A518 WeakPolarHBondContact O-CB 3.46Å; L514-A518 PolarHBondContact O-N 3.03Å; T516-A518 PolarHBondContact O-N 3.31Å; A518-Q520 PolarHBondContact O-N 3.37Å; A518-K521 PolarHBondContact O-N 3.29Å; A518-K521 VanDerWaalsContact O-N 3.1Å; A518-V525 HydrophobicContact CB-CG2 3.64Å
519	S	86.5	Confident	86	Confident	81 Å²	81	48.8 Å²	48.8	57%	0.566	25%	0.252	S	S	*	.	H	α-helix	trans	-68.9	-22.4	177	72.4	0	0	0	0	112.9	R515 T516	R515-S519 WeakPolarHBondContact O-CB 3.38Å; R515-S519 PolarHBondContact O-N 2.9Å; R515-S519 PolarHBondContact O-OG 3Å; T516-S519 PolarHBondContact O-N 3.35Å; T516-S519 PolarHBondContact O-OG 3.27Å; T516-S519 VanDerWaalsContact O-OG 3.08Å
520	Q	87.7	Confident	85.3	Confident	62 Å²	62	48.5 Å²	48.5	29%	0.29	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	13.3	173.6	-57.3	-57.2	-80.6	0	0	112.8	V452 L457 T516 L517 A518 L522	V452-Q520 HydrophobicContact CG1-CB 4.5Å; V452-Q520 HydrophobicContact CG1-CG 4.02Å; V452-Q520 HydrophobicContact CG2-CB 4.29Å; L457-Q520 HydrophobicContact CD1-CG 4.26Å; T516-Q520 VanDerWaalsContact O-CG 3.3Å; T516-Q520 WeakPolarHBondContact O-CG 3.2Å; T516-Q520 PolarHBondContact O-N 3.2Å; L517-Q520 CarbonylContact O-C 3.58Å; L517-Q520 PolarHBondContact O-N 2.86Å; A518-Q520 PolarHBondContact O-N 3.37Å; Q520-L522 HydrophobicContact CB-CD1 4.2Å; Q520-L522 HydrophobicContact CB-CG 4.31Å; Q520-L522 PolarHBondContact O-N 3.35Å
521	K	85.7	Confident	83.6	Confident	188 Å²	188	55 Å²	55	82%	0.817	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	7.5	179.7	-55.2	-178.3	-178.3	177.5	0	116.2	L517 A518 V523	L517-K521 PolarHBondContact O-N 2.95Å; A518-K521 PolarHBondContact O-N 3.29Å; A518-K521 VanDerWaalsContact O-N 3.1Å; K521-V523 PolarHBondContact O-N 2.98Å
522	L	87.4	Confident	81.9	Confident	39 Å²	39	57 Å²	57	20%	0.204	29%	0.289	C	S	.	.	S	Bend	trans	-71.1	-13.9	179.7	-63.5	168	0	0	0	113.4	T450 F454 L517 Q520	T450-L522 HydrophobicContact CG2-CD1 3.78Å; T450-L522 HydrophobicContact CG2-CD2 4.35Å; F454-L522 HydrophobicContact CZ-CD1 3.84Å; L517-L522 HydrophobicContact CB-CB 4.44Å; L517-L522 HydrophobicContact CD2-CB 4.26Å; L517-L522 HydrophobicContact CD2-CD1 3.68Å; L517-L522 PolarHBondContact O-N 2.87Å; Q520-L522 HydrophobicContact CB-CD1 4.2Å; Q520-L522 HydrophobicContact CB-CG 4.31Å; Q520-L522 PolarHBondContact O-N 3.35Å
523	V	88.8	Confident	79.8	Confident	6 Å²	6	57.4 Å²	57.4	4%	0.036	30%	0.296	C	S	.	.	S	Bend	trans	-145.2	127.9	-177.8	172.9	0	0	0	0	109.1	V477 L517 K521 F541	V477-V523 HydrophobicContact CG1-CG1 4.42Å; V477-V523 HydrophobicContact CG1-CG2 4.24Å; V477-V523 HydrophobicContact CG2-CG2 4.34Å; L517-V523 HydrophobicContact CB-CB 4.29Å; L517-V523 HydrophobicContact CB-CG2 3.83Å; L517-V523 HydrophobicContact CD1-CG2 4.21Å; K521-V523 PolarHBondContact O-N 2.98Å; V523-F541 HydrophobicContact CG1-CB 3.81Å; V523-F541 HydrophobicContact CG1-CD1 4.09Å; V523-F541 HydrophobicContact CG1-CG 4.47Å
524	K	87.6	Confident	77.9	Confident	62 Å²	62	61.8 Å²	61.8	27%	0.27	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	147.1	170.9	-85.6	176.7	170.8	168	0	110.4	Y526 F541 C542 P544 V546 Q547	K524-Y526 HydrophobicContact CB-CE2 4.2Å; K524-Y526 HydrophobicContact CD-CE2 4.36Å; K524-F541 WeakPolarHBondContact O-CA 3.29Å; K524-C542 HydrophobicContact CB-CB 4.38Å; K524-C542 PolarHBondContact N-O 3.19Å; K524-C542 PolarHBondContact O-N 3.12Å; K524-P544 VanDerWaalsContact CD-O 3.31Å; K524-P544 WeakPolarHBondContact CD-O 3.37Å; K524-P544 WeakPolarHBondContact CE-O 3.28Å; K524-P544 PolarHBondContact NZ-O 3.15Å; K524-V546 WeakPolarHBondContact CD-O 3.39Å; K524-V546 PolarHBondContact NZ-O 3.4Å; K524-Q547 VanDerWaalsContact NZ-OE1 3.15Å
525	V	89.5	Confident	76.3	Confident	68 Å²	68	65.6 Å²	65.6	41%	0.412	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	117.9	178.1	-173	0	0	0	0	110.9	A518 F540 F541	A518-V525 HydrophobicContact CB-CG2 3.64Å; V525-F540 WeakPolarHBondContact CA-O 3.33Å; V525-F541 HydrophobicContact CG1-CD1 4.47Å; V525-F541 HydrophobicContact CG1-CE1 4.18Å; V525-F541 HydrophobicContact CG2-CD1 3.7Å; V525-F541 HydrophobicContact CG2-CE1 3.75Å
526	Y	87.6	Confident	75.1	Confident	49 Å²	49	64.5 Å²	64.5	19%	0.192	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144.8	171.9	-65.1	-80.8	0	0	0	109.7	K524 F540 C542 V546 Q547 S548 L553	K524-Y526 HydrophobicContact CB-CE2 4.2Å; K524-Y526 HydrophobicContact CD-CE2 4.36Å; Y526-F540 PolarHBondContact N-O 3.16Å; Y526-F540 PolarHBondContact O-N 2.94Å; Y526-C542 HydrophobicContact CD2-CB 4.34Å; Y526-C542 HydrophobicContact CE2-CB 4.41Å; Y526-V546 HydrophobicContact CE2-CG1 4.06Å; Y526-V546 PolarHBondContact OH-O 3.42Å; Y526-Q547 VanDerWaalsContact OH-C 3.29Å; Y526-Q547 WeakPolarHBondContact OH-CA 3.46Å; Y526-S548 PolarHBondContact OH-N 3.28Å; Y526-L553 HydrophobicContact CD1-CD2 3.95Å; Y526-L553 HydrophobicContact CD2-CD1 4.18Å; Y526-L553 HydrophobicContact CD2-CD2 3.51Å; Y526-L553 HydrophobicContact CE1-CD2 4.2Å; Y526-L553 HydrophobicContact CE2-CD2 3.78Å; Y526-L553 HydrophobicContact CG-CD1 4.24Å; Y526-L553 HydrophobicContact CG-CD2 3.59Å
527	Q	82.1	Confident	74.4	Confident	110 Å²	110	65.4 Å²	65.4	51%	0.514	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124.4	-176.4	-171.9	-171.2	-107.2	0	0	110.9	A537 V538	Q527-A537 HydrophobicContact CG-CB 3.88Å; Q527-V538 WeakPolarHBondContact CA-O 3.24Å
528	T	78.8	Confident	73.9	Confident	7 Å²	7	67 Å²	67	4%	0.043	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	153.7	164.4	-162.8	0	0	0	0	110.9	L530 A537 V538 F540 A560 Q561	T528-L530 HydrophobicContact CG2-CD2 4.35Å; T528-A537 WeakPolarHBondContact O-CA 3.34Å; T528-V538 HydrophobicContact CG2-CB 4.12Å; T528-V538 PolarHBondContact N-O 3.03Å; T528-V538 VanDerWaalsContact N-O 3.15Å; T528-V538 PolarHBondContact O-N 3.13Å; T528-F540 HydrophobicContact CG2-CE2 3.77Å; T528-A560 HydrophobicContact CG2-CB 4.45Å; T528-Q561 PolarHBondContact OG1-NE2 3.21Å
529	I	70.2	Confident	73.8	Confident	66 Å²	66	68.2 Å²	68.2	34%	0.338	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.3	174.4	-65	166.8	0	0	0	107.6	N535 R583	I529-N535 VanDerWaalsContact CG2-OD1 3.31Å; I529-N535 WeakPolarHBondContact CG2-OD1 3.36Å; I529-R583 VanDerWaalsContact CG2-NH2 3.34Å
530	L	66.3	Low	73.9	Confident	22 Å²	22	64.5 Å²	64.5	12%	0.115	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	120.6	169	-56	-176.4	0	0	0	109.3	T528 D532 K536 V538 A560 Q561	T528-L530 HydrophobicContact CG2-CD2 4.35Å; L530-D532 PolarHBondContact O-N 3.36Å; L530-K536 HydrophobicContact CB-CB 4.27Å; L530-K536 WeakPolarHBondContact CB-O 3.22Å; L530-K536 HydrophobicContact CD1-CB 4.4Å; L530-K536 WeakPolarHBondContact CG-O 3.41Å; L530-K536 PolarHBondContact N-O 3.17Å; L530-K536 PolarHBondContact O-N 2.79Å; L530-V538 HydrophobicContact CD1-CG2 3.71Å; L530-V538 HydrophobicContact CD2-CG2 4.41Å; L530-V538 HydrophobicContact CG-CG2 3.91Å; L530-A560 HydrophobicContact CD2-CB 4.09Å; L530-A560 WeakPolarHBondContact CD2-O 3.43Å; L530-Q561 HydrophobicContact CD2-CG 4.45Å
531	L	52.8	Low	74.1	Confident	140 Å²	140	61.6 Å²	61.6	73%	0.733	31%	0.31	S	S	*	.			trans	-76.7	70.4	177.8	-65.4	173.7	0	0	0	110.5
532	D	50.2	Low	74.3	Confident	49 Å²	49	52.7 Å²	52.7	26%	0.262	27%	0.271	S	S	.	.	S	Bend	trans	-123.1	160.7	172.3	155.6	47.8	0	0	0	108.3	L530 R534 N535 K536	L530-D532 PolarHBondContact O-N 3.36Å; D532-R534 PolarHBondContact O-N 3.1Å; D532-N535 PolarHBondContact O-N 3.43Å; D532-K536 IonicContact OD2-NZ 3.84Å; D532-K536 PolarHBondContact OD2-NZ 3.29Å
533	S	42.7	Very low	74.4	Confident	85 Å²	85	51.1 Å²	51.1	59%	0.594	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.8	-2.5	170.9	65.7	0	0	0	0	117.8
534	R	49.8	Very low	74.2	Confident	101 Å²	101	53.4 Å²	53.4	38%	0.381	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.1	12.3	-178.9	-46.6	-167	176	-174	0.8	112.8	D532 K536	D532-R534 PolarHBondContact O-N 3.1Å; R534-K536 HydrophobicContact CB-CG 4.02Å; R534-K536 PolarHBondContact O-N 3.47Å
535	N	55.9	Low	74.1	Confident	79 Å²	79	55.6 Å²	55.6	42%	0.422	29%	0.293	S	S	.	.			trans	46.2	47.2	166.4	-133	-33	0	0	0	112.3	I529 D532 A537 R583	I529-N535 VanDerWaalsContact CG2-OD1 3.31Å; I529-N535 WeakPolarHBondContact CG2-OD1 3.36Å; D532-N535 PolarHBondContact O-N 3.43Å; N535-A537 PolarHBondContact O-N 3.29Å; N535-A537 VanDerWaalsContact O-N 3.17Å; N535-R583 VanDerWaalsContact CG-NH2 3.34Å; N535-R583 VanDerWaalsContact O-CZ 3.28Å; N535-R583 PolarHBondContact O-NE 3.08Å; N535-R583 PolarHBondContact O-NH2 3.18Å; N535-R583 PolarHBondContact OD1-NH2 3.22Å
536	K	60.2	Low	73.9	Confident	99 Å²	99	52.4 Å²	52.4	43%	0.43	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	107.9	-160.6	-59.3	-164.9	-163.1	84.5	0	111	L530 D532 R534 V538	L530-K536 HydrophobicContact CB-CB 4.27Å; L530-K536 WeakPolarHBondContact CB-O 3.22Å; L530-K536 HydrophobicContact CD1-CB 4.4Å; L530-K536 WeakPolarHBondContact CG-O 3.41Å; L530-K536 PolarHBondContact N-O 3.17Å; L530-K536 PolarHBondContact O-N 2.79Å; D532-K536 IonicContact OD2-NZ 3.84Å; D532-K536 PolarHBondContact OD2-NZ 3.29Å; R534-K536 HydrophobicContact CB-CG 4.02Å; R534-K536 PolarHBondContact O-N 3.47Å; K536-V538 PolarHBondContact O-N 3.13Å
537	A	73.6	Confident	73.7	Confident	32 Å²	32	55.1 Å²	55.1	26%	0.264	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	131.6	162.3	0	0	0	0	0	111.3	Q527 T528 N535	Q527-A537 HydrophobicContact CG-CB 3.88Å; T528-A537 WeakPolarHBondContact O-CA 3.34Å; N535-A537 PolarHBondContact O-N 3.29Å; N535-A537 VanDerWaalsContact O-N 3.17Å
538	V	79.5	Confident	73.7	Confident	35 Å²	35	53.8 Å²	53.8	21%	0.212	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.3	166.3	174.5	0	0	0	0	108	Q527 T528 L530 K536 F540	Q527-V538 WeakPolarHBondContact CA-O 3.24Å; T528-V538 HydrophobicContact CG2-CB 4.12Å; T528-V538 PolarHBondContact N-O 3.03Å; T528-V538 VanDerWaalsContact N-O 3.15Å; T528-V538 PolarHBondContact O-N 3.13Å; L530-V538 HydrophobicContact CD1-CG2 3.71Å; L530-V538 HydrophobicContact CD2-CG2 4.41Å; L530-V538 HydrophobicContact CG-CG2 3.91Å; K536-V538 PolarHBondContact O-N 3.13Å; V538-F540 HydrophobicContact CG1-CD2 4.45Å; V538-F540 HydrophobicContact CG1-CE1 4.45Å; V538-F540 HydrophobicContact CG1-CE2 4.01Å; V538-F540 HydrophobicContact CG1-CZ 4.01Å
539	E	86.4	Confident	73.8	Confident	52 Å²	52	59.3 Å²	59.3	24%	0.243	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.1	176.2	-58.6	166.8	150	0	0	109.3	R515 F541	R515-E539 IonicContact CZ-OE1 4Å; R515-E539 IonicContact NE-OE1 2.67Å; R515-E539 IonicContact NH2-OE1 3.71Å; R515-E539 PolarHBondContact NH2-OE1 2.86Å; R515-E539 IonicContact NH2-OE2 3.76Å; R515-E539 PolarHBondContact NH2-OE2 2.98Å; E539-F541 HydrophobicContact CB-CD2 4.38Å; E539-F541 HydrophobicContact CB-CE2 3.44Å; E539-F541 VanDerWaalsContact CB-CE2 3.44Å; E539-F541 HydrophobicContact CB-CZ 3.69Å; E539-F541 HydrophobicContact CG-CZ 4.42Å
540	F	89.7	Confident	74.6	Confident	3 Å²	3	57.4 Å²	57.4	1%	0.013	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.8	167.2	-64.2	-82.1	0	0	0	109	V482 T484 V525 Y526 T528 V538 L553 R556 M557 A560	V482-F540 HydrophobicContact CG1-CB 4.33Å; V482-F540 HydrophobicContact CG1-CD1 4.06Å; T484-F540 HydrophobicContact CG2-CD1 3.79Å; T484-F540 HydrophobicContact CG2-CE1 3.85Å; V525-F540 WeakPolarHBondContact CA-O 3.33Å; Y526-F540 PolarHBondContact N-O 3.16Å; Y526-F540 PolarHBondContact O-N 2.94Å; T528-F540 HydrophobicContact CG2-CE2 3.77Å; V538-F540 HydrophobicContact CG1-CD2 4.45Å; V538-F540 HydrophobicContact CG1-CE1 4.45Å; V538-F540 HydrophobicContact CG1-CE2 4.01Å; V538-F540 HydrophobicContact CG1-CZ 4.01Å; F540-L553 HydrophobicContact CB-CD1 4.16Å; F540-L553 HydrophobicContact CD2-CD1 4.5Å; F540-L553 HydrophobicContact CG-CD1 4.32Å; F540-R556 HydrophobicContact CE1-CB 3.93Å; F540-R556 HydrophobicContact CZ-CB 4.4Å; F540-M557 HydrophobicContact CD2-CG 4.01Å; F540-M557 HydrophobicContact CE2-CB 4.43Å; F540-M557 HydrophobicContact CE2-CG 3.57Å; F540-M557 HydrophobicContact CZ-CG 4.2Å; F540-A560 HydrophobicContact CZ-CB 4.17Å
541	F	90.5	Very high	75.4	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.009	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126.4	-178.7	-63.1	-90.6	0	0	0	107.8	V483 N485 L514 V523 K524 V525 E539	V483-F541 HydrophobicContact CG2-CB 4.18Å; V483-F541 PolarHBondContact N-O 3.04Å; V483-F541 PolarHBondContact O-N 3.19Å; N485-F541 HydrophobicContact CB-CE2 4.05Å; L514-F541 HydrophobicContact CB-CD1 3.99Å; L514-F541 HydrophobicContact CB-CE1 3.71Å; L514-F541 HydrophobicContact CB-CZ 4.06Å; L514-F541 HydrophobicContact CD1-CD1 4.45Å; L514-F541 HydrophobicContact CD1-CD2 3.99Å; L514-F541 HydrophobicContact CD1-CE1 4.42Å; L514-F541 HydrophobicContact CD1-CE2 3.94Å; L514-F541 HydrophobicContact CD1-CG 4.25Å; L514-F541 HydrophobicContact CD1-CZ 4.17Å; L514-F541 HydrophobicContact CD2-CB 4.14Å; L514-F541 HydrophobicContact CD2-CD1 3.86Å; L514-F541 HydrophobicContact CD2-CD2 4.41Å; L514-F541 HydrophobicContact CD2-CE1 4.43Å; L514-F541 HydrophobicContact CD2-CG 3.86Å; L514-F541 HydrophobicContact CG-CD1 4.33Å; L514-F541 HydrophobicContact CG-CE1 4.42Å; L514-F541 HydrophobicContact CG-CG 4.47Å; V523-F541 HydrophobicContact CG1-CB 3.81Å; V523-F541 HydrophobicContact CG1-CD1 4.09Å; V523-F541 HydrophobicContact CG1-CG 4.47Å; K524-F541 WeakPolarHBondContact O-CA 3.29Å; V525-F541 HydrophobicContact CG1-CD1 4.47Å; V525-F541 HydrophobicContact CG1-CE1 4.18Å; V525-F541 HydrophobicContact CG2-CD1 3.7Å; V525-F541 HydrophobicContact CG2-CE1 3.75Å; E539-F541 HydrophobicContact CB-CD2 4.38Å; E539-F541 HydrophobicContact CB-CE2 3.44Å; E539-F541 VanDerWaalsContact CB-CE2 3.44Å; E539-F541 HydrophobicContact CB-CZ 3.69Å; E539-F541 HydrophobicContact CG-CZ 4.42Å
542	C	90.1	Very high	77	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	156	-165.2	-53.7	0	0	0	0	112.3	V477 R481 K524 Y526 V546	V477-C542 VanDerWaalsContact CG1-C 3.46Å; R481-C542 WeakPolarHBondContact O-CA 3.14Å; R481-C542 WeakPolarHBondContact O-CB 3.48Å; K524-C542 HydrophobicContact CB-CB 4.38Å; K524-C542 PolarHBondContact N-O 3.19Å; K524-C542 PolarHBondContact O-N 3.12Å; Y526-C542 HydrophobicContact CD2-CB 4.34Å; Y526-C542 HydrophobicContact CE2-CB 4.41Å; C542-V546 HydrophobicContact CB-CB 3.81Å; C542-V546 HydrophobicContact CB-CG1 4.07Å; C542-V546 HydrophobicContact CB-CG2 3.96Å
543	S	89.2	Confident	78.7	Confident	7 Å²	7	54 Å²	54	5%	0.049	31%	0.306	C	S	.	.			trans	-54.1	145.4	169	-173.2	0	0	0	0	110.2	R481 D545 V546	R481-S543 PolarHBondContact O-N 3.19Å; S543-D545 PolarHBondContact O-N 3.18Å; S543-D545 PolarHBondContact OG-OD2 3.24Å; S543-V546 WeakPolarHBondContact O-CB 3.33Å; S543-V546 PolarHBondContact O-N 3.09Å
544	P	85.6	Confident	80.7	Confident	54 Å²	54	53.2 Å²	53.2	35%	0.351	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-27.1	170.8	-31	37.9	0	0	0	114.9	K524 V546	K524-P544 VanDerWaalsContact CD-O 3.31Å; K524-P544 WeakPolarHBondContact CD-O 3.37Å; K524-P544 WeakPolarHBondContact CE-O 3.28Å; K524-P544 PolarHBondContact NZ-O 3.15Å; P544-V546 VanDerWaalsContact C-N 3.33Å; P544-V546 PolarHBondContact O-N 2.9Å
545	D	84.8	Confident	82.3	Confident	108 Å²	108	51.2 Å²	51.2	58%	0.578	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-18.9	-179.5	-33.6	-61.7	0	0	0	113.6	S543 Q547	S543-D545 PolarHBondContact O-N 3.18Å; S543-D545 PolarHBondContact OG-OD2 3.24Å; D545-Q547 PolarHBondContact O-N 2.78Å
546	V	85	Confident	83.6	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	29%	0.294	C	S	.	.			trans	-71.6	124.1	-174.3	177.7	0	0	0	0	110.6	R481 V482 K524 Y526 C542 S543 P544 D550 L553	R481-V546 HydrophobicContact CB-CG2 4.43Å; V482-V546 HydrophobicContact CG2-CG1 4.38Å; V482-V546 HydrophobicContact CG2-CG2 4.48Å; K524-V546 WeakPolarHBondContact CD-O 3.39Å; K524-V546 PolarHBondContact NZ-O 3.4Å; Y526-V546 HydrophobicContact CE2-CG1 4.06Å; Y526-V546 PolarHBondContact OH-O 3.42Å; C542-V546 HydrophobicContact CB-CB 3.81Å; C542-V546 HydrophobicContact CB-CG1 4.07Å; C542-V546 HydrophobicContact CB-CG2 3.96Å; S543-V546 WeakPolarHBondContact O-CB 3.33Å; S543-V546 PolarHBondContact O-N 3.09Å; P544-V546 VanDerWaalsContact C-N 3.33Å; P544-V546 PolarHBondContact O-N 2.9Å; V546-D550 HydrophobicContact CG1-CB 3.86Å; V546-L553 HydrophobicContact CG1-CB 4.37Å; V546-L553 HydrophobicContact CG1-CD2 4.28Å
547	Q	84.1	Confident	84.7	Confident	105 Å²	105	48.4 Å²	48.4	49%	0.491	28%	0.283	S	S	.	.			trans	-96.5	162.9	176.7	-54.4	-60.4	9.2	0	0	111.4	K524 Y526 D545 N549 D550	K524-Q547 VanDerWaalsContact NZ-OE1 3.15Å; Y526-Q547 VanDerWaalsContact OH-C 3.29Å; Y526-Q547 WeakPolarHBondContact OH-CA 3.46Å; D545-Q547 PolarHBondContact O-N 2.78Å; Q547-N549 VanDerWaalsContact CB-OD1 3.23Å; Q547-N549 WeakPolarHBondContact CB-OD1 3.32Å; Q547-N549 PolarHBondContact O-N 2.77Å; Q547-N549 VanDerWaalsContact O-N 3.17Å; Q547-D550 WeakPolarHBondContact O-CB 3.47Å; Q547-D550 PolarHBondContact O-N 2.72Å; Q547-D550 VanDerWaalsContact O-N 3.1Å
548	S	81.3	Confident	84.9	Confident	83 Å²	83	55.3 Å²	55.3	58%	0.58	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-17.6	-176.8	49.9	0	0	0	0	114.4	Y526	Y526-S548 PolarHBondContact OH-N 3.28Å
549	N	82.6	Confident	84.8	Confident	122 Å²	122	60.4 Å²	60.4	65%	0.652	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	3.6	176.9	63.1	-19.7	0	0	0	113.8	Q547 A551	Q547-N549 VanDerWaalsContact CB-OD1 3.23Å; Q547-N549 WeakPolarHBondContact CB-OD1 3.32Å; Q547-N549 PolarHBondContact O-N 2.77Å; Q547-N549 VanDerWaalsContact O-N 3.17Å; N549-A551 PolarHBondContact O-N 3.02Å
550	D	86.3	Confident	84	Confident	27 Å²	27	58.9 Å²	58.9	14%	0.144	32%	0.318	C	S	.	.			trans	-57.6	125.9	178.9	165.4	49.8	0	0	0	111.7	V546 Q547 T552 L553 L554	V546-D550 HydrophobicContact CG1-CB 3.86Å; Q547-D550 WeakPolarHBondContact O-CB 3.47Å; Q547-D550 PolarHBondContact O-N 2.72Å; Q547-D550 VanDerWaalsContact O-N 3.1Å; D550-T552 PolarHBondContact O-N 3.3Å; D550-T552 PolarHBondContact OD1-N 2.86Å; D550-T552 PolarHBondContact OD1-OG1 3.31Å; D550-T552 VanDerWaalsContact OD2-CB 3.22Å; D550-T552 WeakPolarHBondContact OD2-CB 3.18Å; D550-T552 PolarHBondContact OD2-N 2.93Å; D550-L553 HydrophobicContact CB-CB 4.12Å; D550-L553 PolarHBondContact O-N 3.43Å; D550-L553 WeakPolarHBondContact OD2-CB 3.44Å; D550-L553 PolarHBondContact OD2-N 3.13Å; D550-L554 WeakPolarHBondContact O-CG 3.3Å; D550-L554 PolarHBondContact O-N 3.29Å
551	A	83.5	Confident	82.9	Confident	74 Å²	74	63 Å²	63	61%	0.612	34%	0.337	S	S	*	.	H	α-helix	trans	-58.7	-34.2	-179.2	0	0	0	0	0	112.3	N549 A555	N549-A551 PolarHBondContact O-N 3.02Å; A551-A555 VanDerWaalsContact O-CB 3.22Å; A551-A555 WeakPolarHBondContact O-CB 3.5Å; A551-A555 PolarHBondContact O-N 3.03Å
552	T	85	Confident	81.5	Confident	64 Å²	64	69.4 Å²	69.4	39%	0.393	37%	0.371	S	S	.	.	H	α-helix	trans	-66.9	-49.5	178.7	-42.8	0	0	0	0	110.8	V482 D550 R556	V482-T552 HydrophobicContact CG2-CG2 4.35Å; D550-T552 PolarHBondContact O-N 3.3Å; D550-T552 PolarHBondContact OD1-N 2.86Å; D550-T552 PolarHBondContact OD1-OG1 3.31Å; D550-T552 VanDerWaalsContact OD2-CB 3.22Å; D550-T552 WeakPolarHBondContact OD2-CB 3.18Å; D550-T552 PolarHBondContact OD2-N 2.93Å; T552-R556 WeakPolarHBondContact O-CB 3.39Å; T552-R556 VanDerWaalsContact O-CG 3.32Å; T552-R556 WeakPolarHBondContact O-CG 3.31Å; T552-R556 PolarHBondContact O-N 2.91Å
553	L	86	Confident	80	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-56.6	-51.7	174	175.7	62.7	0	0	0	111.7	V482 Y526 F540 V546 D550 A555 R556 M557	V482-L553 HydrophobicContact CG1-CD1 4.14Å; V482-L553 HydrophobicContact CG2-CB 4.26Å; Y526-L553 HydrophobicContact CD1-CD2 3.95Å; Y526-L553 HydrophobicContact CD2-CD1 4.18Å; Y526-L553 HydrophobicContact CD2-CD2 3.51Å; Y526-L553 HydrophobicContact CE1-CD2 4.2Å; Y526-L553 HydrophobicContact CE2-CD2 3.78Å; Y526-L553 HydrophobicContact CG-CD1 4.24Å; Y526-L553 HydrophobicContact CG-CD2 3.59Å; F540-L553 HydrophobicContact CB-CD1 4.16Å; F540-L553 HydrophobicContact CD2-CD1 4.5Å; F540-L553 HydrophobicContact CG-CD1 4.32Å; V546-L553 HydrophobicContact CG1-CB 4.37Å; V546-L553 HydrophobicContact CG1-CD2 4.28Å; D550-L553 HydrophobicContact CB-CB 4.12Å; D550-L553 PolarHBondContact O-N 3.43Å; D550-L553 WeakPolarHBondContact OD2-CB 3.44Å; D550-L553 PolarHBondContact OD2-N 3.13Å; L553-A555 PolarHBondContact O-N 3.09Å; L553-R556 PolarHBondContact O-N 2.91Å; L553-M557 HydrophobicContact CD1-CG 4.24Å; L553-M557 HydrophobicContact CD1-SD 3.93Å; L553-M557 HydrophobicContact CG-SD 3.87Å; L553-M557 WeakPolarHBondContact O-CG 3.49Å; L553-M557 PolarHBondContact O-N 3.32Å
554	L	84.7	Confident	77.9	Confident	69 Å²	69	78.7 Å²	78.7	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-42.3	-178	-69.2	175	0	0	0	112.5	D550 R556 M557 R558	D550-L554 WeakPolarHBondContact O-CG 3.3Å; D550-L554 PolarHBondContact O-N 3.29Å; L554-R556 VanDerWaalsContact C-N 3.35Å; L554-R556 PolarHBondContact O-N 3.27Å; L554-M557 PolarHBondContact O-N 3.33Å; L554-R558 WeakPolarHBondContact O-CG 3.42Å; L554-R558 PolarHBondContact O-N 3.06Å
555	A	83.8	Confident	75.5	Confident	59 Å²	59	81 Å²	81	49%	0.488	43%	0.431	S	S	.	.	H	α-helix	trans	-62.3	-41.3	174.9	0	0	0	0	0	111.9	A551 L553 K559	A551-A555 VanDerWaalsContact O-CB 3.22Å; A551-A555 WeakPolarHBondContact O-CB 3.5Å; A551-A555 PolarHBondContact O-N 3.03Å; L553-A555 PolarHBondContact O-N 3.09Å; A555-K559 VanDerWaalsContact O-CB 3.28Å; A555-K559 WeakPolarHBondContact O-CB 3.34Å; A555-K559 PolarHBondContact O-N 2.87Å
556	R	83.2	Confident	73.1	Confident	79 Å²	79	79.6 Å²	79.6	30%	0.298	43%	0.428	S	S	.	.	H	α-helix	trans	-68.3	-35.1	176	-69.7	-163.1	69.8	145.5	15.5	112.7	V482 E487 F540 T552 L553 L554 A560	V482-R556 PolarHBondContact O-NH1 3.05Å; E487-R556 IonicContact OE1-CZ 2.74Å; E487-R556 VanDerWaalsContact OE1-CZ 3.27Å; E487-R556 IonicContact OE1-NH1 2.85Å; E487-R556 PolarHBondContact OE1-NH1 3.07Å; E487-R556 IonicContact OE1-NH2 3.8Å; E487-R556 PolarHBondContact OE1-NH2 3.34Å; E487-R556 IonicContact OE2-CZ 2.94Å; E487-R556 IonicContact OE2-NH1 2.83Å; E487-R556 IonicContact OE2-NH2 3.14Å; E487-R556 PolarHBondContact OE2-NH2 2.98Å; F540-R556 HydrophobicContact CE1-CB 3.93Å; F540-R556 HydrophobicContact CZ-CB 4.4Å; T552-R556 WeakPolarHBondContact O-CB 3.39Å; T552-R556 VanDerWaalsContact O-CG 3.32Å; T552-R556 WeakPolarHBondContact O-CG 3.31Å; T552-R556 PolarHBondContact O-N 2.91Å; L553-R556 PolarHBondContact O-N 2.91Å; L554-R556 VanDerWaalsContact C-N 3.35Å; L554-R556 PolarHBondContact O-N 3.27Å; R556-A560 PolarHBondContact O-N 2.86Å; R556-A560 VanDerWaalsContact O-N 3.14Å
557	M	83.2	Confident	70.6	Confident	40 Å²	40	85.3 Å²	85.3	20%	0.197	47%	0.468	C	S	.	.	H	α-helix	trans	-65.4	-49.8	173.3	-72.7	171.8	71.3	0	0	111.7	F540 L553 L554 K559 A560 Q561	F540-M557 HydrophobicContact CD2-CG 4.01Å; F540-M557 HydrophobicContact CE2-CB 4.43Å; F540-M557 HydrophobicContact CE2-CG 3.57Å; F540-M557 HydrophobicContact CZ-CG 4.2Å; L553-M557 HydrophobicContact CD1-CG 4.24Å; L553-M557 HydrophobicContact CD1-SD 3.93Å; L553-M557 HydrophobicContact CG-SD 3.87Å; L553-M557 WeakPolarHBondContact O-CG 3.49Å; L553-M557 PolarHBondContact O-N 3.32Å; L554-M557 PolarHBondContact O-N 3.33Å; M557-K559 PolarHBondContact O-N 3.18Å; M557-A560 WeakPolarHBondContact O-CB 3.26Å; M557-A560 PolarHBondContact O-N 3.12Å; M557-A560 VanDerWaalsContact O-N 3.11Å; M557-Q561 WeakPolarHBondContact O-CG 3.5Å; M557-Q561 PolarHBondContact O-N 3.24Å
558	R	77.3	Confident	68.1	Low	176 Å²	176	87 Å²	87	66%	0.664	48%	0.48	S	S	*	.	H	α-helix	trans	-57.4	-46.5	175.6	-73	176.9	176.2	173.8	-1.2	111.8	L554 A560 Q561 L562	L554-R558 WeakPolarHBondContact O-CG 3.42Å; L554-R558 PolarHBondContact O-N 3.06Å; R558-A560 PolarHBondContact O-N 2.93Å; R558-Q561 PolarHBondContact O-N 3.07Å; R558-Q561 VanDerWaalsContact O-N 3.17Å; R558-L562 WeakPolarHBondContact O-CG 3.49Å; R558-L562 PolarHBondContact O-N 3.09Å
559	K	78.2	Confident	65.8	Low	143 Å²	143	89.2 Å²	89.2	62%	0.622	49%	0.49	S	S	*	.	H	α-helix	trans	-65.3	-21.2	178.2	-167.4	166.8	-173.2	167.1	0	113.6	A555 M557 K563	A555-K559 VanDerWaalsContact O-CB 3.28Å; A555-K559 WeakPolarHBondContact O-CB 3.34Å; A555-K559 PolarHBondContact O-N 2.87Å; M557-K559 PolarHBondContact O-N 3.18Å; K559-K563 WeakPolarHBondContact O-CG 3.26Å
560	A	69.3	Low	63.5	Low	20 Å²	20	90.9 Å²	90.9	17%	0.165	50%	0.499	C	S	.	.	H	α-helix	trans	-80.3	-44.7	170.8	0	0	0	0	0	111.8	T528 L530 F540 R556 M557 R558 K563	T528-A560 HydrophobicContact CG2-CB 4.45Å; L530-A560 HydrophobicContact CD2-CB 4.09Å; L530-A560 WeakPolarHBondContact CD2-O 3.43Å; F540-A560 HydrophobicContact CZ-CB 4.17Å; R556-A560 PolarHBondContact O-N 2.86Å; R556-A560 VanDerWaalsContact O-N 3.14Å; M557-A560 WeakPolarHBondContact O-CB 3.26Å; M557-A560 PolarHBondContact O-N 3.12Å; M557-A560 VanDerWaalsContact O-N 3.11Å; R558-A560 PolarHBondContact O-N 2.93Å; A560-K563 PolarHBondContact O-N 3.23Å
561	Q	66.7	Low	61	Low	88 Å²	88	97.7 Å²	97.7	41%	0.411	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-47.6	178.3	-70.5	165.4	-37.9	0	0	112.1	T528 L530 M557 R558 K563 S564	T528-Q561 PolarHBondContact OG1-NE2 3.21Å; L530-Q561 HydrophobicContact CD2-CG 4.45Å; M557-Q561 WeakPolarHBondContact O-CG 3.5Å; M557-Q561 PolarHBondContact O-N 3.24Å; R558-Q561 PolarHBondContact O-N 3.07Å; R558-Q561 VanDerWaalsContact O-N 3.17Å; Q561-K563 PolarHBondContact O-N 3.36Å; Q561-S564 PolarHBondContact O-N 3.09Å; Q561-S564 PolarHBondContact O-OG 3.22Å
562	L	62.6	Low	58.7	Low	138 Å²	138	99.2 Å²	99.2	72%	0.723	54%	0.539	S	S	*	.	H	α-helix	trans	-55.5	-34.2	177.4	-76.2	163.2	0	0	0	113	R558 S564	R558-L562 WeakPolarHBondContact O-CG 3.49Å; R558-L562 PolarHBondContact O-N 3.09Å; L562-S564 PolarHBondContact O-N 3.44Å; L562-S564 VanDerWaalsContact O-N 3.15Å
563	K	57	Low	56.3	Low	176 Å²	176	100.3 Å²	100.3	77%	0.765	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	7.6	176.6	-72.4	-173.7	175.4	-169.5	0	114.5	K559 A560 Q561	K559-K563 WeakPolarHBondContact O-CG 3.26Å; A560-K563 PolarHBondContact O-N 3.23Å; Q561-K563 PolarHBondContact O-N 3.36Å
564	S	46.3	Very low	53.8	Low	25 Å²	25	107.2 Å²	107.2	18%	0.175	60%	0.597	C	S	.	*	T	Hydrogen-bonded Turn	trans	-128.6	2.6	179.8	57.7	0	0	0	0	115.3	Q561 L562 P566	Q561-S564 PolarHBondContact O-N 3.09Å; Q561-S564 PolarHBondContact O-OG 3.22Å; L562-S564 PolarHBondContact O-N 3.44Å; L562-S564 VanDerWaalsContact O-N 3.15Å; S564-P566 WeakPolarHBondContact O-CD 3.42Å
565	S	33.5	Very low	51.3	Low	103 Å²	103	108.4 Å²	108.4	72%	0.72	62%	0.616	S	S	*	*			trans	-67	125.4	-178	-156.3	0	0	0	0	111.9
566	P	35.8	Very low	48.7	Very low	79 Å²	79	111.7 Å²	111.7	51%	0.513	63%	0.633	S	S	.	*			trans	-98.3	154.8	177.5	37.1	-32.5	0	0	0	112.6	S564 N568	S564-P566 WeakPolarHBondContact O-CD 3.42Å; P566-N568 PolarHBondContact O-N 3.09Å
567	S	31.2	Very low	46.2	Very low	121 Å²	121	118 Å²	118	85%	0.846	66%	0.662	S	S	*	*	S	Bend	trans	-74.7	27	178.5	-44.4	0	0	0	0	115.2
568	N	33.6	Very low	43.9	Very low	139 Å²	139	125.1 Å²	125.1	74%	0.743	70%	0.695	S	S	*	*			trans	-118	58.3	-172.1	-74	28.9	0	0	0	111.6	P566 L570	P566-N568 PolarHBondContact O-N 3.09Å; N568-L570 PolarHBondContact O-N 3.27Å
569	T	32.2	Very low	41.6	Very low	130 Å²	130	121.8 Å²	121.8	80%	0.798	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	11.4	-168.5	-21	0	0	0	0	115.9
570	L	34.5	Very low	39.5	Very low	158 Å²	158	118.6 Å²	118.6	83%	0.827	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	5.1	-154.1	-81.5	167.8	0	0	0	117.7	N568	N568-L570 PolarHBondContact O-N 3.27Å
571	K	34.5	Very low	37.8	Very low	169 Å²	169	120.3 Å²	120.3	74%	0.735	71%	0.708	S	S	*	*			trans	-135.8	46.8	177.5	-63.6	-162.8	177.9	-166.6	0	113.5
572	A	35.1	Very low	36.4	Very low	106 Å²	106	118.9 Å²	118.9	88%	0.876	71%	0.707	S	S	*	*			trans	-103.4	9	-175.8	0	0	0	0	0	114.9
573	A	33.9	Very low	35.1	Very low	87 Å²	87	115.1 Å²	115.1	72%	0.719	68%	0.683	S	S	*	*			trans	-105.9	149	174.8	0	0	0	0	0	111.1
574	V	33.3	Very low	34	Very low	147 Å²	147	113.7 Å²	113.7	89%	0.891	68%	0.677	S	S	*	*	S	Bend	trans	76.4	139.4	178.2	-168	0	0	0	0	116.1
575	A	31.7	Very low	33.4	Very low	93 Å²	93	114.4 Å²	114.4	77%	0.769	68%	0.68	S	S	*	*			trans	75.4	145.8	174.1	0	0	0	0	0	119.3
576	P	30.7	Very low	33.3	Very low	129 Å²	129	112.5 Å²	112.5	84%	0.838	66%	0.66	S	S	*	*			trans	-109.5	-179.6	-156.8	9.6	15.4	0	0	0	115.6
577	K	30.1	Very low	33.2	Very low	210 Å²	210	115.5 Å²	115.5	91%	0.913	67%	0.665	S	S	*	*			trans	-78.5	136.8	-169.3	-59	160.6	-174.6	163.5	0	113.2
578	Q	34.6	Very low	33.3	Very low	190 Å²	190	114.2 Å²	114.2	89%	0.888	65%	0.652	S	S	*	*			trans	-118.2	160.4	168.2	-86.8	-168	-5.4	0	0	112.8
579	P	29.4	Very low	33.3	Very low	107 Å²	107	109.8 Å²	109.8	70%	0.695	63%	0.63	S	S	*	*			trans	-83.9	-178.8	-160.2	32.7	-36.7	0	0	0	116.6	S581	P579-S581 PolarHBondContact O-N 3.12Å
580	A	33.3	Very low	33.4	Very low	75 Å²	75	107 Å²	107	62%	0.62	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-2.2	-154	0	0	0	0	0	117.8
581	S	34.1	Very low	33.2	Very low	57 Å²	57	106.1 Å²	106.1	40%	0.399	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.4	-37.1	-173.3	64.8	0	0	0	0	113.6	P579 R583 K584 E1510 K1511	P579-S581 PolarHBondContact O-N 3.12Å; S581-R583 VanDerWaalsContact C-N 3.29Å; S581-R583 PolarHBondContact O-N 3.42Å; S581-K584 PolarHBondContact O-N 3.14Å; S581-E1510 WeakPolarHBondContact CB-OE1 3.46Å; S581-E1510 WeakPolarHBondContact CB-OE2 3.43Å; S581-E1510 PolarHBondContact OG-OE1 3.21Å; S581-K1511 PolarHBondContact O-NZ 2.8Å
582	S	36.1	Very low	33	Very low	58 Å²	58	101.3 Å²	101.3	41%	0.406	58%	0.584	S	S	.	*	H	α-helix	trans	-51.9	-36.6	179.8	58.3	0	0	0	0	114.5	K584 V585 E586	S582-K584 PolarHBondContact O-N 3.47Å; S582-V585 WeakPolarHBondContact O-CB 3.27Å; S582-V585 PolarHBondContact O-N 3.02Å; S582-E586 PolarHBondContact O-N 3.29Å
583	R	37.3	Very low	32.9	Very low	58 Å²	58	99.9 Å²	99.9	22%	0.219	56%	0.557	C	S	.	*	H	α-helix	trans	-61.4	-16	-179.4	-71.8	-179.5	173.3	179.3	-3.5	114.2	I529 N535 S581	I529-R583 VanDerWaalsContact CG2-NH2 3.34Å; N535-R583 VanDerWaalsContact CG-NH2 3.34Å; N535-R583 VanDerWaalsContact O-CZ 3.28Å; N535-R583 PolarHBondContact O-NE 3.08Å; N535-R583 PolarHBondContact O-NH2 3.18Å; N535-R583 PolarHBondContact OD1-NH2 3.22Å; S581-R583 VanDerWaalsContact C-N 3.29Å; S581-R583 PolarHBondContact O-N 3.42Å
584	K	32.7	Very low	33	Very low	146 Å²	146	99.6 Å²	99.6	64%	0.635	55%	0.554	S	S	*	*	H	α-helix	trans	-81.1	-38.8	170.5	-72.8	176.7	-177.7	168.1	0	111.9	S581 S582 K587 K1511	S581-K584 PolarHBondContact O-N 3.14Å; S582-K584 PolarHBondContact O-N 3.47Å; K584-K587 PolarHBondContact O-N 3.06Å; K584-K1511 HydrophobicContact CB-CD 3.78Å; K584-K1511 HydrophobicContact CD-CD 4.3Å
585	V	33.2	Very low	33.1	Very low	40 Å²	40	100.4 Å²	100.4	24%	0.242	55%	0.546	C	S	.	.	H	α-helix	trans	-59.9	-52.1	179.1	-174.5	0	0	0	0	109.9	S582 K587 V588 V589 E1509	S582-V585 WeakPolarHBondContact O-CB 3.27Å; S582-V585 PolarHBondContact O-N 3.02Å; V585-K587 PolarHBondContact O-N 3.22Å; V585-V588 PolarHBondContact O-N 3.11Å; V585-V589 HydrophobicContact CG1-CG2 3.89Å; V585-V589 WeakPolarHBondContact O-CB 3.31Å; V585-V589 WeakPolarHBondContact O-CG2 3.48Å; V585-V589 PolarHBondContact O-N 3.19Å; V585-E1509 HydrophobicContact CG2-CG 4.27Å
586	E	32.5	Very low	33.5	Very low	64 Å²	64	100 Å²	100	30%	0.299	53%	0.526	S	S	.	.	H	α-helix	trans	-43.7	-43.3	175.5	-82.8	-124.6	121.4	0	0	114.3	S582 K590	S582-E586 PolarHBondContact O-N 3.29Å; E586-K590 VanDerWaalsContact O-CB 3.23Å; E586-K590 WeakPolarHBondContact O-CB 3.47Å; E586-K590 WeakPolarHBondContact O-CD 3.32Å; E586-K590 WeakPolarHBondContact O-CG 3.45Å; E586-K590 PolarHBondContact O-N 3.27Å; E586-K590 VanDerWaalsContact OE1-CE 3.27Å; E586-K590 WeakPolarHBondContact OE1-CE 3.48Å; E586-K590 IonicContact OE1-NZ 2.7Å; E586-K590 PolarHBondContact OE1-NZ 3.26Å; E586-K590 IonicContact OE2-NZ 3.18Å; E586-K590 PolarHBondContact OE2-NZ 3.22Å
587	K	33.2	Very low	34.3	Very low	141 Å²	141	104.5 Å²	104.5	61%	0.613	53%	0.527	S	S	*	.	H	α-helix	trans	-78.8	-20.2	-174.6	-73.1	173.9	-179.4	168.3	0	112.9	K584 V585	K584-K587 PolarHBondContact O-N 3.06Å; V585-K587 PolarHBondContact O-N 3.22Å
588	V	33.3	Very low	35.4	Very low	94 Å²	94	95.5 Å²	95.5	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-84.2	-50.4	171.1	-179.8	0	0	0	0	109.4	V585 K590 K591 S592	V585-V588 PolarHBondContact O-N 3.11Å; V588-K590 PolarHBondContact O-N 2.74Å; V588-K591 WeakPolarHBondContact O-CA 3.43Å; V588-K591 WeakPolarHBondContact O-CB 3.32Å; V588-K591 PolarHBondContact O-N 2.86Å; V588-S592 PolarHBondContact O-N 2.99Å; V588-S592 VanDerWaalsContact O-N 3.1Å; V588-S592 PolarHBondContact O-OG 2.95Å
589	V	33	Very low	36.7	Very low	46 Å²	46	87 Å²	87	28%	0.279	45%	0.452	S	S	.	.	H	α-helix	trans	-44.4	-59.5	169.8	162.3	0	0	0	0	110.9	V585 K591 S592 Y593	V585-V589 HydrophobicContact CG1-CG2 3.89Å; V585-V589 WeakPolarHBondContact O-CB 3.31Å; V585-V589 WeakPolarHBondContact O-CG2 3.48Å; V585-V589 PolarHBondContact O-N 3.19Å; V589-K591 PolarHBondContact O-N 2.78Å; V589-S592 PolarHBondContact O-N 3.41Å; V589-Y593 HydrophobicContact CB-CE2 4.22Å; V589-Y593 HydrophobicContact CG1-CD2 3.92Å; V589-Y593 HydrophobicContact CG1-CE2 3.65Å; V589-Y593 HydrophobicContact CG2-CE2 4.34Å; V589-Y593 WeakPolarHBondContact O-CD2 3.42Å; V589-Y593 PolarHBondContact O-N 3.19Å
590	K	34.5	Very low	38.9	Very low	73 Å²	73	82.1 Å²	82.1	32%	0.317	42%	0.42	S	S	.	.	H	α-helix	trans	-64.2	-13.7	-177.4	-67.9	167.3	-171.6	179.6	0	113.9	E586 V588	E586-K590 VanDerWaalsContact O-CB 3.23Å; E586-K590 WeakPolarHBondContact O-CB 3.47Å; E586-K590 WeakPolarHBondContact O-CD 3.32Å; E586-K590 WeakPolarHBondContact O-CG 3.45Å; E586-K590 PolarHBondContact O-N 3.27Å; E586-K590 VanDerWaalsContact OE1-CE 3.27Å; E586-K590 WeakPolarHBondContact OE1-CE 3.48Å; E586-K590 IonicContact OE1-NZ 2.7Å; E586-K590 PolarHBondContact OE1-NZ 3.26Å; E586-K590 IonicContact OE2-NZ 3.18Å; E586-K590 PolarHBondContact OE2-NZ 3.22Å; V588-K590 PolarHBondContact O-N 2.74Å
591	K	31	Very low	41.2	Very low	138 Å²	138	78.9 Å²	78.9	60%	0.6	39%	0.394	S	S	*	.	H	α-helix	trans	-93.5	-18.1	171.5	-83.6	176.5	178.4	168.4	0	114.6	V588 V589 K595	V588-K591 WeakPolarHBondContact O-CA 3.43Å; V588-K591 WeakPolarHBondContact O-CB 3.32Å; V588-K591 PolarHBondContact O-N 2.86Å; V589-K591 PolarHBondContact O-N 2.78Å; K591-K595 PolarHBondContact O-NZ 3.22Å
592	S	29.8	Very low	43.7	Very low	69 Å²	69	77.7 Å²	77.7	48%	0.483	38%	0.382	S	S	.	.	H	α-helix	trans	-88.5	-48.7	176.5	-69.6	0	0	0	0	111.5	V588 V589 A594 K595	V588-S592 PolarHBondContact O-N 2.99Å; V588-S592 VanDerWaalsContact O-N 3.1Å; V588-S592 PolarHBondContact O-OG 2.95Å; V589-S592 PolarHBondContact O-N 3.41Å; S592-A594 VanDerWaalsContact C-N 3.3Å; S592-A594 PolarHBondContact O-N 2.91Å; S592-K595 PolarHBondContact O-N 3.35Å
593	Y	34.1	Very low	46.4	Very low	75 Å²	75	74.9 Å²	74.9	29%	0.294	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-65.5	-36.9	-175.2	-70.9	-132.1	0	0	0	110.5	V589 K595 K596 E692 Y721	V589-Y593 HydrophobicContact CB-CE2 4.22Å; V589-Y593 HydrophobicContact CG1-CD2 3.92Å; V589-Y593 HydrophobicContact CG1-CE2 3.65Å; V589-Y593 HydrophobicContact CG2-CE2 4.34Å; V589-Y593 WeakPolarHBondContact O-CD2 3.42Å; V589-Y593 PolarHBondContact O-N 3.19Å; Y593-K595 PolarHBondContact O-N 3.23Å; Y593-K596 PolarHBondContact O-N 3Å; Y593-K596 VanDerWaalsContact O-N 3.09Å; Y593-E692 PolarHBondContact OH-OE2 2.66Å; Y593-Y721 AromaticContact CE1-CE1 3.87Å; Y593-Y721 HydrophobicContact CE1-CE1 3.87Å
594	A	34	Very low	48.9	Very low	81 Å²	81	72.2 Å²	72.2	67%	0.669	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-59.5	-2.8	173.5	0	0	0	0	0	115.8	S592	S592-A594 VanDerWaalsContact C-N 3.3Å; S592-A594 PolarHBondContact O-N 2.91Å
595	K	36.3	Very low	51.6	Low	164 Å²	164	66.7 Å²	66.7	71%	0.713	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-117.9	-13.4	175.1	-67.7	176.7	-166.5	111.6	0	114.5	K591 S592 Y593 R597	K591-K595 PolarHBondContact O-NZ 3.22Å; S592-K595 PolarHBondContact O-N 3.35Å; Y593-K595 PolarHBondContact O-N 3.23Å; K595-R597 PolarHBondContact O-N 3.49Å; K595-R597 VanDerWaalsContact O-N 3.13Å
596	K	39.9	Very low	54.5	Low	84 Å²	84	64.9 Å²	64.9	37%	0.365	32%	0.316	S	S	.	.	S	Bend	trans	-66.3	112.1	169.4	-80	-179.7	169.8	178.7	0	106.7	Y593 E691	Y593-K596 PolarHBondContact O-N 3Å; Y593-K596 VanDerWaalsContact O-N 3.09Å; K596-E691 WeakPolarHBondContact CE-OE2 3.27Å; K596-E691 IonicContact NZ-OE2 3.05Å; K596-E691 PolarHBondContact NZ-OE2 2.93Å
597	R	46.8	Very low	57.4	Low	224 Å²	224	62.2 Å²	62.2	85%	0.845	30%	0.304	S	S	*	.			trans	-65.3	155.1	173.3	-73.4	-178.5	176.5	165.3	-1.1	108.7	K595	K595-R597 PolarHBondContact O-N 3.49Å; K595-R597 VanDerWaalsContact O-N 3.13Å
598	S	54.4	Low	60.2	Low	21 Å²	21	56.2 Å²	56.2	15%	0.147	28%	0.278	C	S	.	.			trans	-46.4	144.8	166.6	49	0	0	0	0	110.7	Q600 R605	S598-Q600 VanDerWaalsContact C-N 3.31Å; S598-Q600 WeakPolarHBondContact CB-O 3.48Å; S598-Q600 PolarHBondContact OG-O 3.42Å; S598-R605 VanDerWaalsContact CB-NE 3.26Å; S598-R605 VanDerWaalsContact OG-CZ 3.28Å; S598-R605 PolarHBondContact OG-NE 3.41Å; S598-R605 PolarHBondContact OG-NH2 2.91Å
599	S	62.4	Low	63.1	Low	13 Å²	13	51.7 Å²	51.7	9%	0.091	25%	0.251	C	S	.	.	S	Bend	trans	-60	-49.7	171.3	53.3	0	0	0	0	109.1	N880 E886	S599-N880 VanDerWaalsContact C-ND2 3.32Å; S599-N880 VanDerWaalsContact CA-ND2 3.35Å; S599-N880 WeakPolarHBondContact CA-ND2 3.34Å; S599-N880 WeakPolarHBondContact CB-ND2 3.33Å; S599-N880 WeakPolarHBondContact O-CB 3.27Å; S599-N880 PolarHBondContact O-ND2 3.42Å; S599-E886 WeakPolarHBondContact CB-OE1 3.16Å; S599-E886 PolarHBondContact OG-OE1 3.47Å
600	Q	75.5	Confident	66.1	Low	3 Å²	3	49.5 Å²	49.5	1%	0.014	24%	0.238	C	C	.	.	S	Bend	trans	-75.9	154.8	178.9	-61.7	-60.2	5.4	0	0	114.4	S598 V604 R605 Q685	S598-Q600 VanDerWaalsContact C-N 3.31Å; S598-Q600 WeakPolarHBondContact CB-O 3.48Å; S598-Q600 PolarHBondContact OG-O 3.42Å; Q600-V604 HydrophobicContact CB-CB 4.35Å; Q600-V604 HydrophobicContact CB-CG1 4.12Å; Q600-V604 HydrophobicContact CG-CG1 4.25Å; Q600-R605 HydrophobicContact CB-CG 3.73Å; Q600-R605 PolarHBondContact O-NE 3.26Å; Q600-Q685 HydrophobicContact CG-CB 3.85Å; Q600-Q685 HydrophobicContact CG-CG 4.36Å; Q600-Q685 WeakPolarHBondContact CG-O 3.39Å
601	G	81	Confident	68.9	Low	7 Å²	7	46.7 Å²	46.7	7%	0.072	23%	0.226	C	C	.	.			trans	-55.8	175.4	173.8	0	0	0	0	0	114.5	R605 N876 V878	G601-R605 PolarHBondContact O-NE 3.42Å; G601-N876 CarbonylContact C-O 3.44Å; G601-V878 WeakPolarHBondContact CA-O 3.23Å; G601-V878 PolarHBondContact N-O 3.43Å
602	K	87.4	Confident	71.9	Confident	32 Å²	32	40.1 Å²	40.1	14%	0.139	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-44.5	178.8	173	-178.5	169.1	-171.7	0	112.1	M606 M869 N876	K602-M606 HydrophobicContact CD-CE 4.34Å; K602-M606 HydrophobicContact CG-CE 3.71Å; K602-M606 WeakPolarHBondContact O-CE 3.41Å; K602-M869 VanDerWaalsContact NZ-CA 3.29Å; K602-M869 PolarHBondContact NZ-O 3.41Å; K602-M869 PolarHBondContact NZ-SD 2.66Å; K602-N876 HydrophobicContact CB-CB 3.96Å; K602-N876 PolarHBondContact N-O 3.11Å
603	F	91.2	Very high	74.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-33.8	-179.6	-65.6	-82.3	0	0	0	112.1	R605 M606 Q607 L741 W806 M869 A871 N876 W877	F603-R605 PolarHBondContact O-N 3.2Å; F603-M606 HydrophobicContact CD1-CE 3.41Å; F603-M606 VanDerWaalsContact CD1-CE 3.41Å; F603-M606 HydrophobicContact CE1-CE 3.59Å; F603-M606 HydrophobicContact CG-CE 4.01Å; F603-M606 HydrophobicContact CZ-CE 4.28Å; F603-M606 CarbonylContact O-C 3.56Å; F603-M606 WeakPolarHBondContact O-CA 3.46Å; F603-M606 PolarHBondContact O-N 2.92Å; F603-Q607 PolarHBondContact O-N 2.85Å; F603-L741 HydrophobicContact CE1-CD2 4.33Å; F603-W806 HydrophobicContact CB-CZ3 4.17Å; F603-W806 HydrophobicContact CD1-CH2 4.49Å; F603-W806 HydrophobicContact CD1-CZ3 4.06Å; F603-M869 HydrophobicContact CZ-CB 4.49Å; F603-A871 HydrophobicContact CE2-CB 4.33Å; F603-A871 HydrophobicContact CZ-CB 3.94Å; F603-N876 HydrophobicContact CD2-CB 3.65Å; F603-N876 HydrophobicContact CE2-CB 3.78Å; F603-N876 PolarHBondContact N-O 2.86Å; F603-W877 HydrophobicContact CB-CD2 3.92Å; F603-W877 HydrophobicContact CB-CE3 3.73Å; F603-W877 HydrophobicContact CB-CH2 3.77Å; F603-W877 HydrophobicContact CB-CZ2 3.95Å; F603-W877 HydrophobicContact CB-CZ3 3.66Å; F603-W877 HydrophobicContact CD1-CH2 4.28Å; F603-W877 HydrophobicContact CD1-CZ2 4.14Å; F603-W877 HydrophobicContact CD2-CD2 4.24Å; F603-W877 AromaticContact CD2-CE2 3.73Å; F603-W877 AromaticContact CD2-CZ2 3.95Å; F603-W877 HydrophobicContact CD2-CZ2 3.95Å; F603-W877 AromaticContact CD2-NE1 3.79Å; F603-W877 HydrophobicContact CG-CD2 4.3Å; F603-W877 AromaticContact CG-CE2 3.89Å; F603-W877 AromaticContact CG-CH2 3.97Å; F603-W877 HydrophobicContact CG-CH2 3.97Å; F603-W877 AromaticContact CG-CZ2 3.73Å; F603-W877 HydrophobicContact CG-CZ2 3.73Å; F603-W877 HydrophobicContact CG-CZ3 4.35Å
604	V	89.7	Confident	77.7	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-51.9	-42	172.3	-176.9	0	0	0	0	111.8	Q600 L608 W877 V879 M893	Q600-V604 HydrophobicContact CB-CB 4.35Å; Q600-V604 HydrophobicContact CB-CG1 4.12Å; Q600-V604 HydrophobicContact CG-CG1 4.25Å; V604-L608 HydrophobicContact CG1-CD1 4.4Å; V604-L608 WeakPolarHBondContact O-CG 3.42Å; V604-L608 PolarHBondContact O-N 3.38Å; V604-W877 WeakPolarHBondContact CG2-O 3.2Å; V604-V879 HydrophobicContact CG1-CG2 4.48Å; V604-V879 HydrophobicContact CG2-CG2 4.16Å; V604-M893 HydrophobicContact CG1-CE 4.07Å
605	R	90.8	Very high	80.5	Confident	30 Å²	30	29.7 Å²	29.7	11%	0.113	13%	0.13	C	C	.	.	H	α-helix	trans	-78.9	-19.4	176.9	-68.7	178.9	-64.7	110.4	-3	115.1	S598 Q600 G601 F603 L609 Q685 I686 I734	S598-R605 VanDerWaalsContact CB-NE 3.26Å; S598-R605 VanDerWaalsContact OG-CZ 3.28Å; S598-R605 PolarHBondContact OG-NE 3.41Å; S598-R605 PolarHBondContact OG-NH2 2.91Å; Q600-R605 HydrophobicContact CB-CG 3.73Å; Q600-R605 PolarHBondContact O-NE 3.26Å; G601-R605 PolarHBondContact O-NE 3.42Å; F603-R605 PolarHBondContact O-N 3.2Å; R605-L609 WeakPolarHBondContact O-CB 3.38Å; R605-L609 PolarHBondContact O-N 2.88Å; R605-Q685 VanDerWaalsContact CD-O 3.28Å; R605-Q685 WeakPolarHBondContact CD-O 3.31Å; R605-Q685 WeakPolarHBondContact CG-O 3.44Å; R605-I686 HydrophobicContact CG-CG1 4.43Å; R605-I734 HydrophobicContact CB-CD1 4.14Å
606	M	93.6	Very high	83.1	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-77.8	-40.7	169	-83.5	-178.9	-76.8	0	0	110.1	K602 F603 L609 H610 I734 K737 L738 L741 W806 M869	K602-M606 HydrophobicContact CD-CE 4.34Å; K602-M606 HydrophobicContact CG-CE 3.71Å; K602-M606 WeakPolarHBondContact O-CE 3.41Å; F603-M606 HydrophobicContact CD1-CE 3.41Å; F603-M606 VanDerWaalsContact CD1-CE 3.41Å; F603-M606 HydrophobicContact CE1-CE 3.59Å; F603-M606 HydrophobicContact CG-CE 4.01Å; F603-M606 HydrophobicContact CZ-CE 4.28Å; F603-M606 CarbonylContact O-C 3.56Å; F603-M606 WeakPolarHBondContact O-CA 3.46Å; F603-M606 PolarHBondContact O-N 2.92Å; M606-L609 PolarHBondContact O-N 3.11Å; M606-H610 VanDerWaalsContact O-CB 3.23Å; M606-H610 WeakPolarHBondContact O-CB 3.24Å; M606-H610 PolarHBondContact O-N 2.85Å; M606-I734 HydrophobicContact CB-CG2 4.4Å; M606-I734 HydrophobicContact CG-CG2 3.68Å; M606-K737 HydrophobicContact CE-CB 4.45Å; M606-K737 HydrophobicContact CG-CB 4.35Å; M606-K737 HydrophobicContact SD-CB 3.44Å; M606-K737 WeakPolarHBondContact SD-CB 2.47Å; M606-L738 HydrophobicContact CB-CD2 3.77Å; M606-L738 HydrophobicContact CB-CG 4.5Å; M606-L738 HydrophobicContact CG-CD2 3.98Å; M606-L738 HydrophobicContact CG-CG 4.25Å; M606-L738 HydrophobicContact SD-CD2 4.5Å; M606-L741 HydrophobicContact SD-CD1 3.8Å; M606-W806 HydrophobicContact CB-CH2 3.56Å; M606-W806 HydrophobicContact CB-CZ2 3.97Å; M606-W806 HydrophobicContact CB-CZ3 4.48Å; M606-M869 HydrophobicContact CE-CE 4.37Å; M606-M869 HydrophobicContact SD-CE 4.33Å
607	Q	94.3	Very high	85.4	Confident	9 Å²	9	19.6 Å²	19.6	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-57.7	-55.5	172.4	177.7	174.2	-5.5	0	0	111.5	F603 L609 H610 E611 W806 M893	F603-Q607 PolarHBondContact O-N 2.85Å; Q607-L609 VanDerWaalsContact C-N 3.29Å; Q607-L609 PolarHBondContact O-N 3.01Å; Q607-H610 PolarHBondContact O-N 2.88Å; Q607-H610 VanDerWaalsContact O-N 3.11Å; Q607-E611 HydrophobicContact CG-CG 4.47Å; Q607-E611 WeakPolarHBondContact CG-OE1 3.18Å; Q607-E611 PolarHBondContact NE2-OE1 3.45Å; Q607-E611 PolarHBondContact O-N 3Å; Q607-W806 HydrophobicContact CB-CD2 3.69Å; Q607-W806 HydrophobicContact CB-CE3 4.06Å; Q607-W806 HydrophobicContact CB-CG 3.93Å; Q607-W806 HydrophobicContact CB-CZ2 4.39Å; Q607-W806 HydrophobicContact CG-CB 4.09Å; Q607-W806 HydrophobicContact CG-CD2 4.03Å; Q607-W806 HydrophobicContact CG-CG 3.69Å; Q607-M893 VanDerWaalsContact CD-CE 3.45Å; Q607-M893 HydrophobicContact CG-CE 4.2Å; Q607-M893 VanDerWaalsContact OE1-CE 3.31Å
608	L	92.2	Very high	87.3	Confident	14 Å²	14	12.1 Å²	12.1	7%	0.073	6%	0.06	C	C	.	.	H	α-helix	trans	-54.7	-42.1	178.9	-75.8	171	0	0	0	113	V604 F612 I682 Q685	V604-L608 HydrophobicContact CG1-CD1 4.4Å; V604-L608 WeakPolarHBondContact O-CG 3.42Å; V604-L608 PolarHBondContact O-N 3.38Å; L608-F612 WeakPolarHBondContact O-CB 3.28Å; L608-F612 PolarHBondContact O-N 3Å; L608-I682 HydrophobicContact CB-CG2 4.47Å; L608-Q685 HydrophobicContact CD1-CB 3.79Å
609	L	93.4	Very high	88.9	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-75.8	-33	179.1	-172.3	59.4	0	0	0	112.5	R605 M606 Q607 F612 I613 I686 L731 I734	R605-L609 WeakPolarHBondContact O-CB 3.38Å; R605-L609 PolarHBondContact O-N 2.88Å; M606-L609 PolarHBondContact O-N 3.11Å; Q607-L609 VanDerWaalsContact C-N 3.29Å; Q607-L609 PolarHBondContact O-N 3.01Å; L609-F612 HydrophobicContact CD1-CD1 3.98Å; L609-I613 HydrophobicContact CD1-CD1 3.86Å; L609-I613 HydrophobicContact CD1-CG1 4Å; L609-I613 HydrophobicContact CD2-CD1 4.15Å; L609-I613 HydrophobicContact CG-CD1 3.63Å; L609-I613 HydrophobicContact CG-CG1 4.19Å; L609-I613 WeakPolarHBondContact O-CB 3.4Å; L609-I613 VanDerWaalsContact O-CG1 3.24Å; L609-I613 WeakPolarHBondContact O-CG1 2.87Å; L609-I613 PolarHBondContact O-N 2.8Å; L609-I686 HydrophobicContact CB-CD1 4.38Å; L609-I686 HydrophobicContact CD1-CD1 4.48Å; L609-L731 HydrophobicContact CD1-CD2 3.78Å; L609-L731 HydrophobicContact CD2-CD2 4.02Å; L609-I734 HydrophobicContact CB-CG2 3.98Å; L609-I734 HydrophobicContact CD2-CB 3.59Å; L609-I734 HydrophobicContact CD2-CD1 4.44Å; L609-I734 HydrophobicContact CD2-CG2 3.52Å; L609-I734 HydrophobicContact CG-CG2 4.34Å
610	H	95	Very high	90.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-70.2	-40.5	176.8	-169.4	-106.1	0	0	0	111.9	M606 Q607 Y614 L738 V802 W806	M606-H610 VanDerWaalsContact O-CB 3.23Å; M606-H610 WeakPolarHBondContact O-CB 3.24Å; M606-H610 PolarHBondContact O-N 2.85Å; Q607-H610 PolarHBondContact O-N 2.88Å; Q607-H610 VanDerWaalsContact O-N 3.11Å; H610-Y614 WeakPolarHBondContact O-CB 3.33Å; H610-Y614 PolarHBondContact O-N 3.36Å; H610-L738 HydrophobicContact CB-CD1 4.43Å; H610-L738 HydrophobicContact CB-CD2 4.02Å; H610-V802 WeakPolarHBondContact ND1-CG1 3.2Å; H610-W806 HydrophobicContact CB-CZ2 4.29Å; H610-W806 AromaticContact CG-NE1 3.88Å; H610-W806 AromaticContact ND1-NE1 3.57Å
611	E	93.8	Very high	90.5	Very high	13 Å²	13	18.7 Å²	18.7	6%	0.061	10%	0.099	C	C	.	.	H	α-helix	trans	-61.1	-44.1	172.7	-76.2	-176.9	-133.8	0	0	111.4	Q607 Y615 W651 L799 V802 R803	Q607-E611 HydrophobicContact CG-CG 4.47Å; Q607-E611 WeakPolarHBondContact CG-OE1 3.18Å; Q607-E611 PolarHBondContact NE2-OE1 3.45Å; Q607-E611 PolarHBondContact O-N 3Å; E611-Y615 WeakPolarHBondContact O-CB 3.33Å; E611-Y615 PolarHBondContact O-N 2.7Å; E611-Y615 VanDerWaalsContact O-N 3.13Å; E611-W651 HydrophobicContact CB-CZ2 4.35Å; E611-L799 HydrophobicContact CB-CD1 3.76Å; E611-L799 HydrophobicContact CG-CD1 3.9Å; E611-L799 WeakPolarHBondContact O-CD1 3.48Å; E611-V802 HydrophobicContact CG-CG1 4.06Å; E611-R803 HydrophobicContact CG-CG 4.29Å; E611-R803 IonicContact OE1-NE 3.35Å; E611-R803 IonicContact OE2-CZ 2.67Å; E611-R803 VanDerWaalsContact OE2-CZ 3.3Å; E611-R803 IonicContact OE2-NE 3.86Å; E611-R803 PolarHBondContact OE2-NE 3.21Å; E611-R803 IonicContact OE2-NH2 2.68Å; E611-R803 PolarHBondContact OE2-NH2 2.77Å
612	F	93.7	Very high	90.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.8	-49	176.4	177.4	-110.5	0	0	0	113.3	L608 L609 L616 W651 L655 L674 M677 L678 P679 I682	L608-F612 WeakPolarHBondContact O-CB 3.28Å; L608-F612 PolarHBondContact O-N 3Å; L609-F612 HydrophobicContact CD1-CD1 3.98Å; F612-L616 HydrophobicContact CD1-CD1 4.38Å; F612-L616 HydrophobicContact CD2-CD1 4.3Å; F612-L616 HydrophobicContact CE1-CD1 3.79Å; F612-L616 HydrophobicContact CE2-CD1 3.66Å; F612-L616 HydrophobicContact CE2-CG 4.35Å; F612-L616 HydrophobicContact CZ-CD1 3.39Å; F612-L616 PolarHBondContact O-N 3.05Å; F612-L616 VanDerWaalsContact O-N 3.14Å; F612-W651 HydrophobicContact CB-CZ3 4.49Å; F612-W651 HydrophobicContact CD2-CE3 4.2Å; F612-W651 AromaticContact CD2-CZ3 3.94Å; F612-W651 HydrophobicContact CD2-CZ3 3.94Å; F612-L655 HydrophobicContact CD2-CD1 4.14Å; F612-L655 HydrophobicContact CE2-CD1 3.8Å; F612-L655 HydrophobicContact CE2-CD2 3.94Å; F612-L674 HydrophobicContact CE1-CB 4.28Å; F612-L674 HydrophobicContact CE1-CD2 4.07Å; F612-M677 HydrophobicContact CZ-CB 4.33Å; F612-L678 HydrophobicContact CD1-CD1 3.97Å; F612-L678 HydrophobicContact CE1-CD1 3.72Å; F612-L678 HydrophobicContact CG-CD1 4.44Å; F612-L678 HydrophobicContact CZ-CD1 4.02Å; F612-P679 VanDerWaalsContact CE2-CD 3.48Å; F612-P679 HydrophobicContact CE2-CG 4.25Å; F612-I682 HydrophobicContact CB-CD1 4.19Å; F612-I682 HydrophobicContact CD2-CD1 4.04Å; F612-I682 HydrophobicContact CG-CD1 4.35Å
613	I	92.8	Very high	90	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.7	-43.3	-179.3	-71.1	174.5	0	0	0	111.3	L609 L616 V617 F669 L674 V763	L609-I613 HydrophobicContact CD1-CD1 3.86Å; L609-I613 HydrophobicContact CD1-CG1 4Å; L609-I613 HydrophobicContact CD2-CD1 4.15Å; L609-I613 HydrophobicContact CG-CD1 3.63Å; L609-I613 HydrophobicContact CG-CG1 4.19Å; L609-I613 WeakPolarHBondContact O-CB 3.4Å; L609-I613 VanDerWaalsContact O-CG1 3.24Å; L609-I613 WeakPolarHBondContact O-CG1 2.87Å; L609-I613 PolarHBondContact O-N 2.8Å; I613-L616 PolarHBondContact O-N 2.75Å; I613-V617 HydrophobicContact CG2-CG2 4.26Å; I613-V617 WeakPolarHBondContact O-CB 3.45Å; I613-V617 VanDerWaalsContact O-CG2 3.28Å; I613-V617 WeakPolarHBondContact O-CG2 3.34Å; I613-V617 PolarHBondContact O-N 2.76Å; I613-F669 HydrophobicContact CD1-CE2 4.01Å; I613-F669 HydrophobicContact CD1-CZ 3.77Å; I613-F669 HydrophobicContact CG1-CZ 4.48Å; I613-F669 HydrophobicContact CG2-CD1 4.14Å; I613-F669 HydrophobicContact CG2-CE1 3.67Å; I613-F669 HydrophobicContact CG2-CE2 4.45Å; I613-F669 HydrophobicContact CG2-CZ 3.84Å; I613-L674 HydrophobicContact CD1-CD1 3.81Å; I613-L674 HydrophobicContact CG1-CD1 3.68Å; I613-V763 HydrophobicContact CG2-CG2 3.49Å; I613-V763 VanDerWaalsContact CG2-CG2 3.49Å
614	Y	93.9	Very high	88.8	Confident	6 Å²	6	28.2 Å²	28.2	2%	0.024	16%	0.156	C	C	.	.	H	α-helix	trans	-64.8	-41	-179.9	-178.2	-91.2	0	0	0	111.6	H610 V617 R618 D619 V763 F796 V797 S798 L799 V802	H610-Y614 WeakPolarHBondContact O-CB 3.33Å; H610-Y614 PolarHBondContact O-N 3.36Å; Y614-V617 PolarHBondContact O-N 3.42Å; Y614-R618 HydrophobicContact CD2-CB 4.08Å; Y614-R618 HydrophobicContact CD2-CG 4.22Å; Y614-R618 HydrophobicContact CE1-CB 4.5Å; Y614-R618 HydrophobicContact CE2-CB 3.83Å; Y614-R618 HydrophobicContact CE2-CG 4.13Å; Y614-R618 WeakPolarHBondContact O-CA 3.41Å; Y614-R618 PolarHBondContact O-N 3.28Å; Y614-D619 HydrophobicContact CD1-CB 3.86Å; Y614-D619 HydrophobicContact CE1-CB 3.51Å; Y614-D619 PolarHBondContact O-N 2.81Å; Y614-V763 HydrophobicContact CD2-CG1 4.03Å; Y614-F796 HydrophobicContact CD2-CB 4.47Å; Y614-F796 HydrophobicContact CE2-CB 3.53Å; Y614-F796 HydrophobicContact CE2-CG 4.35Å; Y614-F796 WeakPolarHBondContact OH-CB 3.35Å; Y614-F796 PolarHBondContact OH-O 3.15Å; Y614-V797 VanDerWaalsContact OH-C 3.3Å; Y614-S798 PolarHBondContact OH-N 2.93Å; Y614-L799 HydrophobicContact CD1-CD1 4.38Å; Y614-V802 HydrophobicContact CD1-CG2 3.73Å; Y614-V802 HydrophobicContact CD2-CG2 3.93Å; Y614-V802 HydrophobicContact CE1-CG2 3.97Å; Y614-V802 HydrophobicContact CE2-CG2 4.18Å; Y614-V802 HydrophobicContact CG-CG2 3.71Å
615	Y	93.2	Very high	87.5	Confident	1 Å²	1	31.6 Å²	31.6	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-57.3	-53.6	172.7	177.4	-105.1	0	0	0	111.7	E611 V617 D619 Y620 A621 V646 W651 R652 L655	E611-Y615 WeakPolarHBondContact O-CB 3.33Å; E611-Y615 PolarHBondContact O-N 2.7Å; E611-Y615 VanDerWaalsContact O-N 3.13Å; Y615-V617 VanDerWaalsContact C-N 3.31Å; Y615-V617 PolarHBondContact O-N 2.81Å; Y615-D619 WeakPolarHBondContact CD2-O 3.28Å; Y615-D619 VanDerWaalsContact CE2-O 3.23Å; Y615-D619 WeakPolarHBondContact CE2-O 3.42Å; Y615-D619 CarbonylContact O-C 3.52Å; Y615-D619 VanDerWaalsContact O-C 3.24Å; Y615-D619 PolarHBondContact O-N 3.38Å; Y615-Y620 AromaticContact CE1-CD2 3.84Å; Y615-Y620 HydrophobicContact CE1-CD2 3.84Å; Y615-Y620 HydrophobicContact CE1-CE2 4.2Å; Y615-Y620 AromaticContact CZ-CD2 3.92Å; Y615-Y620 WeakPolarHBondContact O-CA 3.47Å; Y615-Y620 WeakPolarHBondContact O-CB 3.44Å; Y615-Y620 PolarHBondContact O-N 2.69Å; Y615-A621 HydrophobicContact CE2-CB 4.38Å; Y615-V646 WeakPolarHBondContact OH-CG2 3.23Å; Y615-W651 HydrophobicContact CD1-CH2 4.31Å; Y615-W651 AromaticContact CD1-CZ3 3.9Å; Y615-W651 HydrophobicContact CD1-CZ3 3.9Å; Y615-W651 HydrophobicContact CG-CH2 4.11Å; Y615-W651 HydrophobicContact CG-CZ3 4.18Å; Y615-R652 HydrophobicContact CD1-CG 4.27Å; Y615-R652 HydrophobicContact CD2-CG 4.47Å; Y615-R652 HydrophobicContact CE1-CB 4.2Å; Y615-R652 HydrophobicContact CE1-CG 3.97Å; Y615-R652 VanDerWaalsContact CE2-CD 3.45Å; Y615-R652 HydrophobicContact CE2-CG 4.21Å; Y615-L655 HydrophobicContact CD1-CD1 3.9Å; Y615-L655 HydrophobicContact CE1-CB 4.32Å; Y615-L655 HydrophobicContact CE1-CD1 3.85Å
616	L	89.7	Confident	85.7	Confident	8 Å²	8	35.9 Å²	35.9	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-26.3	-177.7	-74	178.6	0	0	0	114.9	F612 I613 Y620 L655 L658 L674 M677	F612-L616 HydrophobicContact CD1-CD1 4.38Å; F612-L616 HydrophobicContact CD2-CD1 4.3Å; F612-L616 HydrophobicContact CE1-CD1 3.79Å; F612-L616 HydrophobicContact CE2-CD1 3.66Å; F612-L616 HydrophobicContact CE2-CG 4.35Å; F612-L616 HydrophobicContact CZ-CD1 3.39Å; F612-L616 PolarHBondContact O-N 3.05Å; F612-L616 VanDerWaalsContact O-N 3.14Å; I613-L616 PolarHBondContact O-N 2.75Å; L616-Y620 HydrophobicContact CD2-CD2 4.45Å; L616-L655 HydrophobicContact CD2-CB 4.34Å; L616-L655 HydrophobicContact CD2-CD1 4.23Å; L616-L658 HydrophobicContact CB-CD1 3.92Å; L616-L658 HydrophobicContact CB-CG 4.15Å; L616-L674 HydrophobicContact CD1-CD2 3.79Å; L616-M677 HydrophobicContact CD1-SD 4.39Å
617	V	88.7	Confident	83.7	Confident	27 Å²	27	42.5 Å²	42.5	16%	0.164	23%	0.234	C	C	.	.	H	α-helix	trans	-105	-24.7	-171.8	179	0	0	0	0	113.4	I613 Y614 Y615 L658 F669 V763	I613-V617 HydrophobicContact CG2-CG2 4.26Å; I613-V617 WeakPolarHBondContact O-CB 3.45Å; I613-V617 VanDerWaalsContact O-CG2 3.28Å; I613-V617 WeakPolarHBondContact O-CG2 3.34Å; I613-V617 PolarHBondContact O-N 2.76Å; Y614-V617 PolarHBondContact O-N 3.42Å; Y615-V617 VanDerWaalsContact C-N 3.31Å; Y615-V617 PolarHBondContact O-N 2.81Å; V617-L658 HydrophobicContact CG2-CD1 3.64Å; V617-F669 HydrophobicContact CG2-CB 4.02Å; V617-F669 HydrophobicContact CG2-CD1 4.19Å; V617-F669 HydrophobicContact CG2-CG 4.26Å; V617-V763 HydrophobicContact CB-CG2 4.03Å; V617-V763 HydrophobicContact CG1-CB 4.26Å; V617-V763 HydrophobicContact CG1-CG2 3.81Å; V617-V763 HydrophobicContact CG2-CG2 4.21Å
618	R	86.8	Confident	81.5	Confident	67 Å²	67	44.6 Å²	44.6	25%	0.253	25%	0.245	S	C	.	.	H	α-helix	trans	-137	-27	-170.4	-61.8	-62	-165	143.7	11.8	115.8	Y614 V763 E765	Y614-R618 HydrophobicContact CD2-CB 4.08Å; Y614-R618 HydrophobicContact CD2-CG 4.22Å; Y614-R618 HydrophobicContact CE1-CB 4.5Å; Y614-R618 HydrophobicContact CE2-CB 3.83Å; Y614-R618 HydrophobicContact CE2-CG 4.13Å; Y614-R618 WeakPolarHBondContact O-CA 3.41Å; Y614-R618 PolarHBondContact O-N 3.28Å; R618-V763 HydrophobicContact CG-CG1 4.33Å; R618-V763 PolarHBondContact NH2-O 3.49Å; R618-E765 IonicContact CZ-OE1 2.74Å; R618-E765 IonicContact NH1-OE1 3.64Å; R618-E765 PolarHBondContact NH1-OE1 2.66Å; R618-E765 IonicContact NH2-OE1 2.66Å; R618-E765 PolarHBondContact NH2-OE1 2.72Å
619	D	87.8	Confident	79.3	Confident	43 Å²	43	48.4 Å²	48.4	23%	0.23	28%	0.279	C	S	.	.			trans	-132.2	38.5	-169.1	-172.7	40.5	0	0	0	110.8	Y614 Y615 L799	Y614-D619 HydrophobicContact CD1-CB 3.86Å; Y614-D619 HydrophobicContact CE1-CB 3.51Å; Y614-D619 PolarHBondContact O-N 2.81Å; Y615-D619 WeakPolarHBondContact CD2-O 3.28Å; Y615-D619 VanDerWaalsContact CE2-O 3.23Å; Y615-D619 WeakPolarHBondContact CE2-O 3.42Å; Y615-D619 CarbonylContact O-C 3.52Å; Y615-D619 VanDerWaalsContact O-C 3.24Å; Y615-D619 PolarHBondContact O-N 3.38Å; D619-L799 WeakPolarHBondContact OD2-CB 3.42Å; D619-L799 PolarHBondContact OD2-N 3.19Å
620	Y	88.7	Confident	76.8	Confident	56 Å²	56	55.5 Å²	55.5	22%	0.22	32%	0.317	C	S	.	.			trans	-77.5	129	-178.5	-178.8	-95.3	0	0	0	109.9	Y615 L616 G622 L655 P657	Y615-Y620 AromaticContact CE1-CD2 3.84Å; Y615-Y620 HydrophobicContact CE1-CD2 3.84Å; Y615-Y620 HydrophobicContact CE1-CE2 4.2Å; Y615-Y620 AromaticContact CZ-CD2 3.92Å; Y615-Y620 WeakPolarHBondContact O-CA 3.47Å; Y615-Y620 WeakPolarHBondContact O-CB 3.44Å; Y615-Y620 PolarHBondContact O-N 2.69Å; L616-Y620 HydrophobicContact CD2-CD2 4.45Å; Y620-G622 WeakPolarHBondContact CE1-O 3.44Å; Y620-L655 WeakPolarHBondContact CE2-O 3.41Å; Y620-L655 PolarHBondContact OH-O 2.85Å; Y620-P657 HydrophobicContact CD1-CB 4.21Å; Y620-P657 HydrophobicContact CE1-CB 3.85Å; Y620-P657 HydrophobicContact CE1-CG 4.41Å; Y620-P657 HydrophobicContact CE2-CB 4.46Å; Y620-P657 WeakPolarHBondContact OH-CD 3.29Å
621	A	82.7	Confident	74.2	Confident	76 Å²	76	62.4 Å²	62.4	63%	0.628	34%	0.343	S	S	*	.			trans	-136.6	26.1	-169.2	0	0	0	0	0	112.8	Y615	Y615-A621 HydrophobicContact CE2-CB 4.38Å
622	G	80.2	Confident	71.7	Confident	13 Å²	13	68.2 Å²	68.2	13%	0.134	37%	0.37	C	S	.	.	S	Bend	trans	-100.6	162.2	175.1	0	0	0	0	0	112.7	Y620 Y645	Y620-G622 WeakPolarHBondContact CE1-O 3.44Å; G622-Y645 CarbonylContact C-O 3.46Å; G622-Y645 WeakPolarHBondContact CA-O 3.44Å
623	E	77.5	Confident	69.3	Low	133 Å²	133	74.1 Å²	74.1	62%	0.621	41%	0.408	S	S	*	.			trans	-72.4	136.7	-179.1	-66.3	-173	-175.9	0	0	112.5	H625 Y645	E623-H625 PolarHBondContact O-N 2.79Å; E623-H625 IonicContact OE2-CE1 3.81Å; E623-Y645 PolarHBondContact N-O 2.83Å; E623-Y645 WeakPolarHBondContact O-CD1 3.4Å
624	S	66.1	Low	66.9	Low	93 Å²	93	77.8 Å²	77.8	65%	0.65	44%	0.439	S	S	*	.			trans	-92.1	79.6	-178.5	-67.3	0	0	0	0	111.3	P626	S624-P626 WeakPolarHBondContact O-CD 3.27Å
625	H	62.4	Low	64.5	Low	73 Å²	73	83.3 Å²	83.3	34%	0.338	47%	0.468	S	S	.	.			trans	-64.2	116.8	175.8	-59.1	-56.9	0	0	0	111.6	E623 E627 I628	E623-H625 PolarHBondContact O-N 2.79Å; E623-H625 IonicContact OE2-CE1 3.81Å; H625-E627 VanDerWaalsContact C-N 3.33Å; H625-E627 PolarHBondContact O-N 2.86Å; H625-I628 HydrophobicContact CB-CD1 3.78Å; H625-I628 HydrophobicContact CB-CG1 4.16Å
626	P	53.9	Low	62.4	Low	120 Å²	120	89.8 Å²	89.8	78%	0.779	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-73	-21	-171.4	28.3	-35.2	0	0	0	114.1	S624 I628	S624-P626 WeakPolarHBondContact O-CD 3.27Å; P626-I628 VanDerWaalsContact C-N 3.25Å; P626-I628 PolarHBondContact O-N 3.35Å
627	E	50.3	Low	60.2	Low	140 Å²	140	93 Å²	93	65%	0.654	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-71.6	-12.4	-173.3	-57.2	-175.1	171.2	0	0	115.2	H625 R631	H625-E627 VanDerWaalsContact C-N 3.33Å; H625-E627 PolarHBondContact O-N 2.86Å; E627-R631 IonicContact OE2-NH2 3.61Å; E627-R631 PolarHBondContact OE2-NH2 2.9Å
628	I	49.3	Very low	58.2	Low	53 Å²	53	99.4 Å²	99.4	27%	0.272	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-82.9	-19.8	-163.7	-58.5	-177.7	0	0	0	112.3	H625 P626 N630 R631 I643 Y645	H625-I628 HydrophobicContact CB-CD1 3.78Å; H625-I628 HydrophobicContact CB-CG1 4.16Å; P626-I628 VanDerWaalsContact C-N 3.25Å; P626-I628 PolarHBondContact O-N 3.35Å; I628-N630 PolarHBondContact O-N 3.16Å; I628-R631 PolarHBondContact O-N 3.23Å; I628-I643 HydrophobicContact CD1-CD1 3.62Å; I628-I643 HydrophobicContact CG1-CD1 4.29Å; I628-Y645 HydrophobicContact CD1-CE1 4.18Å; I628-Y645 WeakPolarHBondContact CD1-OH 3.19Å
629	A	44.5	Very low	56.7	Low	94 Å²	94	99.9 Å²	99.9	78%	0.777	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-59.1	-23.2	-176.7	0	0	0	0	0	114.6
630	N	40.9	Very low	55.6	Low	150 Å²	150	105 Å²	105	80%	0.802	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-107	-0.4	-173.5	-68.5	-19.9	0	0	0	114.8	I628 H632	I628-N630 PolarHBondContact O-N 3.16Å; N630-H632 PolarHBondContact O-N 3.31Å
631	R	40.7	Very low	54.7	Low	144 Å²	144	109.1 Å²	109.1	54%	0.543	63%	0.627	S	S	.	*			trans	-80.3	116.7	-176.1	-65.9	-167.5	-173.8	-170.2	4.9	111.9	E627 I628	E627-R631 IonicContact OE2-NH2 3.61Å; E627-R631 PolarHBondContact OE2-NH2 2.9Å; I628-R631 PolarHBondContact O-N 3.23Å
632	H	41.6	Very low	54.5	Low	135 Å²	135	106.3 Å²	106.3	63%	0.625	60%	0.602	S	S	*	*			trans	-71.3	146.8	179.1	-107.5	-92.6	0	0	0	111.5	N630 A634 D635	N630-H632 PolarHBondContact O-N 3.31Å; H632-A634 PolarHBondContact O-N 3.35Å; H632-D635 WeakPolarHBondContact CB-OD2 3.09Å; H632-D635 PolarHBondContact O-N 3.41Å
633	P	43	Very low	54.6	Low	124 Å²	124	108.7 Å²	108.7	81%	0.805	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	9.1	177.4	-22.7	34.6	0	0	0	116.1
634	A	42.4	Very low	55	Low	78 Å²	78	104.9 Å²	104.9	65%	0.645	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-26.1	-178.7	0	0	0	0	0	113.1	H632 K636	H632-A634 PolarHBondContact O-N 3.35Å; A634-K636 PolarHBondContact O-N 3.08Å
635	D	44.2	Very low	56.1	Low	121 Å²	121	101.5 Å²	101.5	65%	0.647	57%	0.57	S	S	*	*			trans	-90.6	6.7	-162.9	-49	-48.5	0	0	0	114.3	H632 A637	H632-D635 WeakPolarHBondContact CB-OD2 3.09Å; H632-D635 PolarHBondContact O-N 3.41Å; D635-A637 PolarHBondContact O-N 3.32Å
636	K	49.4	Very low	57.3	Low	137 Å²	137	99.2 Å²	99.2	60%	0.596	56%	0.562	S	S	*	*			trans	-78.4	99.6	174.9	-71.5	-162	176.2	-160.6	0	110.5	A634 D712	A634-K636 PolarHBondContact O-N 3.08Å; K636-D712 IonicContact NZ-OD1 2.86Å; K636-D712 PolarHBondContact NZ-OD1 2.95Å
637	A	42.3	Very low	58.8	Low	75 Å²	75	99.8 Å²	99.8	62%	0.62	56%	0.558	S	S	*	*			trans	-63.1	144.2	164.8	0	0	0	0	0	110.8	D635 G639	D635-A637 PolarHBondContact O-N 3.32Å; A637-G639 PolarHBondContact O-N 2.99Å
638	D	46.9	Very low	60.5	Low	162 Å²	162	96.6 Å²	96.6	87%	0.866	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	120.4	176.3	-87.3	-47.7	0	0	0	110.3
639	G	55.3	Low	62.2	Low	78 Å²	78	98.9 Å²	98.9	80%	0.804	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	121	-12.1	173	0	0	0	0	0	116.7	A637	A637-G639 PolarHBondContact O-N 2.99Å
640	Q	64.6	Low	64.3	Low	151 Å²	151	95.1 Å²	95.1	71%	0.706	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-76.8	128.7	179	-165	172.9	38.5	0	0	112
641	E	70.6	Confident	66.6	Low	142 Å²	142	89.1 Å²	89.1	66%	0.664	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-68.2	147.5	-180	-64.7	-151.9	136.6	0	0	112.9
642	P	78.6	Confident	69	Low	16 Å²	16	84.4 Å²	84.4	10%	0.104	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-69.7	146.7	177.2	-19	33.6	0	0	0	113.4	Y654 Y708 D712	P642-Y654 HydrophobicContact CB-CD1 3.73Å; P642-Y654 HydrophobicContact CB-CE1 4.17Å; P642-Y654 HydrophobicContact CB-CG 4.37Å; P642-Y654 WeakPolarHBondContact O-CD1 3.43Å; P642-Y654 WeakPolarHBondContact O-CE1 2.99Å; P642-Y708 HydrophobicContact CG-CD1 3.81Å; P642-Y708 HydrophobicContact CG-CD2 4.14Å; P642-Y708 HydrophobicContact CG-CE1 3.78Å; P642-Y708 HydrophobicContact CG-CE2 4.12Å; P642-Y708 HydrophobicContact CG-CG 3.99Å; P642-D712 HydrophobicContact CG-CB 4.09Å
643	I	83.1	Confident	71.3	Confident	63 Å²	63	79.7 Å²	79.7	32%	0.323	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-63.8	133.2	-176.7	-62.3	171.7	0	0	0	111	I628 Y645 Y654	I628-I643 HydrophobicContact CD1-CD1 3.62Å; I628-I643 HydrophobicContact CG1-CD1 4.29Å; I643-Y645 HydrophobicContact CB-CE2 4.06Å; I643-Y645 HydrophobicContact CG2-CD2 4.4Å; I643-Y645 HydrophobicContact CG2-CE2 4.02Å; I643-Y645 WeakPolarHBondContact O-CD2 3.45Å; I643-Y654 WeakPolarHBondContact O-CD1 3.45Å
644	V	85.8	Confident	73.5	Confident	54 Å²	54	74.1 Å²	74.1	33%	0.327	41%	0.411	S	S	.	.			trans	-90.9	113.7	178.4	176.9	0	0	0	0	109.6	D647 R653 Y654	V644-D647 HydrophobicContact CG1-CB 4.36Å; V644-R653 CarbonylContact C-O 3.58Å; V644-R653 WeakPolarHBondContact CA-O 3.33Å; V644-R653 HydrophobicContact CG1-CG 3.94Å; V644-R653 HydrophobicContact CG2-CG 4.22Å; V644-Y654 HydrophobicContact CG2-CD1 4.37Å; V644-Y654 HydrophobicContact CG2-CE1 3.86Å
645	Y	87.5	Confident	75.7	Confident	21 Å²	21	70.5 Å²	70.5	8%	0.082	38%	0.381	C	S	.	.	S	Bend	trans	-93.2	-23.4	177.9	-65.8	-91.4	0	0	0	112.7	G622 E623 I628 I643 R653 L655 P656	G622-Y645 CarbonylContact C-O 3.46Å; G622-Y645 WeakPolarHBondContact CA-O 3.44Å; E623-Y645 PolarHBondContact N-O 2.83Å; E623-Y645 WeakPolarHBondContact O-CD1 3.4Å; I628-Y645 HydrophobicContact CD1-CE1 4.18Å; I628-Y645 WeakPolarHBondContact CD1-OH 3.19Å; I643-Y645 HydrophobicContact CB-CE2 4.06Å; I643-Y645 HydrophobicContact CG2-CD2 4.4Å; I643-Y645 HydrophobicContact CG2-CE2 4.02Å; I643-Y645 WeakPolarHBondContact O-CD2 3.45Å; Y645-R653 PolarHBondContact N-O 3Å; Y645-L655 VanDerWaalsContact CB-O 3.31Å; Y645-L655 WeakPolarHBondContact CB-O 3.2Å; Y645-L655 WeakPolarHBondContact CD2-O 3.49Å; Y645-L655 VanDerWaalsContact CG-O 3.22Å; Y645-P656 HydrophobicContact CE1-CB 3.98Å; Y645-P656 HydrophobicContact CE2-CB 4.19Å
646	V	87.6	Confident	77.7	Confident	25 Å²	25	65.7 Å²	65.7	15%	0.152	36%	0.356	C	S	.	.	S	Bend	trans	-143.8	118	178.2	177.2	0	0	0	0	107.9	Y615 E648 R653	Y615-V646 WeakPolarHBondContact OH-CG2 3.23Å; V646-E648 HydrophobicContact CG1-CB 4.14Å; V646-E648 HydrophobicContact CG1-CG 3.82Å; V646-E648 PolarHBondContact O-N 3.35Å; V646-R653 PolarHBondContact N-O 3.07Å; V646-R653 WeakPolarHBondContact O-CA 3.01Å; V646-R653 WeakPolarHBondContact O-CG 3.36Å
647	D	85.9	Confident	79.3	Confident	132 Å²	132	61.5 Å²	61.5	71%	0.706	34%	0.343	S	S	*	.			trans	-78.6	57.3	179.2	-165.2	29.9	0	0	0	113.5	V644 R653	V644-D647 HydrophobicContact CG1-CB 4.36Å; D647-R653 IonicContact OD1-CZ 3.19Å; D647-R653 IonicContact OD1-NH1 2.75Å; D647-R653 PolarHBondContact OD1-NH1 3.21Å; D647-R653 IonicContact OD1-NH2 2.71Å; D647-R653 PolarHBondContact OD1-NH2 3.31Å
648	E	86.3	Confident	81.1	Confident	74 Å²	74	59.7 Å²	59.7	35%	0.346	32%	0.323	S	S	.	.	S	Bend	trans	-108.4	151.7	165	-72.9	-177.6	160.6	0	0	109.7	V646 S650 R652 R653	V646-E648 HydrophobicContact CG1-CB 4.14Å; V646-E648 HydrophobicContact CG1-CG 3.82Å; V646-E648 PolarHBondContact O-N 3.35Å; E648-S650 PolarHBondContact O-N 2.84Å; E648-S650 WeakPolarHBondContact OE2-CB 3.17Å; E648-S650 PolarHBondContact OE2-OG 3.31Å; E648-R652 IonicContact OE1-CZ 3.14Å; E648-R652 IonicContact OE1-NH2 2.62Å; E648-R652 PolarHBondContact OE1-NH2 3.12Å; E648-R652 IonicContact OE2-CZ 3.24Å; E648-R652 VanDerWaalsContact OE2-CZ 3.29Å; E648-R652 IonicContact OE2-NE 2.7Å; E648-R652 PolarHBondContact OE2-NE 3.13Å; E648-R652 IonicContact OE2-NH2 2.63Å; E648-R652 PolarHBondContact OE2-NH2 2.77Å; E648-R653 WeakPolarHBondContact O-CB 3.36Å; E648-R653 WeakPolarHBondContact O-CD 3.16Å; E648-R653 WeakPolarHBondContact O-CG 3.11Å; E648-R653 PolarHBondContact O-NH1 2.96Å
649	I	85.5	Confident	82.3	Confident	100 Å²	100	55.7 Å²	55.7	51%	0.513	31%	0.306	S	S	.	.	S	Bend	trans	-83.3	71.7	161.4	-52.5	-179.7	0	0	0	107.7	R703	I649-R703 HydrophobicContact CG2-CB 4.37Å
650	S	87.7	Confident	82.8	Confident	16 Å²	16	57.4 Å²	57.4	11%	0.112	30%	0.303	C	S	.	.	S	Bend	trans	-142.7	171.2	-179.4	85.4	0	0	0	0	111.5	E648 R652 R653	E648-S650 PolarHBondContact O-N 2.84Å; E648-S650 WeakPolarHBondContact OE2-CB 3.17Å; E648-S650 PolarHBondContact OE2-OG 3.31Å; S650-R652 PolarHBondContact O-N 3.13Å; S650-R652 PolarHBondContact OG-N 2.89Å; S650-R653 WeakPolarHBondContact O-CB 3.47Å; S650-R653 PolarHBondContact O-N 2.9Å
651	W	89.7	Confident	82.9	Confident	23 Å²	23	53.8 Å²	53.8	9%	0.087	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-5.6	176.4	59.5	-99.8	0	0	0	114	E611 F612 Y615 L655 P679 I682 L799	E611-W651 HydrophobicContact CB-CZ2 4.35Å; F612-W651 HydrophobicContact CB-CZ3 4.49Å; F612-W651 HydrophobicContact CD2-CE3 4.2Å; F612-W651 AromaticContact CD2-CZ3 3.94Å; F612-W651 HydrophobicContact CD2-CZ3 3.94Å; Y615-W651 HydrophobicContact CD1-CH2 4.31Å; Y615-W651 AromaticContact CD1-CZ3 3.9Å; Y615-W651 HydrophobicContact CD1-CZ3 3.9Å; Y615-W651 HydrophobicContact CG-CH2 4.11Å; Y615-W651 HydrophobicContact CG-CZ3 4.18Å; W651-L655 HydrophobicContact CE3-CD1 3.83Å; W651-L655 HydrophobicContact CZ3-CD1 3.84Å; W651-P679 HydrophobicContact CB-CB 4.26Å; W651-P679 HydrophobicContact CB-CG 4.24Å; W651-P679 VanDerWaalsContact O-CG 3.31Å; W651-P679 WeakPolarHBondContact O-CG 3.27Å; W651-I682 HydrophobicContact CB-CD1 4.11Å; W651-I682 HydrophobicContact CB-CG1 4.25Å; W651-I682 HydrophobicContact CD2-CD1 3.78Å; W651-I682 HydrophobicContact CE3-CD1 3.89Å; W651-I682 HydrophobicContact CG-CD1 3.89Å; W651-I682 HydrophobicContact CG-CG1 4.36Å; W651-L799 HydrophobicContact CH2-CD2 4.36Å; W651-L799 HydrophobicContact CZ2-CD2 4.08Å
652	R	91.1	Very high	82.3	Confident	46 Å²	46	54.5 Å²	54.5	17%	0.174	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-19.1	175.3	-60.8	-174.8	-77.3	-162.5	3.7	113.4	Y615 E648 S650 Y654 L655	Y615-R652 HydrophobicContact CD1-CG 4.27Å; Y615-R652 HydrophobicContact CD2-CG 4.47Å; Y615-R652 HydrophobicContact CE1-CB 4.2Å; Y615-R652 HydrophobicContact CE1-CG 3.97Å; Y615-R652 VanDerWaalsContact CE2-CD 3.45Å; Y615-R652 HydrophobicContact CE2-CG 4.21Å; E648-R652 IonicContact OE1-CZ 3.14Å; E648-R652 IonicContact OE1-NH2 2.62Å; E648-R652 PolarHBondContact OE1-NH2 3.12Å; E648-R652 IonicContact OE2-CZ 3.24Å; E648-R652 VanDerWaalsContact OE2-CZ 3.29Å; E648-R652 IonicContact OE2-NE 2.7Å; E648-R652 PolarHBondContact OE2-NE 3.13Å; E648-R652 IonicContact OE2-NH2 2.63Å; E648-R652 PolarHBondContact OE2-NH2 2.77Å; S650-R652 PolarHBondContact O-N 3.13Å; S650-R652 PolarHBondContact OG-N 2.89Å; R652-Y654 VanDerWaalsContact C-N 3.25Å; R652-Y654 PolarHBondContact O-N 2.82Å; R652-L655 PolarHBondContact O-N 3.4Å; R652-L655 VanDerWaalsContact O-N 3.13Å
653	R	89.9	Confident	81.8	Confident	35 Å²	35	59 Å²	59	13%	0.132	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-40.5	-167.1	-170.8	176.2	-174.8	85	8.3	114.7	V644 Y645 V646 D647 E648 S650	V644-R653 CarbonylContact C-O 3.58Å; V644-R653 WeakPolarHBondContact CA-O 3.33Å; V644-R653 HydrophobicContact CG1-CG 3.94Å; V644-R653 HydrophobicContact CG2-CG 4.22Å; Y645-R653 PolarHBondContact N-O 3Å; V646-R653 PolarHBondContact N-O 3.07Å; V646-R653 WeakPolarHBondContact O-CA 3.01Å; V646-R653 WeakPolarHBondContact O-CG 3.36Å; D647-R653 IonicContact OD1-CZ 3.19Å; D647-R653 IonicContact OD1-NH1 2.75Å; D647-R653 PolarHBondContact OD1-NH1 3.21Å; D647-R653 IonicContact OD1-NH2 2.71Å; D647-R653 PolarHBondContact OD1-NH2 3.31Å; E648-R653 WeakPolarHBondContact O-CB 3.36Å; E648-R653 WeakPolarHBondContact O-CD 3.16Å; E648-R653 WeakPolarHBondContact O-CG 3.11Å; E648-R653 PolarHBondContact O-NH1 2.96Å; S650-R653 WeakPolarHBondContact O-CB 3.47Å; S650-R653 PolarHBondContact O-N 2.9Å
654	Y	89.5	Confident	81.3	Confident	8 Å²	8	57.2 Å²	57.2	3%	0.031	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	19.6	-172.2	-54.1	-74.4	0	0	0	113	P642 I643 V644 R652 P656 H707 Y708 M709	P642-Y654 HydrophobicContact CB-CD1 3.73Å; P642-Y654 HydrophobicContact CB-CE1 4.17Å; P642-Y654 HydrophobicContact CB-CG 4.37Å; P642-Y654 WeakPolarHBondContact O-CD1 3.43Å; P642-Y654 WeakPolarHBondContact O-CE1 2.99Å; I643-Y654 WeakPolarHBondContact O-CD1 3.45Å; V644-Y654 HydrophobicContact CG2-CD1 4.37Å; V644-Y654 HydrophobicContact CG2-CE1 3.86Å; R652-Y654 VanDerWaalsContact C-N 3.25Å; R652-Y654 PolarHBondContact O-N 2.82Å; Y654-P656 WeakPolarHBondContact O-CD 3.41Å; Y654-H707 HydrophobicContact CD2-CB 4.03Å; Y654-H707 HydrophobicContact CE2-CB 4.13Å; Y654-Y708 AromaticContact CD2-CD1 3.91Å; Y654-Y708 HydrophobicContact CD2-CD1 3.91Å; Y654-Y708 HydrophobicContact CE1-CD1 4.33Å; Y654-Y708 HydrophobicContact CE1-CE1 4.14Å; Y654-Y708 AromaticContact CE2-CD1 3.6Å; Y654-Y708 HydrophobicContact CE2-CD1 3.6Å; Y654-Y708 AromaticContact CE2-CE1 3.88Å; Y654-Y708 HydrophobicContact CE2-CE1 3.88Å; Y654-Y708 HydrophobicContact CG-CD1 4.39Å; Y654-Y708 AromaticContact CZ-CD1 3.83Å; Y654-Y708 AromaticContact CZ-CE1 3.64Å; Y654-M709 VanDerWaalsContact O-CE 3.3Å; Y654-M709 WeakPolarHBondContact O-CE 3.46Å
655	L	87.9	Confident	80.8	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.005	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-92.1	118.2	-177.3	-68.9	-174.5	0	0	0	112.2	F612 Y615 L616 Y620 Y645 W651 R652 M677 P679 M709	F612-L655 HydrophobicContact CD2-CD1 4.14Å; F612-L655 HydrophobicContact CE2-CD1 3.8Å; F612-L655 HydrophobicContact CE2-CD2 3.94Å; Y615-L655 HydrophobicContact CD1-CD1 3.9Å; Y615-L655 HydrophobicContact CE1-CB 4.32Å; Y615-L655 HydrophobicContact CE1-CD1 3.85Å; L616-L655 HydrophobicContact CD2-CB 4.34Å; L616-L655 HydrophobicContact CD2-CD1 4.23Å; Y620-L655 WeakPolarHBondContact CE2-O 3.41Å; Y620-L655 PolarHBondContact OH-O 2.85Å; Y645-L655 VanDerWaalsContact CB-O 3.31Å; Y645-L655 WeakPolarHBondContact CB-O 3.2Å; Y645-L655 WeakPolarHBondContact CD2-O 3.49Å; Y645-L655 VanDerWaalsContact CG-O 3.22Å; W651-L655 HydrophobicContact CE3-CD1 3.83Å; W651-L655 HydrophobicContact CZ3-CD1 3.84Å; R652-L655 PolarHBondContact O-N 3.4Å; R652-L655 VanDerWaalsContact O-N 3.13Å; L655-M677 WeakPolarHBondContact CD2-O 3.43Å; L655-P679 HydrophobicContact CD2-CG 3.87Å; L655-P679 HydrophobicContact CG-CG 4.42Å; L655-M709 HydrophobicContact CD2-CG 4.19Å; L655-M709 HydrophobicContact CD2-SD 4.16Å
656	P	86.1	Confident	80.4	Confident	20 Å²	20	60.8 Å²	60.8	13%	0.13	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-71.8	165.5	168.1	32.1	-36.2	0	0	0	111.6	Y645 Y654 M677 M709	Y645-P656 HydrophobicContact CE1-CB 3.98Å; Y645-P656 HydrophobicContact CE2-CB 4.19Å; Y654-P656 WeakPolarHBondContact O-CD 3.41Å; P656-M677 HydrophobicContact CG-CE 3.81Å; P656-M677 HydrophobicContact CG-CG 4.34Å; P656-M677 HydrophobicContact CG-SD 4.19Å; P656-M709 WeakPolarHBondContact CD-SD 3.36Å; P656-M709 HydrophobicContact CG-CE 4.35Å; P656-M709 HydrophobicContact CG-SD 4.24Å
657	P	84.4	Confident	80.3	Confident	50 Å²	50	59.8 Å²	59.8	33%	0.325	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-64.4	153	165.3	29.9	-34.1	0	0	0	110.5	Y620	Y620-P657 HydrophobicContact CD1-CB 4.21Å; Y620-P657 HydrophobicContact CE1-CB 3.85Å; Y620-P657 HydrophobicContact CE1-CG 4.41Å; Y620-P657 HydrophobicContact CE2-CB 4.46Å; Y620-P657 WeakPolarHBondContact OH-CD 3.29Å
658	L	79.8	Confident	80.3	Confident	36 Å²	36	54.4 Å²	54.4	19%	0.188	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-64.8	141.4	169.1	-80.6	170.8	0	0	0	110.2	L616 V617 D673 L674 M677	L616-L658 HydrophobicContact CB-CD1 3.92Å; L616-L658 HydrophobicContact CB-CG 4.15Å; V617-L658 HydrophobicContact CG2-CD1 3.64Å; L658-D673 HydrophobicContact CD2-CB 4.05Å; L658-L674 HydrophobicContact CD2-CD2 4.45Å; L658-M677 HydrophobicContact CD2-CE 4.14Å; L658-M677 HydrophobicContact CD2-SD 3.79Å
659	P	71.6	Confident	80.4	Confident	79 Å²	79	51 Å²	51	51%	0.513	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-58.3	134.8	176.9	-24	34.2	0	0	0	111.4	R661	P659-R661 PolarHBondContact O-N 3.35Å
660	P	65.4	Low	80.5	Confident	114 Å²	114	47.3 Å²	47.3	74%	0.74	26%	0.264	S	S	*	.			trans	-65.8	109.8	179.1	26.1	-33.4	0	0	0	110.6	N662	P660-N662 PolarHBondContact O-N 2.91Å
661	R	66.2	Low	80.4	Confident	74 Å²	74	46.6 Å²	46.6	28%	0.279	26%	0.259	S	S	.	.			trans	-90.2	84.8	173	-74.9	175.6	171.7	-94.1	7	108.9	P659 D663 L664 D673 Y760	P659-R661 PolarHBondContact O-N 3.35Å; R661-D663 VanDerWaalsContact C-OD1 3.25Å; R661-D663 WeakPolarHBondContact CA-OD1 3.28Å; R661-D663 WeakPolarHBondContact CB-OD1 3.29Å; R661-D663 PolarHBondContact O-N 3.23Å; R661-L664 HydrophobicContact CB-CD1 4.41Å; R661-L664 PolarHBondContact O-N 2.92Å; R661-L664 VanDerWaalsContact O-N 3.12Å; R661-D673 IonicContact CZ-OD1 2.68Å; R661-D673 IonicContact CZ-OD2 3.14Å; R661-D673 VanDerWaalsContact CZ-OD2 3.26Å; R661-D673 IonicContact NE-OD2 2.74Å; R661-D673 PolarHBondContact NE-OD2 3.43Å; R661-D673 VanDerWaalsContact NH2-CG 3.31Å; R661-D673 IonicContact NH2-OD1 2.7Å; R661-D673 PolarHBondContact NH2-OD1 2.99Å; R661-D673 IonicContact NH2-OD2 3.58Å; R661-D673 PolarHBondContact NH2-OD2 3Å; R661-Y760 PolarHBondContact NH1-OH 2.78Å
662	N	58.9	Low	80	Confident	157 Å²	157	48.2 Å²	48.2	84%	0.84	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-11.1	-176.7	-63.9	-9.5	0	0	0	113.8	P660	P660-N662 PolarHBondContact O-N 2.91Å
663	D	68.3	Low	79.7	Confident	110 Å²	110	47.5 Å²	47.5	59%	0.588	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.2	178.4	58.7	-53.3	0	0	0	114.7	R661	R661-D663 VanDerWaalsContact C-OD1 3.25Å; R661-D663 WeakPolarHBondContact CA-OD1 3.28Å; R661-D663 WeakPolarHBondContact CB-OD1 3.29Å; R661-D663 PolarHBondContact O-N 3.23Å
664	L	72	Confident	79.6	Confident	27 Å²	27	45.9 Å²	45.9	14%	0.141	26%	0.262	C	S	.	.	S	Bend	trans	-128.4	143.1	-172.9	-65.1	176.6	0	0	0	113.8	R661 W668 Y760 F846	R661-L664 HydrophobicContact CB-CD1 4.41Å; R661-L664 PolarHBondContact O-N 2.92Å; R661-L664 VanDerWaalsContact O-N 3.12Å; L664-W668 HydrophobicContact CB-CB 4.21Å; L664-W668 HydrophobicContact CD1-CB 4.3Å; L664-Y760 HydrophobicContact CD1-CD1 3.87Å; L664-Y760 HydrophobicContact CD1-CE1 3.68Å; L664-F846 HydrophobicContact CD2-CD1 3.94Å; L664-F846 HydrophobicContact CD2-CD2 4.2Å; L664-F846 HydrophobicContact CD2-CE1 3.7Å; L664-F846 HydrophobicContact CD2-CE2 3.95Å; L664-F846 HydrophobicContact CD2-CG 4.2Å; L664-F846 HydrophobicContact CD2-CZ 3.71Å
665	P	76.1	Confident	79.3	Confident	53 Å²	53	45.6 Å²	45.6	34%	0.344	26%	0.261	S	S	.	.			trans	-60.8	151	172.4	-22.3	32.5	0	0	0	113.3	G667 W668 F846	P665-G667 PolarHBondContact O-N 2.81Å; P665-W668 PolarHBondContact O-N 3.21Å; P665-F846 HydrophobicContact CG-CB 4.3Å
666	S	79.4	Confident	79	Confident	97 Å²	97	48 Å²	48	68%	0.678	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	134.7	178.8	-175.3	0	0	0	0	112.1	F762	S666-F762 WeakPolarHBondContact O-CE2 3.46Å
667	G	83.7	Confident	79	Confident	4 Å²	4	48.1 Å²	48.1	4%	0.041	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	100	-11.6	-176.7	0	0	0	0	0	115.4	P665 F762 V763	P665-G667 PolarHBondContact O-N 2.81Å; G667-F762 CarbonylContact O-C 3.13Å; G667-F762 WeakPolarHBondContact O-CA 3.08Å; G667-V763 PolarHBondContact O-N 3.19Å
668	W	87.4	Confident	79.1	Confident	19 Å²	19	45.7 Å²	45.7	7%	0.072	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	144	172.5	-74.5	101.2	0	0	0	112.5	L664 P665 Y761 F762 F846 V849	L664-W668 HydrophobicContact CB-CB 4.21Å; L664-W668 HydrophobicContact CD1-CB 4.3Å; P665-W668 PolarHBondContact O-N 3.21Å; W668-Y761 CarbonylContact C-O 3.45Å; W668-Y761 WeakPolarHBondContact CA-O 3.48Å; W668-Y761 VanDerWaalsContact CE3-O 3.32Å; W668-F762 AromaticContact CD1-CD2 3.77Å; W668-F762 HydrophobicContact CD2-CB 3.73Å; W668-F762 HydrophobicContact CD2-CD2 4.11Å; W668-F762 HydrophobicContact CD2-CG 4.43Å; W668-F762 AromaticContact CE2-CD2 3.87Å; W668-F762 HydrophobicContact CE3-CB 3.79Å; W668-F762 HydrophobicContact CG-CB 4.38Å; W668-F762 HydrophobicContact CG-CD2 4.04Å; W668-F762 HydrophobicContact CH2-CB 3.97Å; W668-F762 HydrophobicContact CZ2-CB 3.91Å; W668-F762 HydrophobicContact CZ3-CB 3.9Å; W668-F762 AromaticContact NE1-CD2 3.66Å; W668-F846 AromaticContact CD2-CD1 3.73Å; W668-F846 HydrophobicContact CD2-CD1 3.73Å; W668-F846 HydrophobicContact CD2-CE1 4.21Å; W668-F846 AromaticContact CE2-CD1 3.58Å; W668-F846 HydrophobicContact CE3-CD1 4.04Å; W668-F846 HydrophobicContact CE3-CE1 4.12Å; W668-F846 HydrophobicContact CG-CD1 4.26Å; W668-F846 HydrophobicContact CH2-CD1 4.1Å; W668-F846 HydrophobicContact CZ2-CB 4.48Å; W668-F846 AromaticContact CZ2-CD1 3.78Å; W668-F846 HydrophobicContact CZ2-CD1 3.78Å; W668-F846 HydrophobicContact CZ3-CD1 4.23Å; W668-F846 HydrophobicContact CZ3-CE1 4.29Å; W668-F846 AromaticContact NE1-CD1 3.95Å; W668-F846 PolarHBondContact NE1-O 2.81Å; W668-V849 HydrophobicContact CH2-CG2 3.99Å; W668-V849 HydrophobicContact CZ2-CG2 3.45Å; W668-V849 VanDerWaalsContact CZ2-CG2 3.45Å
669	F	87.9	Confident	79.7	Confident	3 Å²	3	44 Å²	44	1%	0.013	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160.4	174.6	71.8	-84.6	0	0	0	111.7	I613 V617 V671 L674 I744 Y761 V763	I613-F669 HydrophobicContact CD1-CE2 4.01Å; I613-F669 HydrophobicContact CD1-CZ 3.77Å; I613-F669 HydrophobicContact CG1-CZ 4.48Å; I613-F669 HydrophobicContact CG2-CD1 4.14Å; I613-F669 HydrophobicContact CG2-CE1 3.67Å; I613-F669 HydrophobicContact CG2-CE2 4.45Å; I613-F669 HydrophobicContact CG2-CZ 3.84Å; V617-F669 HydrophobicContact CG2-CB 4.02Å; V617-F669 HydrophobicContact CG2-CD1 4.19Å; V617-F669 HydrophobicContact CG2-CG 4.26Å; F669-V671 HydrophobicContact CE2-CG2 4.47Å; F669-L674 HydrophobicContact CD2-CD1 3.59Å; F669-L674 HydrophobicContact CD2-CG 4.14Å; F669-L674 HydrophobicContact CE2-CD1 3.45Å; F669-L674 VanDerWaalsContact CE2-CD1 3.45Å; F669-L674 HydrophobicContact CE2-CG 4.47Å; F669-L674 HydrophobicContact CZ-CD1 4.49Å; F669-I744 HydrophobicContact CZ-CD1 4.17Å; F669-Y761 WeakPolarHBondContact CD1-O 3.37Å; F669-Y761 HydrophobicContact CZ-CG 4.17Å; F669-Y761 PolarHBondContact N-O 2.63Å; F669-Y761 PolarHBondContact O-N 3.07Å; F669-V763 HydrophobicContact CD1-CG2 3.75Å; F669-V763 HydrophobicContact CE1-CG2 3.62Å
670	H	86.5	Confident	80.4	Confident	22 Å²	22	40.2 Å²	40.2	10%	0.102	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	147.7	173.5	-175.6	-113.6	0	0	0	111.1	D672 D673 Y760	H670-D672 IonicContact CE1-OD2 3.41Å; H670-D672 PolarHBondContact CE1-OD2 3.25Å; H670-D672 IonicContact ND1-OD2 2.77Å; H670-D672 IonicContact NE2-OD2 3.54Å; H670-D672 PolarHBondContact O-N 3.08Å; H670-D673 IonicContact CG-OD1 2.69Å; H670-D673 IonicContact ND1-OD1 3.37Å; H670-D673 PolarHBondContact ND1-OD1 3.37Å; H670-Y760 HydrophobicContact CB-CD1 3.88Å; H670-Y760 HydrophobicContact CB-CE1 3.73Å
671	V	85.8	Confident	81.4	Confident	1 Å²	1	35 Å²	35	1%	0.006	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-28	-171	-178.1	0	0	0	0	113	F669 L674 V675 L731 I732 Y761	F669-V671 HydrophobicContact CE2-CG2 4.47Å; V671-L674 WeakPolarHBondContact O-CB 3.45Å; V671-L674 PolarHBondContact O-N 3.14Å; V671-V675 WeakPolarHBondContact O-CG2 3.5Å; V671-L731 HydrophobicContact CG1-CB 3.78Å; V671-L731 HydrophobicContact CG1-CD1 4.49Å; V671-I732 HydrophobicContact CB-CG1 4.27Å; V671-I732 HydrophobicContact CG1-CG1 3.85Å; V671-I732 HydrophobicContact CG2-CG1 4.33Å; V671-Y761 HydrophobicContact CG2-CD2 3.54Å; V671-Y761 HydrophobicContact CG2-CE2 3.46Å; V671-Y761 VanDerWaalsContact CG2-CE2 3.46Å
672	D	82.5	Confident	82.5	Confident	56 Å²	56	31.7 Å²	31.7	30%	0.299	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-31.5	179.8	-71.9	-59.5	0	0	0	113.5	H670 L674 V675 P676 R728	H670-D672 IonicContact CE1-OD2 3.41Å; H670-D672 PolarHBondContact CE1-OD2 3.25Å; H670-D672 IonicContact ND1-OD2 2.77Å; H670-D672 IonicContact NE2-OD2 3.54Å; H670-D672 PolarHBondContact O-N 3.08Å; D672-L674 PolarHBondContact O-N 3.2Å; D672-V675 PolarHBondContact O-N 3.49Å; D672-P676 WeakPolarHBondContact O-CD 3.31Å; D672-R728 WeakPolarHBondContact OD1-CD 3.4Å; D672-R728 WeakPolarHBondContact OD1-CG 3.36Å; D672-R728 IonicContact OD1-CZ 3.96Å; D672-R728 IonicContact OD1-NE 2.64Å; D672-R728 PolarHBondContact OD1-NE 2.87Å; D672-R728 IonicContact OD1-NH2 4Å; D672-R728 IonicContact OD2-CZ 3.17Å; D672-R728 IonicContact OD2-NE 2.75Å; D672-R728 PolarHBondContact OD2-NE 3.24Å; D672-R728 IonicContact OD2-NH2 2.78Å; D672-R728 PolarHBondContact OD2-NH2 2.91Å
673	D	84.1	Confident	83.8	Confident	31 Å²	31	24.2 Å²	24.2	17%	0.166	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-34	174.4	-46.7	9.9	0	0	0	110.5	L658 R661 H670	L658-D673 HydrophobicContact CD2-CB 4.05Å; R661-D673 IonicContact CZ-OD1 2.68Å; R661-D673 IonicContact CZ-OD2 3.14Å; R661-D673 VanDerWaalsContact CZ-OD2 3.26Å; R661-D673 IonicContact NE-OD2 2.74Å; R661-D673 PolarHBondContact NE-OD2 3.43Å; R661-D673 VanDerWaalsContact NH2-CG 3.31Å; R661-D673 IonicContact NH2-OD1 2.7Å; R661-D673 PolarHBondContact NH2-OD1 2.99Å; R661-D673 IonicContact NH2-OD2 3.58Å; R661-D673 PolarHBondContact NH2-OD2 3Å; H670-D673 IonicContact CG-OD1 2.69Å; H670-D673 IonicContact ND1-OD1 3.37Å; H670-D673 PolarHBondContact ND1-OD1 3.37Å
674	L	87.1	Confident	84.4	Confident	1 Å²	1	19 Å²	19	1%	0.005	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-15.7	178.2	-59.4	179.3	0	0	0	114.9	F612 I613 L616 L658 F669 V671 D672 L678 L731	F612-L674 HydrophobicContact CE1-CB 4.28Å; F612-L674 HydrophobicContact CE1-CD2 4.07Å; I613-L674 HydrophobicContact CD1-CD1 3.81Å; I613-L674 HydrophobicContact CG1-CD1 3.68Å; L616-L674 HydrophobicContact CD1-CD2 3.79Å; L658-L674 HydrophobicContact CD2-CD2 4.45Å; F669-L674 HydrophobicContact CD2-CD1 3.59Å; F669-L674 HydrophobicContact CD2-CG 4.14Å; F669-L674 HydrophobicContact CE2-CD1 3.45Å; F669-L674 VanDerWaalsContact CE2-CD1 3.45Å; F669-L674 HydrophobicContact CE2-CG 4.47Å; F669-L674 HydrophobicContact CZ-CD1 4.49Å; V671-L674 WeakPolarHBondContact O-CB 3.45Å; V671-L674 PolarHBondContact O-N 3.14Å; D672-L674 PolarHBondContact O-N 3.2Å; L674-L678 PolarHBondContact O-N 3.09Å; L674-L731 HydrophobicContact CB-CD1 4.22Å
675	V	84.4	Confident	84.9	Confident	2 Å²	2	18 Å²	18	1%	0.012	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-48.8	-175.6	-168	0	0	0	0	112.9	V671 D672 M677 F724 V727 R728 L731	V671-V675 WeakPolarHBondContact O-CG2 3.5Å; D672-V675 PolarHBondContact O-N 3.49Å; V675-M677 VanDerWaalsContact C-N 3.34Å; V675-F724 HydrophobicContact CB-CD1 4.26Å; V675-F724 HydrophobicContact CG1-CB 4.08Å; V675-F724 HydrophobicContact CG1-CD1 3.57Å; V675-F724 HydrophobicContact CG1-CE1 4.45Å; V675-F724 HydrophobicContact CG1-CG 4.24Å; V675-V727 HydrophobicContact CG1-CB 3.91Å; V675-V727 HydrophobicContact CG1-CG1 3.92Å; V675-R728 HydrophobicContact CG2-CB 3.95Å; V675-R728 HydrophobicContact CG2-CG 4.41Å; V675-L731 HydrophobicContact CG2-CD1 4.16Å
676	P	80.9	Confident	85.2	Confident	52 Å²	52	15.5 Å²	15.5	34%	0.338	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-36.3	177.5	27.7	-33	0	0	0	111.7	D672 L678 M709 I710 G711 F724	D672-P676 WeakPolarHBondContact O-CD 3.31Å; P676-L678 VanDerWaalsContact C-N 3.26Å; P676-L678 PolarHBondContact O-N 3.37Å; P676-M709 WeakPolarHBondContact O-CB 3.36Å; P676-I710 PolarHBondContact O-N 3.4Å; P676-G711 PolarHBondContact O-N 2.99Å; P676-G711 VanDerWaalsContact O-N 3.13Å; P676-F724 HydrophobicContact CB-CE1 4.16Å
677	M	85.7	Confident	85	Confident	22 Å²	22	11 Å²	11	11%	0.108	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-9	-178	-63.4	-173.8	178.7	0	0	114.7	F612 L616 L655 P656 L658 V675 P679 M709	F612-M677 HydrophobicContact CZ-CB 4.33Å; L616-M677 HydrophobicContact CD1-SD 4.39Å; L655-M677 WeakPolarHBondContact CD2-O 3.43Å; P656-M677 HydrophobicContact CG-CE 3.81Å; P656-M677 HydrophobicContact CG-CG 4.34Å; P656-M677 HydrophobicContact CG-SD 4.19Å; L658-M677 HydrophobicContact CD2-CE 4.14Å; L658-M677 HydrophobicContact CD2-SD 3.79Å; V675-M677 VanDerWaalsContact C-N 3.34Å; M677-P679 VanDerWaalsContact O-CD 3.23Å; M677-P679 WeakPolarHBondContact O-CD 3.49Å; M677-M709 HydrophobicContact CB-SD 4.2Å; M677-M709 HydrophobicContact CG-SD 4.35Å
678	L	88.3	Confident	84.1	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.067	C	C	.	.			trans	-69.2	121.1	-173.6	-170	68.7	0	0	0	111.2	F612 L674 P676 I682 A683 I710 V727 L731	F612-L678 HydrophobicContact CD1-CD1 3.97Å; F612-L678 HydrophobicContact CE1-CD1 3.72Å; F612-L678 HydrophobicContact CG-CD1 4.44Å; F612-L678 HydrophobicContact CZ-CD1 4.02Å; L674-L678 PolarHBondContact O-N 3.09Å; P676-L678 VanDerWaalsContact C-N 3.26Å; P676-L678 PolarHBondContact O-N 3.37Å; L678-I682 HydrophobicContact CD1-CB 4.22Å; L678-I682 HydrophobicContact CD1-CG2 3.85Å; L678-A683 HydrophobicContact CD2-CB 3.84Å; L678-A683 HydrophobicContact CG-CB 4.21Å; L678-I710 HydrophobicContact CB-CD1 4.1Å; L678-I710 HydrophobicContact CD2-CD1 4.16Å; L678-I710 WeakPolarHBondContact O-CG1 3.49Å; L678-I710 PolarHBondContact O-N 2.7Å; L678-V727 HydrophobicContact CD2-CG1 3.74Å; L678-L731 HydrophobicContact CD2-CD2 4.26Å
679	P	90.7	Very high	82.6	Confident	0 Å²	0	13 Å²	13	0%	0	8%	0.075	C	C	.	.	B	Isolated β-bridge	trans	-65.2	141	177.7	-24.4	35.5	0	0	0	112.1	F612 W651 L655 M677 S681 I682 A683	F612-P679 VanDerWaalsContact CE2-CD 3.48Å; F612-P679 HydrophobicContact CE2-CG 4.25Å; W651-P679 HydrophobicContact CB-CB 4.26Å; W651-P679 HydrophobicContact CB-CG 4.24Å; W651-P679 VanDerWaalsContact O-CG 3.31Å; W651-P679 WeakPolarHBondContact O-CG 3.27Å; L655-P679 HydrophobicContact CD2-CG 3.87Å; L655-P679 HydrophobicContact CG-CG 4.42Å; M677-P679 VanDerWaalsContact O-CD 3.23Å; M677-P679 WeakPolarHBondContact O-CD 3.49Å; P679-S681 PolarHBondContact O-N 3.36Å; P679-S681 VanDerWaalsContact O-N 3.16Å; P679-I682 HydrophobicContact CB-CG1 4.36Å; P679-I682 HydrophobicContact CG-CD1 4.22Å; P679-I682 HydrophobicContact CG-CG1 4.5Å; P679-I682 WeakPolarHBondContact O-CA 3.47Å; P679-I682 PolarHBondContact O-N 2.88Å; P679-A683 PolarHBondContact O-N 3.25Å
680	L	86.6	Confident	80.7	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-52.9	-39.7	178.8	178	61.6	0	0	0	112.2	I682 A683 C684 F696 Y699 L700 R706 Y708 L713 M722	L680-I682 PolarHBondContact O-N 3Å; L680-A683 PolarHBondContact O-N 3.06Å; L680-C684 VanDerWaalsContact CD1-SG 3.55Å; L680-C684 WeakPolarHBondContact O-CB 3.39Å; L680-C684 PolarHBondContact O-N 3.18Å; L680-F696 HydrophobicContact CD1-CD1 4.18Å; L680-F696 HydrophobicContact CD1-CE1 4.26Å; L680-F696 HydrophobicContact CD2-CD1 4.19Å; L680-Y699 HydrophobicContact CD2-CG 4.35Å; L680-L700 HydrophobicContact CD2-CD2 4.32Å; L680-L700 HydrophobicContact CG-CD2 4.09Å; L680-R706 CarbonylContact C-O 3.57Å; L680-R706 WeakPolarHBondContact CB-O 3.29Å; L680-Y708 PolarHBondContact N-O 3Å; L680-L713 HydrophobicContact CB-CD1 4.46Å; L680-L713 HydrophobicContact CD1-CD1 4.1Å; L680-L713 HydrophobicContact CD2-CD1 4.33Å; L680-L713 HydrophobicContact CD2-CD2 4.14Å; L680-M722 HydrophobicContact CD1-CE 3.68Å
681	S	87.8	Confident	78.8	Confident	5 Å²	5	19.2 Å²	19.2	4%	0.035	11%	0.105	C	C	.	.	H	α-helix	trans	-61.2	-25.8	175.7	58.1	0	0	0	0	114.6	P679 Q685 R706 H707	P679-S681 PolarHBondContact O-N 3.36Å; P679-S681 VanDerWaalsContact O-N 3.16Å; S681-Q685 WeakPolarHBondContact O-CG 3.42Å; S681-Q685 PolarHBondContact O-NE2 3.29Å; S681-R706 WeakPolarHBondContact CA-O 3.5Å; S681-R706 VanDerWaalsContact CB-O 3.25Å; S681-R706 WeakPolarHBondContact CB-O 3.47Å; S681-R706 PolarHBondContact N-O 2.9Å; S681-H707 WeakPolarHBondContact CB-ND1 3.39Å; S681-H707 PolarHBondContact OG-ND1 3.07Å
682	I	89.2	Confident	76.8	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.015	13%	0.126	C	C	.	.	H	α-helix	trans	-91.9	-42.6	174.1	-58.6	-174	0	0	0	109.6	L608 F612 W651 L678 P679 L680 C684 Q685 I686	L608-I682 HydrophobicContact CB-CG2 4.47Å; F612-I682 HydrophobicContact CB-CD1 4.19Å; F612-I682 HydrophobicContact CD2-CD1 4.04Å; F612-I682 HydrophobicContact CG-CD1 4.35Å; W651-I682 HydrophobicContact CB-CD1 4.11Å; W651-I682 HydrophobicContact CB-CG1 4.25Å; W651-I682 HydrophobicContact CD2-CD1 3.78Å; W651-I682 HydrophobicContact CE3-CD1 3.89Å; W651-I682 HydrophobicContact CG-CD1 3.89Å; W651-I682 HydrophobicContact CG-CG1 4.36Å; L678-I682 HydrophobicContact CD1-CB 4.22Å; L678-I682 HydrophobicContact CD1-CG2 3.85Å; P679-I682 HydrophobicContact CB-CG1 4.36Å; P679-I682 HydrophobicContact CG-CD1 4.22Å; P679-I682 HydrophobicContact CG-CG1 4.5Å; P679-I682 WeakPolarHBondContact O-CA 3.47Å; P679-I682 PolarHBondContact O-N 2.88Å; L680-I682 PolarHBondContact O-N 3Å; I682-C684 PolarHBondContact O-N 2.73Å; I682-Q685 WeakPolarHBondContact O-CB 3.22Å; I682-Q685 PolarHBondContact O-N 2.9Å; I682-I686 HydrophobicContact CG2-CD1 3.73Å; I682-I686 HydrophobicContact CG2-CG1 4.34Å; I682-I686 PolarHBondContact O-N 3.12Å; I682-I686 VanDerWaalsContact O-N 3.08Å
683	A	85.6	Confident	75.3	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-55.8	-50.6	179.3	0	0	0	0	0	112.2	L678 P679 L680 Q685 I686 V687 I710 M722	L678-A683 HydrophobicContact CD2-CB 3.84Å; L678-A683 HydrophobicContact CG-CB 4.21Å; P679-A683 PolarHBondContact O-N 3.25Å; L680-A683 PolarHBondContact O-N 3.06Å; A683-Q685 PolarHBondContact O-N 3.04Å; A683-I686 PolarHBondContact O-N 2.8Å; A683-V687 WeakPolarHBondContact O-CB 3.29Å; A683-V687 PolarHBondContact O-N 2.89Å; A683-I710 HydrophobicContact CB-CD1 3.83Å; A683-I710 HydrophobicContact CB-CG1 4.27Å; A683-M722 HydrophobicContact CB-CE 3.76Å; A683-M722 HydrophobicContact CB-SD 3.88Å
684	C	80.8	Confident	73.7	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.5	-5.6	177.2	-76.6	0	0	0	0	114.9	L680 I682 V687 L700 M722	L680-C684 VanDerWaalsContact CD1-SG 3.55Å; L680-C684 WeakPolarHBondContact O-CB 3.39Å; L680-C684 PolarHBondContact O-N 3.18Å; I682-C684 PolarHBondContact O-N 2.73Å; C684-V687 CarbonylContact C-O 3.37Å; C684-V687 VanDerWaalsContact O-O 3.11Å; C684-L700 HydrophobicContact CB-CD2 4.27Å; C684-M722 WeakPolarHBondContact SG-CE 3.49Å
685	Q	83.3	Confident	72.2	Confident	7 Å²	7	30.2 Å²	30.2	3%	0.033	17%	0.166	C	C	.	.	H	α-helix	trans	-104	-24.4	173.6	-65.4	-165.5	73	0	0	112.5	Q600 R605 L608 S681 I682 A683 C885 E886 N889	Q600-Q685 HydrophobicContact CG-CB 3.85Å; Q600-Q685 HydrophobicContact CG-CG 4.36Å; Q600-Q685 WeakPolarHBondContact CG-O 3.39Å; R605-Q685 VanDerWaalsContact CD-O 3.28Å; R605-Q685 WeakPolarHBondContact CD-O 3.31Å; R605-Q685 WeakPolarHBondContact CG-O 3.44Å; L608-Q685 HydrophobicContact CD1-CB 3.79Å; S681-Q685 WeakPolarHBondContact O-CG 3.42Å; S681-Q685 PolarHBondContact O-NE2 3.29Å; I682-Q685 WeakPolarHBondContact O-CB 3.22Å; I682-Q685 PolarHBondContact O-N 2.9Å; A683-Q685 PolarHBondContact O-N 3.04Å; Q685-C885 PolarHBondContact NE2-O 3.16Å; Q685-E886 HydrophobicContact CG-CG 4.05Å; Q685-N889 PolarHBondContact OE1-ND2 2.74Å
686	I	82	Confident	71.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-86.3	-42.1	176.2	-72.8	-179.8	0	0	0	111.7	R605 L609 I682 A683 R730 L731 I734	R605-I686 HydrophobicContact CG-CG1 4.43Å; L609-I686 HydrophobicContact CB-CD1 4.38Å; L609-I686 HydrophobicContact CD1-CD1 4.48Å; I682-I686 HydrophobicContact CG2-CD1 3.73Å; I682-I686 HydrophobicContact CG2-CG1 4.34Å; I682-I686 PolarHBondContact O-N 3.12Å; I682-I686 VanDerWaalsContact O-N 3.08Å; A683-I686 PolarHBondContact O-N 2.8Å; I686-R730 HydrophobicContact CG2-CB 4.41Å; I686-R730 HydrophobicContact CG2-CG 3.45Å; I686-R730 VanDerWaalsContact CG2-CG 3.45Å; I686-R730 PolarHBondContact O-NE 3.27Å; I686-L731 HydrophobicContact CD1-CD2 4.15Å; I686-L731 HydrophobicContact CG2-CD2 4.48Å; I686-I734 HydrophobicContact CD1-CD1 4.38Å; I686-I734 HydrophobicContact CG1-CD1 4.3Å; I686-I734 HydrophobicContact CG2-CD1 3.76Å
687	V	75.5	Confident	70.8	Confident	4 Å²	4	31 Å²	31	2%	0.024	17%	0.169	C	C	.	.	S	Bend	trans	-99.1	163	173.1	169.6	0	0	0	0	109	A683 C684 F726 R730	A683-V687 WeakPolarHBondContact O-CB 3.29Å; A683-V687 PolarHBondContact O-N 2.89Å; C684-V687 CarbonylContact C-O 3.37Å; C684-V687 VanDerWaalsContact O-O 3.11Å; V687-F726 HydrophobicContact CB-CE1 4.5Å; V687-F726 HydrophobicContact CG1-CD1 4.35Å; V687-F726 HydrophobicContact CG1-CE1 3.9Å; V687-F726 HydrophobicContact CG2-CD1 4.13Å; V687-F726 HydrophobicContact CG2-CE1 3.95Å; V687-R730 HydrophobicContact CG2-CG 4.35Å
688	V	64.7	Low	70.2	Confident	30 Å²	30	35.5 Å²	35.5	18%	0.182	19%	0.19	C	C	.	.			trans	-119	113.2	171.6	161.1	0	0	0	0	106.7
689	P	56.2	Low	69.7	Low	35 Å²	35	37.3 Å²	37.3	23%	0.227	20%	0.198	C	C	.	.			trans	-57.9	153.5	161.5	28.1	-33.9	0	0	0	108.4
690	S	47.6	Very low	69.1	Low	13 Å²	13	38 Å²	38	9%	0.091	20%	0.201	C	C	.	.			trans	-75	-171	177.6	74.1	0	0	0	0	110.9	E692 V693 Y721	S690-E692 WeakPolarHBondContact CB-OE2 3.27Å; S690-E692 PolarHBondContact OG-N 3.16Å; S690-E692 PolarHBondContact OG-OE2 3.17Å; S690-V693 WeakPolarHBondContact OG-CG2 3.44Å; S690-Y721 VanDerWaalsContact OG-CE1 3.24Å; S690-Y721 WeakPolarHBondContact OG-CE1 3.16Å; S690-Y721 PolarHBondContact OG-OH 2.92Å
691	E	45.8	Very low	68.6	Low	141 Å²	141	42.3 Å²	42.3	66%	0.659	23%	0.23	S	C	*	.	S	Bend	trans	-95.1	13.6	-178.2	-74.7	143.4	157.6	0	0	110.5	K596 R882	K596-E691 WeakPolarHBondContact CE-OE2 3.27Å; K596-E691 IonicContact NZ-OE2 3.05Å; K596-E691 PolarHBondContact NZ-OE2 2.93Å; E691-R882 IonicContact OE1-NH2 3.47Å
692	E	44.3	Very low	68.4	Low	96 Å²	96	44.4 Å²	44.4	45%	0.449	24%	0.241	S	C	.	.	S	Bend	trans	-125.9	40.7	-171.3	-52.1	110.4	165.4	0	0	111.1	Y593 S690	Y593-E692 PolarHBondContact OH-OE2 2.66Å; S690-E692 WeakPolarHBondContact CB-OE2 3.27Å; S690-E692 PolarHBondContact OG-N 3.16Å; S690-E692 PolarHBondContact OG-OE2 3.17Å
693	V	49.7	Very low	68.1	Low	22 Å²	22	52.9 Å²	52.9	13%	0.133	27%	0.273	C	S	.	.			trans	-146.7	77.2	-169	-158.7	0	0	0	0	114.7	S690 C695 F696 Y721	S690-V693 WeakPolarHBondContact OG-CG2 3.44Å; V693-C695 VanDerWaalsContact C-N 3.31Å; V693-C695 VanDerWaalsContact CG1-SG 3.51Å; V693-C695 PolarHBondContact O-N 3.42Å; V693-F696 HydrophobicContact CG1-CD2 3.69Å; V693-F696 HydrophobicContact CG1-CE2 4.13Å; V693-Y721 HydrophobicContact CB-CE2 4.39Å; V693-Y721 HydrophobicContact CG1-CD2 3.92Å; V693-Y721 HydrophobicContact CG1-CE2 4.05Å; V693-Y721 HydrophobicContact CG1-CG 4.41Å; V693-Y721 HydrophobicContact CG2-CD1 3.88Å; V693-Y721 HydrophobicContact CG2-CD2 3.87Å; V693-Y721 HydrophobicContact CG2-CE1 3.41Å; V693-Y721 VanDerWaalsContact CG2-CE1 3.41Å; V693-Y721 HydrophobicContact CG2-CE2 3.41Å; V693-Y721 VanDerWaalsContact CG2-CE2 3.41Å; V693-Y721 HydrophobicContact CG2-CG 4.11Å
694	D	50.8	Low	68.1	Low	133 Å²	133	54.9 Å²	54.9	71%	0.711	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-76.1	-12.7	173.8	-83.3	-53.7	0	0	0	114.7	F696 T697	D694-F696 PolarHBondContact O-N 2.77Å; D694-T697 VanDerWaalsContact O-CB 3.29Å; D694-T697 WeakPolarHBondContact O-CB 3.45Å; D694-T697 PolarHBondContact O-N 3.43Å; D694-T697 PolarHBondContact O-OG1 3.13Å; D694-T697 PolarHBondContact OD1-OG1 2.9Å
695	C	56.2	Low	68.3	Low	70 Å²	70	57.6 Å²	57.6	47%	0.473	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-66.6	-9.6	178.8	74.7	0	0	0	0	115	V693 Y699	V693-C695 VanDerWaalsContact C-N 3.31Å; V693-C695 VanDerWaalsContact CG1-SG 3.51Å; V693-C695 PolarHBondContact O-N 3.42Å; C695-Y699 WeakPolarHBondContact O-CD2 3.45Å
696	F	67.4	Low	68.5	Low	4 Å²	4	57.6 Å²	57.6	2%	0.018	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-103.9	-6.6	166.9	-66.5	-61.9	0	0	0	113.5	L680 V693 D694 E698 Y699 L700 L713 S717 M722	L680-F696 HydrophobicContact CD1-CD1 4.18Å; L680-F696 HydrophobicContact CD1-CE1 4.26Å; L680-F696 HydrophobicContact CD2-CD1 4.19Å; V693-F696 HydrophobicContact CG1-CD2 3.69Å; V693-F696 HydrophobicContact CG1-CE2 4.13Å; D694-F696 PolarHBondContact O-N 2.77Å; F696-E698 PolarHBondContact O-N 2.63Å; F696-Y699 PolarHBondContact O-N 3.17Å; F696-L700 HydrophobicContact CB-CD1 3.9Å; F696-L700 HydrophobicContact CB-CG 4.33Å; F696-L700 WeakPolarHBondContact O-CB 3.4Å; F696-L700 WeakPolarHBondContact O-CG 3.35Å; F696-L700 PolarHBondContact O-N 2.94Å; F696-L713 HydrophobicContact CE1-CD1 4.2Å; F696-S717 WeakPolarHBondContact CZ-O 3.37Å; F696-M722 HydrophobicContact CZ-CG 4.21Å
697	T	67.7	Low	68.9	Low	65 Å²	65	58 Å²	58	40%	0.399	30%	0.298	S	S	.	.	H	α-helix	trans	-63.3	-42.9	-178.1	-63.3	0	0	0	0	110.5	D694 L700 C701	D694-T697 VanDerWaalsContact O-CB 3.29Å; D694-T697 WeakPolarHBondContact O-CB 3.45Å; D694-T697 PolarHBondContact O-N 3.43Å; D694-T697 PolarHBondContact O-OG1 3.13Å; D694-T697 PolarHBondContact OD1-OG1 2.9Å; T697-L700 PolarHBondContact O-N 2.77Å; T697-C701 VanDerWaalsContact O-CB 3.27Å; T697-C701 WeakPolarHBondContact O-CB 3.31Å; T697-C701 PolarHBondContact O-N 2.76Å; T697-C701 PolarHBondContact O-SG 2.78Å
698	E	73.3	Confident	69.5	Low	117 Å²	117	58.9 Å²	58.9	55%	0.547	30%	0.301	S	S	.	.	H	α-helix	trans	-58	-61.2	173.3	-168.1	-155.7	139.4	0	0	111.3	F696 L700 C701 D702 K705	F696-E698 PolarHBondContact O-N 2.63Å; E698-L700 PolarHBondContact O-N 2.69Å; E698-L700 VanDerWaalsContact O-N 3.15Å; E698-C701 PolarHBondContact O-N 2.76Å; E698-C701 VanDerWaalsContact O-N 3.1Å; E698-D702 PolarHBondContact O-N 3.01Å; E698-K705 IonicContact OE1-NZ 4Å; E698-K705 PolarHBondContact OE1-NZ 3.1Å
699	Y	78.8	Confident	70.7	Confident	39 Å²	39	58.5 Å²	58.5	15%	0.153	30%	0.298	C	S	.	.	H	α-helix	trans	-52.3	-39.6	179.8	-70.7	-89.4	0	0	0	113	L680 C695 F696 K705 R706 Y708 L713 P714	L680-Y699 HydrophobicContact CD2-CG 4.35Å; C695-Y699 WeakPolarHBondContact O-CD2 3.45Å; F696-Y699 PolarHBondContact O-N 3.17Å; Y699-K705 HydrophobicContact CD1-CB 4.02Å; Y699-R706 WeakPolarHBondContact O-CA 3.29Å; Y699-R706 WeakPolarHBondContact O-CB 3.48Å; Y699-R706 PolarHBondContact O-N 3.43Å; Y699-Y708 HydrophobicContact CD1-CD2 4.42Å; Y699-Y708 HydrophobicContact CE1-CD2 4.22Å; Y699-Y708 HydrophobicContact CE1-CE2 4.37Å; Y699-L713 HydrophobicContact CD1-CD2 3.97Å; Y699-L713 HydrophobicContact CE1-CD2 3.94Å; Y699-P714 VanDerWaalsContact OH-CD 3.29Å; Y699-P714 WeakPolarHBondContact OH-CD 3.27Å; Y699-P714 WeakPolarHBondContact OH-CG 3.45Å
700	L	78.1	Confident	71.9	Confident	13 Å²	13	56.9 Å²	56.9	7%	0.068	29%	0.287	C	S	.	.	H	α-helix	trans	-83.3	-18.5	-176.5	-69.6	171.2	0	0	0	114.4	L680 C684 F696 T697 E698 R706 A884	L680-L700 HydrophobicContact CD2-CD2 4.32Å; L680-L700 HydrophobicContact CG-CD2 4.09Å; C684-L700 HydrophobicContact CB-CD2 4.27Å; F696-L700 HydrophobicContact CB-CD1 3.9Å; F696-L700 HydrophobicContact CB-CG 4.33Å; F696-L700 WeakPolarHBondContact O-CB 3.4Å; F696-L700 WeakPolarHBondContact O-CG 3.35Å; F696-L700 PolarHBondContact O-N 2.94Å; T697-L700 PolarHBondContact O-N 2.77Å; E698-L700 PolarHBondContact O-N 2.69Å; E698-L700 VanDerWaalsContact O-N 3.15Å; L700-R706 HydrophobicContact CD2-CB 4.49Å; L700-A884 WeakPolarHBondContact O-CB 3.32Å
701	C	75.9	Confident	73.2	Confident	92 Å²	92	57.8 Å²	57.8	62%	0.622	30%	0.299	S	S	*	.	H	α-helix	trans	-85.6	-35.3	173.6	-82.6	0	0	0	0	112.1	T697 E698	T697-C701 VanDerWaalsContact O-CB 3.27Å; T697-C701 WeakPolarHBondContact O-CB 3.31Å; T697-C701 PolarHBondContact O-N 2.76Å; T697-C701 PolarHBondContact O-SG 2.78Å; E698-C701 PolarHBondContact O-N 2.76Å; E698-C701 VanDerWaalsContact O-N 3.1Å
702	D	83.7	Confident	74.8	Confident	49 Å²	49	52.8 Å²	52.8	26%	0.262	28%	0.277	S	S	.	.	S	Bend	trans	-60.3	143	171.4	-172.9	-62	0	0	0	111.6	E698 T704 K705 R706	E698-D702 PolarHBondContact O-N 3.01Å; D702-T704 PolarHBondContact OD1-N 3.2Å; D702-T704 PolarHBondContact OD1-OG1 2.95Å; D702-T704 VanDerWaalsContact OD1-OG1 3.12Å; D702-K705 HydrophobicContact CB-CB 3.93Å; D702-K705 HydrophobicContact CB-CD 4.15Å; D702-K705 HydrophobicContact CB-CG 4.12Å; D702-K705 VanDerWaalsContact CG-CG 3.45Å; D702-K705 PolarHBondContact OD1-N 3.08Å; D702-K705 WeakPolarHBondContact OD2-CD 3.47Å; D702-K705 VanDerWaalsContact OD2-CE 3.28Å; D702-K705 WeakPolarHBondContact OD2-CE 3.44Å; D702-K705 WeakPolarHBondContact OD2-CG 3.11Å; D702-R706 WeakPolarHBondContact O-CD 3.49Å; D702-R706 VanDerWaalsContact O-CG 3.28Å; D702-R706 WeakPolarHBondContact O-CG 3.45Å; D702-R706 PolarHBondContact O-NE 3.07Å
703	R	83.9	Confident	76.4	Confident	181 Å²	181	48.3 Å²	48.3	68%	0.683	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-27.9	-176.9	-77	-168.2	175.8	-167.5	0.7	114.4	I649 R706 H707	I649-R703 HydrophobicContact CG2-CB 4.37Å; R703-R706 PolarHBondContact O-NE 3.3Å; R703-R706 PolarHBondContact O-NH2 3.26Å; R703-H707 PolarHBondContact O-CD2 3.06Å
704	T	85	Confident	77.3	Confident	42 Å²	42	49 Å²	49	26%	0.258	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-48	-179.4	53.2	0	0	0	0	111.5	D702 R706 H707	D702-T704 PolarHBondContact OD1-N 3.2Å; D702-T704 PolarHBondContact OD1-OG1 2.95Å; D702-T704 VanDerWaalsContact OD1-OG1 3.12Å; T704-R706 PolarHBondContact O-N 2.87Å; T704-R706 VanDerWaalsContact O-N 3.12Å; T704-H707 WeakPolarHBondContact O-CB 3.39Å; T704-H707 PolarHBondContact O-N 2.9Å
705	K	85.5	Confident	77.8	Confident	56 Å²	56	45.7 Å²	45.7	24%	0.243	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-57.7	-31.9	-175.6	-59.7	-178	-166.9	-170.8	0	113.4	E698 Y699 D702 H707 Y708	E698-K705 IonicContact OE1-NZ 4Å; E698-K705 PolarHBondContact OE1-NZ 3.1Å; Y699-K705 HydrophobicContact CD1-CB 4.02Å; D702-K705 HydrophobicContact CB-CB 3.93Å; D702-K705 HydrophobicContact CB-CD 4.15Å; D702-K705 HydrophobicContact CB-CG 4.12Å; D702-K705 VanDerWaalsContact CG-CG 3.45Å; D702-K705 PolarHBondContact OD1-N 3.08Å; D702-K705 WeakPolarHBondContact OD2-CD 3.47Å; D702-K705 VanDerWaalsContact OD2-CE 3.28Å; D702-K705 WeakPolarHBondContact OD2-CE 3.44Å; D702-K705 WeakPolarHBondContact OD2-CG 3.11Å; K705-H707 PolarHBondContact O-N 2.7Å; K705-H707 VanDerWaalsContact O-N 3.07Å; K705-Y708 HydrophobicContact CB-CE1 4.48Å; K705-Y708 HydrophobicContact CB-CE2 4.22Å; K705-Y708 HydrophobicContact CG-CE2 4.22Å; K705-Y708 WeakPolarHBondContact O-CB 3.25Å; K705-Y708 VanDerWaalsContact O-CG 3.26Å; K705-Y708 PolarHBondContact O-N 3.26Å; K705-Y708 VanDerWaalsContact O-N 3.11Å
706	R	86.1	Confident	77.7	Confident	8 Å²	8	46.5 Å²	46.5	3%	0.03	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-59.9	-15.4	173.7	62.8	-174.6	176.1	170.2	14.1	114.5	L680 S681 Y699 L700 D702 R703 T704 E888	L680-R706 CarbonylContact C-O 3.57Å; L680-R706 WeakPolarHBondContact CB-O 3.29Å; S681-R706 WeakPolarHBondContact CA-O 3.5Å; S681-R706 VanDerWaalsContact CB-O 3.25Å; S681-R706 WeakPolarHBondContact CB-O 3.47Å; S681-R706 PolarHBondContact N-O 2.9Å; Y699-R706 WeakPolarHBondContact O-CA 3.29Å; Y699-R706 WeakPolarHBondContact O-CB 3.48Å; Y699-R706 PolarHBondContact O-N 3.43Å; L700-R706 HydrophobicContact CD2-CB 4.49Å; D702-R706 WeakPolarHBondContact O-CD 3.49Å; D702-R706 VanDerWaalsContact O-CG 3.28Å; D702-R706 WeakPolarHBondContact O-CG 3.45Å; D702-R706 PolarHBondContact O-NE 3.07Å; R703-R706 PolarHBondContact O-NE 3.3Å; R703-R706 PolarHBondContact O-NH2 3.26Å; T704-R706 PolarHBondContact O-N 2.87Å; T704-R706 VanDerWaalsContact O-N 3.12Å; R706-E888 IonicContact CZ-OE1 3.52Å; R706-E888 IonicContact CZ-OE2 2.63Å; R706-E888 IonicContact NH1-OE2 2.7Å; R706-E888 PolarHBondContact NH1-OE2 3.23Å; R706-E888 VanDerWaalsContact NH2-CD 3.28Å; R706-E888 IonicContact NH2-OE1 3.41Å; R706-E888 PolarHBondContact NH2-OE1 2.96Å; R706-E888 IonicContact NH2-OE2 2.7Å; R706-E888 PolarHBondContact NH2-OE2 3.41Å
707	H	90.2	Very high	77.2	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.037	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-98.5	-3.1	179.5	-62.1	-50.1	0	0	0	113.2	Y654 S681 R703 T704 K705	Y654-H707 HydrophobicContact CD2-CB 4.03Å; Y654-H707 HydrophobicContact CE2-CB 4.13Å; S681-H707 WeakPolarHBondContact CB-ND1 3.39Å; S681-H707 PolarHBondContact OG-ND1 3.07Å; R703-H707 PolarHBondContact O-CD2 3.06Å; T704-H707 WeakPolarHBondContact O-CB 3.39Å; T704-H707 PolarHBondContact O-N 2.9Å; K705-H707 PolarHBondContact O-N 2.7Å; K705-H707 VanDerWaalsContact O-N 3.07Å
708	Y	89.6	Confident	76.6	Confident	22 Å²	22	45.3 Å²	45.3	9%	0.086	25%	0.245	C	C	.	.	S	Bend	trans	-54.6	145.2	171.7	-67.4	-1.8	0	0	0	111.2	P642 Y654 L680 Y699 K705 L713	P642-Y708 HydrophobicContact CG-CD1 3.81Å; P642-Y708 HydrophobicContact CG-CD2 4.14Å; P642-Y708 HydrophobicContact CG-CE1 3.78Å; P642-Y708 HydrophobicContact CG-CE2 4.12Å; P642-Y708 HydrophobicContact CG-CG 3.99Å; Y654-Y708 AromaticContact CD2-CD1 3.91Å; Y654-Y708 HydrophobicContact CD2-CD1 3.91Å; Y654-Y708 HydrophobicContact CE1-CD1 4.33Å; Y654-Y708 HydrophobicContact CE1-CE1 4.14Å; Y654-Y708 AromaticContact CE2-CD1 3.6Å; Y654-Y708 HydrophobicContact CE2-CD1 3.6Å; Y654-Y708 AromaticContact CE2-CE1 3.88Å; Y654-Y708 HydrophobicContact CE2-CE1 3.88Å; Y654-Y708 HydrophobicContact CG-CD1 4.39Å; Y654-Y708 AromaticContact CZ-CD1 3.83Å; Y654-Y708 AromaticContact CZ-CE1 3.64Å; L680-Y708 PolarHBondContact N-O 3Å; Y699-Y708 HydrophobicContact CD1-CD2 4.42Å; Y699-Y708 HydrophobicContact CE1-CD2 4.22Å; Y699-Y708 HydrophobicContact CE1-CE2 4.37Å; K705-Y708 HydrophobicContact CB-CE1 4.48Å; K705-Y708 HydrophobicContact CB-CE2 4.22Å; K705-Y708 HydrophobicContact CG-CE2 4.22Å; K705-Y708 WeakPolarHBondContact O-CB 3.25Å; K705-Y708 VanDerWaalsContact O-CG 3.26Å; K705-Y708 PolarHBondContact O-N 3.26Å; K705-Y708 VanDerWaalsContact O-N 3.11Å; Y708-L713 HydrophobicContact CD2-CD2 4.47Å
709	M	88.8	Confident	75.6	Confident	23 Å²	23	45.2 Å²	45.2	11%	0.113	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-70.6	153.8	176.1	-59.3	-170.9	-76	0	0	110.9	Y654 L655 P656 P676 M677 G711 D712	Y654-M709 VanDerWaalsContact O-CE 3.3Å; Y654-M709 WeakPolarHBondContact O-CE 3.46Å; L655-M709 HydrophobicContact CD2-CG 4.19Å; L655-M709 HydrophobicContact CD2-SD 4.16Å; P656-M709 WeakPolarHBondContact CD-SD 3.36Å; P656-M709 HydrophobicContact CG-CE 4.35Å; P656-M709 HydrophobicContact CG-SD 4.24Å; P676-M709 WeakPolarHBondContact O-CB 3.36Å; M677-M709 HydrophobicContact CB-SD 4.2Å; M677-M709 HydrophobicContact CG-SD 4.35Å; M709-G711 PolarHBondContact O-N 2.74Å; M709-D712 WeakPolarHBondContact CB-OD2 3.24Å; M709-D712 WeakPolarHBondContact CE-OD2 3.23Å; M709-D712 PolarHBondContact O-N 3.41Å
710	I	81.1	Confident	74.4	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-54.8	-35.6	174.5	-73.2	172.7	0	0	0	111.5	P676 L678 A683 D712 Q718 M722 F724 V727	P676-I710 PolarHBondContact O-N 3.4Å; L678-I710 HydrophobicContact CB-CD1 4.1Å; L678-I710 HydrophobicContact CD2-CD1 4.16Å; L678-I710 WeakPolarHBondContact O-CG1 3.49Å; L678-I710 PolarHBondContact O-N 2.7Å; A683-I710 HydrophobicContact CB-CD1 3.83Å; A683-I710 HydrophobicContact CB-CG1 4.27Å; I710-D712 VanDerWaalsContact C-N 3.28Å; I710-D712 PolarHBondContact O-N 2.88Å; I710-Q718 PolarHBondContact O-NE2 3.09Å; I710-M722 HydrophobicContact CD1-SD 3.89Å; I710-M722 HydrophobicContact CG1-SD 4.3Å; I710-M722 HydrophobicContact CG2-CB 4.44Å; I710-F724 HydrophobicContact CG2-CE1 4.08Å; I710-F724 HydrophobicContact CG2-CZ 3.95Å; I710-V727 HydrophobicContact CD1-CG1 4.13Å; I710-V727 HydrophobicContact CD1-CG2 4.17Å
711	G	75.9	Confident	73.1	Confident	32 Å²	32	53 Å²	53	33%	0.33	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-65.6	-23.2	177.2	0	0	0	0	0	115.4	P676 M709 Q718	P676-G711 PolarHBondContact O-N 2.99Å; P676-G711 VanDerWaalsContact O-N 3.13Å; M709-G711 PolarHBondContact O-N 2.74Å; G711-Q718 PolarHBondContact O-NE2 2.84Å
712	D	79.2	Confident	72.3	Confident	36 Å²	36	48.8 Å²	48.8	19%	0.193	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-94.4	-9.7	-177.5	-62.5	-44.6	0	0	0	113.8	K636 P642 M709 I710	K636-D712 IonicContact NZ-OD1 2.86Å; K636-D712 PolarHBondContact NZ-OD1 2.95Å; P642-D712 HydrophobicContact CG-CB 4.09Å; M709-D712 WeakPolarHBondContact CB-OD2 3.24Å; M709-D712 WeakPolarHBondContact CE-OD2 3.23Å; M709-D712 PolarHBondContact O-N 3.41Å; I710-D712 VanDerWaalsContact C-N 3.28Å; I710-D712 PolarHBondContact O-N 2.88Å
713	L	76.8	Confident	71.4	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.016	26%	0.256	C	S	.	.	S	Bend	trans	-72.1	146.2	177.1	-61.1	170.8	0	0	0	110.3	L680 F696 Y699 Y708 Q718	L680-L713 HydrophobicContact CB-CD1 4.46Å; L680-L713 HydrophobicContact CD1-CD1 4.1Å; L680-L713 HydrophobicContact CD2-CD1 4.33Å; L680-L713 HydrophobicContact CD2-CD2 4.14Å; F696-L713 HydrophobicContact CE1-CD1 4.2Å; Y699-L713 HydrophobicContact CD1-CD2 3.97Å; Y699-L713 HydrophobicContact CE1-CD2 3.94Å; Y708-L713 HydrophobicContact CD2-CD2 4.47Å; L713-Q718 HydrophobicContact CB-CG 4.29Å; L713-Q718 WeakPolarHBondContact O-CG 3.38Å; L713-Q718 PolarHBondContact O-NE2 3.26Å
714	P	69.2	Low	70.7	Confident	36 Å²	36	43.6 Å²	43.6	23%	0.234	24%	0.24	C	C	.	.			trans	-52.9	146.2	177.9	-30.1	36.7	0	0	0	113.6	Y699 S716 S717 Q718	Y699-P714 VanDerWaalsContact OH-CD 3.29Å; Y699-P714 WeakPolarHBondContact OH-CD 3.27Å; Y699-P714 WeakPolarHBondContact OH-CG 3.45Å; P714-S716 PolarHBondContact O-N 2.86Å; P714-S716 VanDerWaalsContact O-N 3.1Å; P714-S717 WeakPolarHBondContact O-CA 3.37Å; P714-S717 WeakPolarHBondContact O-CB 3.46Å; P714-S717 PolarHBondContact O-N 3.25Å; P714-Q718 PolarHBondContact O-N 3.2Å
715	C	61.7	Low	69.8	Low	63 Å²	63	44.4 Å²	44.4	43%	0.426	25%	0.247	S	C	.	.	H	α-helix	trans	-57.4	-29.3	-177.2	-76.9	0	0	0	0	113.2	N719	C715-N719 PolarHBondContact O-ND2 2.97Å
716	S	53.9	Low	69.1	Low	88 Å²	88	46.3 Å²	46.3	62%	0.615	26%	0.256	S	S	*	.	H	α-helix	trans	-59.6	-49.1	171.1	46.1	0	0	0	0	112.1	P714	P714-S716 PolarHBondContact O-N 2.86Å; P714-S716 VanDerWaalsContact O-N 3.1Å
717	S	57.3	Low	68.7	Low	11 Å²	11	46 Å²	46	8%	0.077	25%	0.254	C	S	.	.	H	α-helix	trans	-70.8	-35.7	180	-58	0	0	0	0	113.4	F696 P714	F696-S717 WeakPolarHBondContact CZ-O 3.37Å; P714-S717 WeakPolarHBondContact O-CA 3.37Å; P714-S717 WeakPolarHBondContact O-CB 3.46Å; P714-S717 PolarHBondContact O-N 3.25Å
718	Q	55.7	Low	68.3	Low	32 Å²	32	48.1 Å²	48.1	15%	0.15	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-44.7	179.6	-66.7	-173.6	17.9	0	0	112.7	I710 G711 L713 P714 M722 S723	I710-Q718 PolarHBondContact O-NE2 3.09Å; G711-Q718 PolarHBondContact O-NE2 2.84Å; L713-Q718 HydrophobicContact CB-CG 4.29Å; L713-Q718 WeakPolarHBondContact O-CG 3.38Å; L713-Q718 PolarHBondContact O-NE2 3.26Å; P714-Q718 PolarHBondContact O-N 3.2Å; Q718-M722 CarbonylContact O-C 3.34Å; Q718-M722 PolarHBondContact O-N 3.45Å; Q718-S723 PolarHBondContact O-N 2.99Å
719	N	50.9	Low	67.9	Low	115 Å²	115	52.3 Å²	52.3	62%	0.615	28%	0.283	S	S	*	.	H	α-helix	trans	-68.5	-43.5	-161.4	-87.2	-53	0	0	0	115.2	C715	C715-N719 PolarHBondContact O-ND2 2.97Å
720	H	53.4	Low	67.6	Low	162 Å²	162	54.5 Å²	54.5	75%	0.75	29%	0.29	S	S	*	.	H	α-helix	trans	-82.6	-31.3	-168.2	-73.2	99.7	0	0	0	114.6
721	Y	52.3	Low	67.9	Low	55 Å²	55	54.5 Å²	54.5	22%	0.216	29%	0.29	C	S	.	.	H	α-helix	trans	-124.8	-27.7	-170.1	-79.5	-81.4	0	0	0	115.3	Y593 S690 V693	Y593-Y721 AromaticContact CE1-CE1 3.87Å; Y593-Y721 HydrophobicContact CE1-CE1 3.87Å; S690-Y721 VanDerWaalsContact OG-CE1 3.24Å; S690-Y721 WeakPolarHBondContact OG-CE1 3.16Å; S690-Y721 PolarHBondContact OG-OH 2.92Å; V693-Y721 HydrophobicContact CB-CE2 4.39Å; V693-Y721 HydrophobicContact CG1-CD2 3.92Å; V693-Y721 HydrophobicContact CG1-CE2 4.05Å; V693-Y721 HydrophobicContact CG1-CG 4.41Å; V693-Y721 HydrophobicContact CG2-CD1 3.88Å; V693-Y721 HydrophobicContact CG2-CD2 3.87Å; V693-Y721 HydrophobicContact CG2-CE1 3.41Å; V693-Y721 VanDerWaalsContact CG2-CE1 3.41Å; V693-Y721 HydrophobicContact CG2-CE2 3.41Å; V693-Y721 VanDerWaalsContact CG2-CE2 3.41Å; V693-Y721 HydrophobicContact CG2-CG 4.11Å
722	M	59	Low	68.4	Low	3 Å²	3	54 Å²	54	2%	0.015	28%	0.279	C	S	.	.			trans	-112.5	25.1	-175.7	-71	-82.8	-177.1	0	0	112.9	L680 A683 C684 F696 I710 Q718 F724 V727	L680-M722 HydrophobicContact CD1-CE 3.68Å; A683-M722 HydrophobicContact CB-CE 3.76Å; A683-M722 HydrophobicContact CB-SD 3.88Å; C684-M722 WeakPolarHBondContact SG-CE 3.49Å; F696-M722 HydrophobicContact CZ-CG 4.21Å; I710-M722 HydrophobicContact CD1-SD 3.89Å; I710-M722 HydrophobicContact CG1-SD 4.3Å; I710-M722 HydrophobicContact CG2-CB 4.44Å; Q718-M722 CarbonylContact O-C 3.34Å; Q718-M722 PolarHBondContact O-N 3.45Å; M722-F724 PolarHBondContact O-N 2.95Å; M722-V727 HydrophobicContact SD-CG2 4.39Å
723	S	63.7	Low	68.7	Low	42 Å²	42	54.6 Å²	54.6	29%	0.294	28%	0.283	S	S	.	.			trans	-42.1	116.1	174.8	178.3	0	0	0	0	111.4	Q718 S725 F726 V727	Q718-S723 PolarHBondContact O-N 2.99Å; S723-S725 PolarHBondContact O-N 2.89Å; S723-S725 PolarHBondContact OG-OG 3.01Å; S723-F726 WeakPolarHBondContact O-CA 3.43Å; S723-F726 WeakPolarHBondContact O-CB 3.49Å; S723-F726 PolarHBondContact O-N 2.94Å; S723-V727 PolarHBondContact O-N 2.96Å
724	F	69.4	Low	69.3	Low	79 Å²	79	54.6 Å²	54.6	35%	0.346	28%	0.282	S	S	.	.	H	α-helix	trans	-46.5	-42.1	-174.4	-69	-99.5	0	0	0	112.4	V675 P676 I710 M722 F726 V727 R728	V675-F724 HydrophobicContact CB-CD1 4.26Å; V675-F724 HydrophobicContact CG1-CB 4.08Å; V675-F724 HydrophobicContact CG1-CD1 3.57Å; V675-F724 HydrophobicContact CG1-CE1 4.45Å; V675-F724 HydrophobicContact CG1-CG 4.24Å; P676-F724 HydrophobicContact CB-CE1 4.16Å; I710-F724 HydrophobicContact CG2-CE1 4.08Å; I710-F724 HydrophobicContact CG2-CZ 3.95Å; M722-F724 PolarHBondContact O-N 2.95Å; F724-F726 VanDerWaalsContact C-N 3.29Å; F724-F726 PolarHBondContact O-N 3.15Å; F724-V727 PolarHBondContact O-N 3.43Å; F724-R728 WeakPolarHBondContact O-CB 3.42Å; F724-R728 PolarHBondContact O-N 3.2Å
725	S	67.1	Low	70.3	Confident	58 Å²	58	52.9 Å²	52.9	41%	0.406	27%	0.271	S	S	.	.	H	α-helix	trans	-56.8	-34.1	175.9	67.6	0	0	0	0	115.1	S723 Q729	S723-S725 PolarHBondContact O-N 2.89Å; S723-S725 PolarHBondContact OG-OG 3.01Å; S725-Q729 WeakPolarHBondContact O-CB 3.47Å; S725-Q729 PolarHBondContact O-N 3.36Å; S725-Q729 VanDerWaalsContact O-N 3.09Å
726	F	70.2	Confident	71.5	Confident	97 Å²	97	50.3 Å²	50.3	43%	0.425	25%	0.253	S	S	.	.	H	α-helix	trans	-78.6	-40	177.6	-174.9	-96.8	0	0	0	111.3	V687 S723 F724 R730	V687-F726 HydrophobicContact CB-CE1 4.5Å; V687-F726 HydrophobicContact CG1-CD1 4.35Å; V687-F726 HydrophobicContact CG1-CE1 3.9Å; V687-F726 HydrophobicContact CG2-CD1 4.13Å; V687-F726 HydrophobicContact CG2-CE1 3.95Å; S723-F726 WeakPolarHBondContact O-CA 3.43Å; S723-F726 WeakPolarHBondContact O-CB 3.49Å; S723-F726 PolarHBondContact O-N 2.94Å; F724-F726 VanDerWaalsContact C-N 3.29Å; F724-F726 PolarHBondContact O-N 3.15Å; F726-R730 WeakPolarHBondContact O-CB 3.37Å; F726-R730 PolarHBondContact O-N 2.86Å
727	V	77.1	Confident	73.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-53.1	174.9	-176.5	0	0	0	0	109.9	V675 L678 I710 M722 S723 F724 Q729 R730 L731	V675-V727 HydrophobicContact CG1-CB 3.91Å; V675-V727 HydrophobicContact CG1-CG1 3.92Å; L678-V727 HydrophobicContact CD2-CG1 3.74Å; I710-V727 HydrophobicContact CD1-CG1 4.13Å; I710-V727 HydrophobicContact CD1-CG2 4.17Å; M722-V727 HydrophobicContact SD-CG2 4.39Å; S723-V727 PolarHBondContact O-N 2.96Å; F724-V727 PolarHBondContact O-N 3.43Å; V727-Q729 PolarHBondContact O-N 3.07Å; V727-R730 CarbonylContact O-C 3.41Å; V727-R730 VanDerWaalsContact O-CA 3.31Å; V727-R730 WeakPolarHBondContact O-CA 3.31Å; V727-R730 VanDerWaalsContact O-CB 3.27Å; V727-R730 WeakPolarHBondContact O-CB 3.36Å; V727-R730 PolarHBondContact O-N 2.86Å; V727-L731 HydrophobicContact CG1-CD1 4.36Å; V727-L731 HydrophobicContact CG1-CG 4.29Å; V727-L731 WeakPolarHBondContact O-CG 3.4Å; V727-L731 PolarHBondContact O-N 3.2Å
728	R	82.7	Confident	74.9	Confident	54 Å²	54	47 Å²	47	20%	0.204	23%	0.226	C	C	.	.	H	α-helix	trans	-44.9	-57.2	169.8	-175	-164.4	-157.1	-106.7	-19.3	111.8	D672 V675 F724 R730 L731 I732 D758	D672-R728 WeakPolarHBondContact OD1-CD 3.4Å; D672-R728 WeakPolarHBondContact OD1-CG 3.36Å; D672-R728 IonicContact OD1-CZ 3.96Å; D672-R728 IonicContact OD1-NE 2.64Å; D672-R728 PolarHBondContact OD1-NE 2.87Å; D672-R728 IonicContact OD1-NH2 4Å; D672-R728 IonicContact OD2-CZ 3.17Å; D672-R728 IonicContact OD2-NE 2.75Å; D672-R728 PolarHBondContact OD2-NE 3.24Å; D672-R728 IonicContact OD2-NH2 2.78Å; D672-R728 PolarHBondContact OD2-NH2 2.91Å; V675-R728 HydrophobicContact CG2-CB 3.95Å; V675-R728 HydrophobicContact CG2-CG 4.41Å; F724-R728 WeakPolarHBondContact O-CB 3.42Å; F724-R728 PolarHBondContact O-N 3.2Å; R728-R730 PolarHBondContact O-N 2.94Å; R728-R730 VanDerWaalsContact O-N 3.12Å; R728-L731 PolarHBondContact O-N 3.09Å; R728-L731 VanDerWaalsContact O-N 3.13Å; R728-I732 HydrophobicContact CG-CD1 3.98Å; R728-I732 WeakPolarHBondContact O-CG1 2.46Å; R728-I732 PolarHBondContact O-N 3.12Å; R728-D758 IonicContact CZ-OD1 2.72Å; R728-D758 IonicContact NH1-OD1 3.5Å; R728-D758 PolarHBondContact NH1-OD1 3.42Å; R728-D758 IonicContact NH2-OD1 3.34Å; R728-D758 PolarHBondContact NH2-OD1 3.22Å; R728-D758 IonicContact NH2-OD2 2.74Å
729	Q	79.8	Confident	76.5	Confident	110 Å²	110	45.9 Å²	45.9	51%	0.514	22%	0.221	S	C	.	.	H	α-helix	trans	-62.4	-25.1	-179.1	-179.4	63.2	111.3	0	0	112.3	S725 V727 N733	S725-Q729 WeakPolarHBondContact O-CB 3.47Å; S725-Q729 PolarHBondContact O-N 3.36Å; S725-Q729 VanDerWaalsContact O-N 3.09Å; V727-Q729 PolarHBondContact O-N 3.07Å; Q729-N733 PolarHBondContact NE2-ND2 2.94Å; Q729-N733 VanDerWaalsContact O-CB 3.31Å; Q729-N733 WeakPolarHBondContact O-CB 3.39Å; Q729-N733 PolarHBondContact O-N 3.3Å; Q729-N733 PolarHBondContact O-ND2 3.25Å
730	R	82.9	Confident	78.3	Confident	68 Å²	68	40.5 Å²	40.5	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-80.4	-39.7	174.4	-170.4	54.8	153.7	-152.1	-13.9	113.1	I686 V687 F726 V727 R728 N733 I734	I686-R730 HydrophobicContact CG2-CB 4.41Å; I686-R730 HydrophobicContact CG2-CG 3.45Å; I686-R730 VanDerWaalsContact CG2-CG 3.45Å; I686-R730 PolarHBondContact O-NE 3.27Å; V687-R730 HydrophobicContact CG2-CG 4.35Å; F726-R730 WeakPolarHBondContact O-CB 3.37Å; F726-R730 PolarHBondContact O-N 2.86Å; V727-R730 CarbonylContact O-C 3.41Å; V727-R730 VanDerWaalsContact O-CA 3.31Å; V727-R730 WeakPolarHBondContact O-CA 3.31Å; V727-R730 VanDerWaalsContact O-CB 3.27Å; V727-R730 WeakPolarHBondContact O-CB 3.36Å; V727-R730 PolarHBondContact O-N 2.86Å; R728-R730 PolarHBondContact O-N 2.94Å; R728-R730 VanDerWaalsContact O-N 3.12Å; R730-N733 CarbonylContact O-C 3.4Å; R730-N733 WeakPolarHBondContact O-CA 3.44Å; R730-N733 WeakPolarHBondContact O-CB 3.17Å; R730-N733 PolarHBondContact O-N 3.3Å; R730-I734 WeakPolarHBondContact O-CG1 3.49Å; R730-I734 PolarHBondContact O-N 3.23Å
731	L	87.9	Confident	80.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64	-51.7	174.6	-65.1	-173.2	0	0	0	110.8	L609 V671 L674 V675 L678 I686 V727 R728 N733 I734 C735	L609-L731 HydrophobicContact CD1-CD2 3.78Å; L609-L731 HydrophobicContact CD2-CD2 4.02Å; V671-L731 HydrophobicContact CG1-CB 3.78Å; V671-L731 HydrophobicContact CG1-CD1 4.49Å; L674-L731 HydrophobicContact CB-CD1 4.22Å; V675-L731 HydrophobicContact CG2-CD1 4.16Å; L678-L731 HydrophobicContact CD2-CD2 4.26Å; I686-L731 HydrophobicContact CD1-CD2 4.15Å; I686-L731 HydrophobicContact CG2-CD2 4.48Å; V727-L731 HydrophobicContact CG1-CD1 4.36Å; V727-L731 HydrophobicContact CG1-CG 4.29Å; V727-L731 WeakPolarHBondContact O-CG 3.4Å; V727-L731 PolarHBondContact O-N 3.2Å; R728-L731 PolarHBondContact O-N 3.09Å; R728-L731 VanDerWaalsContact O-N 3.13Å; L731-N733 PolarHBondContact O-N 3.17Å; L731-N733 VanDerWaalsContact O-N 3.09Å; L731-I734 CarbonylContact O-C 3.42Å; L731-I734 WeakPolarHBondContact O-CA 3.41Å; L731-I734 PolarHBondContact O-N 3.26Å; L731-C735 PolarHBondContact O-N 3.27Å; L731-C735 PolarHBondContact O-SG 2.83Å
732	I	86.6	Confident	81.9	Confident	21 Å²	21	30.3 Å²	30.3	11%	0.108	15%	0.148	C	C	.	.	H	α-helix	trans	-50	-40.9	170.8	-63.9	171.2	0	0	0	110.4	V671 R728 I734 C735 W736	V671-I732 HydrophobicContact CB-CG1 4.27Å; V671-I732 HydrophobicContact CG1-CG1 3.85Å; V671-I732 HydrophobicContact CG2-CG1 4.33Å; R728-I732 HydrophobicContact CG-CD1 3.98Å; R728-I732 WeakPolarHBondContact O-CG1 2.46Å; R728-I732 PolarHBondContact O-N 3.12Å; I732-I734 PolarHBondContact O-N 2.72Å; I732-C735 PolarHBondContact O-N 3.37Å; I732-W736 PolarHBondContact O-N 2.82Å
733	N	85.2	Confident	83.5	Confident	50 Å²	50	30.1 Å²	30.1	27%	0.267	15%	0.147	S	C	.	.	H	α-helix	trans	-71.4	-4.7	177.8	-98.3	-68	0	0	0	115.8	Q729 R730 L731 W736 K737	Q729-N733 PolarHBondContact NE2-ND2 2.94Å; Q729-N733 VanDerWaalsContact O-CB 3.31Å; Q729-N733 WeakPolarHBondContact O-CB 3.39Å; Q729-N733 PolarHBondContact O-N 3.3Å; Q729-N733 PolarHBondContact O-ND2 3.25Å; R730-N733 CarbonylContact O-C 3.4Å; R730-N733 WeakPolarHBondContact O-CA 3.44Å; R730-N733 WeakPolarHBondContact O-CB 3.17Å; R730-N733 PolarHBondContact O-N 3.3Å; L731-N733 PolarHBondContact O-N 3.17Å; L731-N733 VanDerWaalsContact O-N 3.09Å; N733-W736 PolarHBondContact OD1-NE1 2.83Å; N733-K737 WeakPolarHBondContact O-CD 3.49Å; N733-K737 WeakPolarHBondContact O-CE 3.5Å; N733-K737 PolarHBondContact O-NZ 3.19Å
734	I	89.4	Confident	84.9	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-109.6	-38.7	171.8	-62.6	168.3	0	0	0	109.1	R605 M606 L609 I686 R730 L731 I732 W736 K737 L738	R605-I734 HydrophobicContact CB-CD1 4.14Å; M606-I734 HydrophobicContact CB-CG2 4.4Å; M606-I734 HydrophobicContact CG-CG2 3.68Å; L609-I734 HydrophobicContact CB-CG2 3.98Å; L609-I734 HydrophobicContact CD2-CB 3.59Å; L609-I734 HydrophobicContact CD2-CD1 4.44Å; L609-I734 HydrophobicContact CD2-CG2 3.52Å; L609-I734 HydrophobicContact CG-CG2 4.34Å; I686-I734 HydrophobicContact CD1-CD1 4.38Å; I686-I734 HydrophobicContact CG1-CD1 4.3Å; I686-I734 HydrophobicContact CG2-CD1 3.76Å; R730-I734 WeakPolarHBondContact O-CG1 3.49Å; R730-I734 PolarHBondContact O-N 3.23Å; L731-I734 CarbonylContact O-C 3.42Å; L731-I734 WeakPolarHBondContact O-CA 3.41Å; L731-I734 PolarHBondContact O-N 3.26Å; I732-I734 PolarHBondContact O-N 2.72Å; I734-W736 PolarHBondContact O-N 2.95Å; I734-K737 CarbonylContact O-C 3.58Å; I734-K737 WeakPolarHBondContact O-CA 2.48Å; I734-K737 WeakPolarHBondContact O-CB 3.49Å; I734-K737 PolarHBondContact O-N 2.99Å; I734-L738 HydrophobicContact CG2-CD1 4.4Å; I734-L738 HydrophobicContact CG2-CG 4.46Å; I734-L738 PolarHBondContact O-N 2.79Å
735	C	90.7	Very high	85.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-50.1	-55.6	173.1	-62.4	0	0	0	0	112.1	L731 I732 K737 L738 S739 I744 Y761	L731-C735 PolarHBondContact O-N 3.27Å; L731-C735 PolarHBondContact O-SG 2.83Å; I732-C735 PolarHBondContact O-N 3.37Å; C735-K737 PolarHBondContact O-N 3.48Å; C735-L738 WeakPolarHBondContact O-CA 3.37Å; C735-L738 WeakPolarHBondContact O-CB 3.34Å; C735-L738 PolarHBondContact O-N 3.15Å; C735-S739 PolarHBondContact O-N 3.05Å; C735-S739 PolarHBondContact O-OG 3.4Å; C735-I744 HydrophobicContact CB-CD1 3.73Å; C735-Y761 HydrophobicContact CB-CD1 3.96Å; C735-Y761 HydrophobicContact CB-CE1 3.57Å; C735-Y761 HydrophobicContact CB-CE2 4.23Å; C735-Y761 HydrophobicContact CB-CG 4.43Å
736	W	86.9	Confident	86.8	Confident	10 Å²	10	22 Å²	22	4%	0.038	10%	0.1	C	C	.	.	H	α-helix	trans	-61.2	-17.9	178.1	77.5	-109.3	0	0	0	114.2	I732 N733 I734 Y740 D834 L837 K838 L841	I732-W736 PolarHBondContact O-N 2.82Å; N733-W736 PolarHBondContact OD1-NE1 2.83Å; I734-W736 PolarHBondContact O-N 2.95Å; W736-Y740 AromaticContact CE3-CD2 3.88Å; W736-Y740 HydrophobicContact CE3-CD2 3.88Å; W736-Y740 HydrophobicContact CE3-CE2 4.01Å; W736-Y740 HydrophobicContact CZ3-CD2 4.01Å; W736-Y740 AromaticContact CZ3-CE2 3.96Å; W736-Y740 HydrophobicContact CZ3-CE2 3.96Å; W736-Y740 WeakPolarHBondContact O-CD2 3.41Å; W736-D834 HydrophobicContact CH2-CB 3.88Å; W736-D834 HydrophobicContact CZ2-CB 3.89Å; W736-L837 HydrophobicContact CH2-CB 4.26Å; W736-L837 HydrophobicContact CZ3-CB 3.89Å; W736-K838 HydrophobicContact CB-CG 4.1Å; W736-K838 HydrophobicContact CD2-CG 4.42Å; W736-K838 HydrophobicContact CG-CG 4.06Å; W736-L841 HydrophobicContact CB-CD1 3.75Å
737	K	89.4	Confident	87.5	Confident	30 Å²	30	17.4 Å²	17.4	13%	0.13	8%	0.08	C	C	.	.	H	α-helix	trans	-88.3	-29.8	174.8	-62.6	176.7	177.3	56.8	0	112.6	M606 N733 I734 C735 S739 Y740 L741 M869	M606-K737 HydrophobicContact CE-CB 4.45Å; M606-K737 HydrophobicContact CG-CB 4.35Å; M606-K737 HydrophobicContact SD-CB 3.44Å; M606-K737 WeakPolarHBondContact SD-CB 2.47Å; N733-K737 WeakPolarHBondContact O-CD 3.49Å; N733-K737 WeakPolarHBondContact O-CE 3.5Å; N733-K737 PolarHBondContact O-NZ 3.19Å; I734-K737 CarbonylContact O-C 3.58Å; I734-K737 WeakPolarHBondContact O-CA 2.48Å; I734-K737 WeakPolarHBondContact O-CB 3.49Å; I734-K737 PolarHBondContact O-N 2.99Å; C735-K737 PolarHBondContact O-N 3.48Å; K737-S739 VanDerWaalsContact C-N 3.31Å; K737-Y740 PolarHBondContact O-N 3.3Å; K737-L741 WeakPolarHBondContact O-CG 3.07Å; K737-M869 HydrophobicContact CB-CE 4.24Å; K737-M869 WeakPolarHBondContact O-CE 3.27Å
738	L	92.5	Very high	87.3	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.8	-36.5	167.7	-68.7	171	0	0	0	110.4	M606 H610 I734 C735 Y740 L741 G742 L743 I744 W806	M606-L738 HydrophobicContact CB-CD2 3.77Å; M606-L738 HydrophobicContact CB-CG 4.5Å; M606-L738 HydrophobicContact CG-CD2 3.98Å; M606-L738 HydrophobicContact CG-CG 4.25Å; M606-L738 HydrophobicContact SD-CD2 4.5Å; H610-L738 HydrophobicContact CB-CD1 4.43Å; H610-L738 HydrophobicContact CB-CD2 4.02Å; I734-L738 HydrophobicContact CG2-CD1 4.4Å; I734-L738 HydrophobicContact CG2-CG 4.46Å; I734-L738 PolarHBondContact O-N 2.79Å; C735-L738 WeakPolarHBondContact O-CA 3.37Å; C735-L738 WeakPolarHBondContact O-CB 3.34Å; C735-L738 PolarHBondContact O-N 3.15Å; L738-Y740 VanDerWaalsContact C-N 3.34Å; L738-Y740 PolarHBondContact O-N 3.06Å; L738-L741 WeakPolarHBondContact O-CA 3.49Å; L738-L741 WeakPolarHBondContact O-CB 3.32Å; L738-L741 PolarHBondContact O-N 3.34Å; L738-G742 PolarHBondContact O-N 3.23Å; L738-L743 HydrophobicContact CB-CB 4.27Å; L738-L743 HydrophobicContact CD2-CB 4.37Å; L738-L743 HydrophobicContact CD2-CD1 3.76Å; L738-L743 PolarHBondContact O-N 3.38Å; L738-L743 VanDerWaalsContact O-N 3.09Å; L738-I744 HydrophobicContact CB-CD1 3.94Å; L738-I744 HydrophobicContact CB-CG1 3.82Å; L738-I744 HydrophobicContact CD1-CD1 4.26Å; L738-W806 HydrophobicContact CD2-CZ2 4.05Å
739	S	90.4	Very high	86.2	Confident	8 Å²	8	19.9 Å²	19.9	6%	0.056	11%	0.107	C	C	.	.	H	α-helix	trans	-61.5	-38.6	172.2	-46.4	0	0	0	0	113.4	C735 K737 L741 G742 I744 C746 V856	C735-S739 PolarHBondContact O-N 3.05Å; C735-S739 PolarHBondContact O-OG 3.4Å; K737-S739 VanDerWaalsContact C-N 3.31Å; S739-L741 PolarHBondContact O-N 3.42Å; S739-G742 PolarHBondContact O-N 3.05Å; S739-G742 VanDerWaalsContact O-N 3.12Å; S739-I744 WeakPolarHBondContact CA-O 3.48Å; S739-I744 WeakPolarHBondContact CB-O 3.36Å; S739-I744 PolarHBondContact OG-O 2.88Å; S739-C746 PolarHBondContact OG-SG 3.38Å; S739-C746 VanDerWaalsContact OG-SG 3.36Å; S739-V856 WeakPolarHBondContact O-CG2 3.24Å
740	Y	87.9	Confident	85.1	Confident	2 Å²	2	22.2 Å²	22.2	1%	0.008	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-18.3	171.5	-97	-69.1	0	0	0	114.8	W736 K737 L738 L837 S840 L841 V856 N866	W736-Y740 AromaticContact CE3-CD2 3.88Å; W736-Y740 HydrophobicContact CE3-CD2 3.88Å; W736-Y740 HydrophobicContact CE3-CE2 4.01Å; W736-Y740 HydrophobicContact CZ3-CD2 4.01Å; W736-Y740 AromaticContact CZ3-CE2 3.96Å; W736-Y740 HydrophobicContact CZ3-CE2 3.96Å; W736-Y740 WeakPolarHBondContact O-CD2 3.41Å; K737-Y740 PolarHBondContact O-N 3.3Å; L738-Y740 VanDerWaalsContact C-N 3.34Å; L738-Y740 PolarHBondContact O-N 3.06Å; Y740-L837 HydrophobicContact CE2-CB 3.76Å; Y740-L837 WeakPolarHBondContact CE2-O 3.29Å; Y740-L837 WeakPolarHBondContact OH-CA 3.47Å; Y740-L837 WeakPolarHBondContact OH-CB 3.24Å; Y740-L837 WeakPolarHBondContact OH-CD2 3.33Å; Y740-L837 PolarHBondContact OH-O 2.82Å; Y740-S840 PolarHBondContact OH-OG 2.93Å; Y740-L841 HydrophobicContact CD1-CD2 4.35Å; Y740-L841 HydrophobicContact CD2-CD2 3.66Å; Y740-L841 HydrophobicContact CD2-CG 4.27Å; Y740-L841 HydrophobicContact CE1-CD2 4.41Å; Y740-L841 HydrophobicContact CE2-CD1 4.46Å; Y740-L841 HydrophobicContact CE2-CD2 3.76Å; Y740-L841 HydrophobicContact CE2-CG 3.98Å; Y740-L841 HydrophobicContact CG-CD2 3.99Å; Y740-V856 HydrophobicContact CD1-CB 3.76Å; Y740-V856 HydrophobicContact CD1-CG1 4.1Å; Y740-V856 HydrophobicContact CE1-CB 4.07Å; Y740-V856 HydrophobicContact CE1-CG1 3.85Å; Y740-V856 PolarHBondContact O-N 2.74Å; Y740-N866 HydrophobicContact CD1-CB 4.26Å
741	L	90.5	Very high	83.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-6.6	176.6	-59.6	-179.8	0	0	0	113	F603 M606 K737 L738 S739 L743 W806 L865 M869	F603-L741 HydrophobicContact CE1-CD2 4.33Å; M606-L741 HydrophobicContact SD-CD1 3.8Å; K737-L741 WeakPolarHBondContact O-CG 3.07Å; L738-L741 WeakPolarHBondContact O-CA 3.49Å; L738-L741 WeakPolarHBondContact O-CB 3.32Å; L738-L741 PolarHBondContact O-N 3.34Å; S739-L741 PolarHBondContact O-N 3.42Å; L741-L743 HydrophobicContact CB-CD1 4.07Å; L741-L743 HydrophobicContact CB-CG 4Å; L741-L743 HydrophobicContact CD1-CD1 4.05Å; L741-W806 HydrophobicContact CD1-CH2 3.58Å; L741-W806 HydrophobicContact CD1-CZ2 4.32Å; L741-W806 HydrophobicContact CD1-CZ3 4.36Å; L741-L865 HydrophobicContact CD2-CD1 3.55Å; L741-L865 HydrophobicContact CD2-CD2 3.69Å; L741-L865 HydrophobicContact CD2-CG 4.19Å; L741-M869 HydrophobicContact CD2-CE 3.88Å; L741-M869 HydrophobicContact CG-CE 4.16Å
742	G	90.1	Very high	81.6	Confident	2 Å²	2	21.3 Å²	21.3	2%	0.021	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	34.4	-169.8	0	0	0	0	0	112.7	L738 S739 G853 E854	L738-G742 PolarHBondContact O-N 3.23Å; S739-G742 PolarHBondContact O-N 3.05Å; S739-G742 VanDerWaalsContact O-N 3.12Å; G742-G853 CarbonylContact O-C 3.39Å; G742-G853 VanDerWaalsContact O-CA 3.3Å; G742-G853 WeakPolarHBondContact O-CA 3.34Å; G742-E854 WeakPolarHBondContact CA-O 3.45Å
743	L	93.5	Very high	79.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-104.2	-32.9	178.4	-70	178.6	0	0	0	113.3	L738 L741 H764 A767 F796 Y805 W806	L738-L743 HydrophobicContact CB-CB 4.27Å; L738-L743 HydrophobicContact CD2-CB 4.37Å; L738-L743 HydrophobicContact CD2-CD1 3.76Å; L738-L743 PolarHBondContact O-N 3.38Å; L738-L743 VanDerWaalsContact O-N 3.09Å; L741-L743 HydrophobicContact CB-CD1 4.07Å; L741-L743 HydrophobicContact CB-CG 4Å; L741-L743 HydrophobicContact CD1-CD1 4.05Å; L743-H764 PolarHBondContact O-N 2.79Å; L743-A767 HydrophobicContact CD2-CB 3.77Å; L743-F796 HydrophobicContact CD2-CE2 4.09Å; L743-F796 HydrophobicContact CD2-CZ 4.02Å; L743-Y805 HydrophobicContact CD1-CE1 3.92Å; L743-Y805 HydrophobicContact CD2-CD1 4.43Å; L743-Y805 HydrophobicContact CD2-CE1 3.85Å; L743-Y805 HydrophobicContact CD2-CE2 4.22Å; L743-Y805 HydrophobicContact CG-CE1 4.34Å; L743-W806 HydrophobicContact CD1-CH2 4.22Å; L743-W806 HydrophobicContact CD1-CZ2 3.55Å
744	I	92.6	Very high	77.2	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140	170.6	72	-178.4	0	0	0	111.6	F669 C735 L738 S739 Y761 F762 V763	F669-I744 HydrophobicContact CZ-CD1 4.17Å; C735-I744 HydrophobicContact CB-CD1 3.73Å; L738-I744 HydrophobicContact CB-CD1 3.94Å; L738-I744 HydrophobicContact CB-CG1 3.82Å; L738-I744 HydrophobicContact CD1-CD1 4.26Å; S739-I744 WeakPolarHBondContact CA-O 3.48Å; S739-I744 WeakPolarHBondContact CB-O 3.36Å; S739-I744 PolarHBondContact OG-O 2.88Å; I744-Y761 HydrophobicContact CD1-CD1 3.62Å; I744-Y761 HydrophobicContact CD1-CE1 4.37Å; I744-Y761 HydrophobicContact CD1-CG 4.14Å; I744-Y761 HydrophobicContact CG1-CD1 4.09Å; I744-F762 CarbonylContact C-O 3.4Å; I744-F762 WeakPolarHBondContact CA-O 3.41Å; I744-F762 WeakPolarHBondContact CB-O 3.41Å; I744-V763 HydrophobicContact CG2-CG2 4.44Å
745	A	89.3	Confident	74.9	Confident	4 Å²	4	33.5 Å²	33.5	3%	0.033	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	167.9	172.4	0	0	0	0	0	111.9	Y761 F762 Y844 V849	A745-Y761 VanDerWaalsContact O-CA 3.27Å; A745-Y761 WeakPolarHBondContact O-CA 3.41Å; A745-Y761 WeakPolarHBondContact O-CD1 3.49Å; A745-F762 HydrophobicContact CB-CB 4.21Å; A745-F762 PolarHBondContact N-O 2.82Å; A745-F762 PolarHBondContact O-N 2.8Å; A745-F762 VanDerWaalsContact O-N 3.15Å; A745-Y844 HydrophobicContact CB-CD2 3.77Å; A745-Y844 HydrophobicContact CB-CE2 3.9Å; A745-V849 HydrophobicContact CB-CG1 3.76Å; A745-V849 HydrophobicContact CB-CG2 4.18Å
746	C	87.5	Confident	72.4	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.014	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.1	174.9	-61.2	0	0	0	0	109.9	S739 Y761 Y844	S739-C746 PolarHBondContact OG-SG 3.38Å; S739-C746 VanDerWaalsContact OG-SG 3.36Å; C746-Y761 VanDerWaalsContact SG-CE1 3.56Å; C746-Y844 PolarHBondContact O-N 3.01Å
747	S	84.2	Confident	70.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	155.5	172.3	76.1	0	0	0	0	112.2	Y760 R843 Y844	S747-Y760 PolarHBondContact N-O 3.18Å; S747-Y760 PolarHBondContact OG-N 2.85Å; S747-R843 WeakPolarHBondContact O-CD 3.3Å; S747-R843 PolarHBondContact O-NH1 2.83Å; S747-Y844 CarbonylContact C-O 3.54Å; S747-Y844 WeakPolarHBondContact CA-O 3.4Å
748	N	73.4	Confident	69.2	Low	37 Å²	37	48.9 Å²	48.9	20%	0.198	29%	0.29	C	S	.	.			trans	-65.5	156.5	155.5	-170	11.6	0	0	0	109.9	E750 R843 Y844	N748-E750 PolarHBondContact ND2-OE2 2.91Å; N748-R843 HydrophobicContact CB-CB 4.28Å; N748-Y844 PolarHBondContact N-O 2.93Å
749	A	60.7	Low	68.2	Low	69 Å²	69	50.5 Å²	50.5	57%	0.57	30%	0.298	S	S	*	.	S	Bend	trans	-83.2	-27.6	177.9	0	0	0	0	0	112.1	A752	A749-A752 PolarHBondContact O-N 2.82Å
750	E	55	Low	68	Low	158 Å²	158	51.1 Å²	51.1	74%	0.738	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-70.2	-35.1	-179.7	-64.7	156.6	157.3	0	0	111.5	N748 A752 G753	N748-E750 PolarHBondContact ND2-OE2 2.91Å; E750-A752 PolarHBondContact O-N 3.39Å; E750-A752 VanDerWaalsContact O-N 3.12Å; E750-G753 PolarHBondContact O-N 3.03Å
751	S	49.6	Very low	68	Low	39 Å²	39	51.1 Å²	51.1	27%	0.273	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-62.2	-16.5	175.2	-40	0	0	0	0	113.9	G753 N845 F846	S751-G753 VanDerWaalsContact C-N 3.32Å; S751-G753 PolarHBondContact O-N 2.94Å; S751-N845 PolarHBondContact OG-OD1 2.77Å; S751-N845 VanDerWaalsContact OG-OD1 3.12Å; S751-F846 WeakPolarHBondContact O-CE2 3.15Å
752	A	48.9	Very low	68	Low	11 Å²	11	51.6 Å²	51.6	9%	0.091	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-90.8	20.4	-177	0	0	0	0	0	114.1	A749 E750 L756 Y760	A749-A752 PolarHBondContact O-N 2.82Å; E750-A752 PolarHBondContact O-N 3.39Å; E750-A752 VanDerWaalsContact O-N 3.12Å; A752-L756 HydrophobicContact CB-CB 4.47Å; A752-Y760 HydrophobicContact CB-CE2 4.43Å
753	G	40.8	Very low	68.1	Low	62 Å²	62	51.5 Å²	51.5	64%	0.639	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	41.5	165.4	0	0	0	0	0	115.8	E750 S751 Q755	E750-G753 PolarHBondContact O-N 3.03Å; S751-G753 VanDerWaalsContact C-N 3.32Å; S751-G753 PolarHBondContact O-N 2.94Å; G753-Q755 PolarHBondContact O-N 3.14Å
754	G	38.3	Very low	68.1	Low	82 Å²	82	51.9 Å²	51.9	85%	0.845	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	-23.9	162.4	0	0	0	0	0	118.6
755	Q	40.9	Very low	68	Low	184 Å²	184	54.9 Å²	54.9	86%	0.86	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-26.5	-175.5	-61	-169.8	5	0	0	113.8	G753	G753-Q755 PolarHBondContact O-N 3.14Å
756	L	38.6	Very low	68.2	Low	102 Å²	102	55.5 Å²	55.5	53%	0.534	32%	0.32	S	S	.	.			trans	-85.1	126	-179.5	-65.4	171.2	0	0	0	111.1	A752	A752-L756 HydrophobicContact CB-CB 4.47Å
757	K	51	Low	68.5	Low	201 Å²	201	55.4 Å²	55.4	87%	0.874	32%	0.319	S	S	*	.			trans	-95.1	7.9	-177.5	-83.2	176	176.8	158.7	0	114.2
758	D	58	Low	69	Low	60 Å²	60	56.1 Å²	56.1	32%	0.321	32%	0.322	S	S	.	.			trans	-113.3	148.5	-164.2	-67.8	-74.3	0	0	0	111.9	R728	R728-D758 IonicContact CZ-OD1 2.72Å; R728-D758 IonicContact NH1-OD1 3.5Å; R728-D758 PolarHBondContact NH1-OD1 3.42Å; R728-D758 IonicContact NH2-OD1 3.34Å; R728-D758 PolarHBondContact NH2-OD1 3.22Å; R728-D758 IonicContact NH2-OD2 2.74Å
759	E	71.2	Confident	69.9	Low	35 Å²	35	54.4 Å²	54.4	16%	0.164	31%	0.313	C	S	.	.			trans	-96.4	123	-165.5	-64.9	167.9	143.1	0	0	110.5	Y761 K838 R843	E759-Y761 HydrophobicContact CB-CE2 3.83Å; E759-Y761 VanDerWaalsContact O-CD2 3.28Å; E759-Y761 WeakPolarHBondContact O-CD2 3.29Å; E759-Y761 WeakPolarHBondContact O-CE2 3.49Å; E759-Y761 PolarHBondContact OE2-OH 2.95Å; E759-Y761 VanDerWaalsContact OE2-OH 3.09Å; E759-K838 VanDerWaalsContact OE1-CE 3.31Å; E759-K838 WeakPolarHBondContact OE1-CE 3.35Å; E759-K838 IonicContact OE1-NZ 2.58Å; E759-K838 PolarHBondContact OE1-NZ 3.12Å; E759-K838 VanDerWaalsContact OE2-CE 3.24Å; E759-K838 WeakPolarHBondContact OE2-CE 3.31Å; E759-K838 IonicContact OE2-NZ 2.71Å; E759-K838 PolarHBondContact OE2-NZ 3.33Å; E759-R843 IonicContact OE1-CZ 2.58Å; E759-R843 IonicContact OE1-NH1 2.88Å; E759-R843 PolarHBondContact OE1-NH1 3.44Å; E759-R843 IonicContact OE1-NH2 2.65Å; E759-R843 PolarHBondContact OE1-NH2 2.85Å
760	Y	85.3	Confident	71.5	Confident	21 Å²	21	51.7 Å²	51.7	8%	0.082	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	155.1	168.1	-71.5	-94.1	0	0	0	110.6	R661 L664 H670 S747 A752 F846	R661-Y760 PolarHBondContact NH1-OH 2.78Å; L664-Y760 HydrophobicContact CD1-CD1 3.87Å; L664-Y760 HydrophobicContact CD1-CE1 3.68Å; H670-Y760 HydrophobicContact CB-CD1 3.88Å; H670-Y760 HydrophobicContact CB-CE1 3.73Å; S747-Y760 PolarHBondContact N-O 3.18Å; S747-Y760 PolarHBondContact OG-N 2.85Å; A752-Y760 HydrophobicContact CB-CE2 4.43Å; Y760-F846 HydrophobicContact CD2-CZ 4.37Å; Y760-F846 HydrophobicContact CG-CE1 4.33Å
761	Y	89.3	Confident	73.4	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	147.3	-178.5	-66.3	-95.2	0	0	0	110.7	W668 F669 V671 C735 I744 A745 C746 E759	W668-Y761 CarbonylContact C-O 3.45Å; W668-Y761 WeakPolarHBondContact CA-O 3.48Å; W668-Y761 VanDerWaalsContact CE3-O 3.32Å; F669-Y761 WeakPolarHBondContact CD1-O 3.37Å; F669-Y761 HydrophobicContact CZ-CG 4.17Å; F669-Y761 PolarHBondContact N-O 2.63Å; F669-Y761 PolarHBondContact O-N 3.07Å; V671-Y761 HydrophobicContact CG2-CD2 3.54Å; V671-Y761 HydrophobicContact CG2-CE2 3.46Å; V671-Y761 VanDerWaalsContact CG2-CE2 3.46Å; C735-Y761 HydrophobicContact CB-CD1 3.96Å; C735-Y761 HydrophobicContact CB-CE1 3.57Å; C735-Y761 HydrophobicContact CB-CE2 4.23Å; C735-Y761 HydrophobicContact CB-CG 4.43Å; I744-Y761 HydrophobicContact CD1-CD1 3.62Å; I744-Y761 HydrophobicContact CD1-CE1 4.37Å; I744-Y761 HydrophobicContact CD1-CG 4.14Å; I744-Y761 HydrophobicContact CG1-CD1 4.09Å; A745-Y761 VanDerWaalsContact O-CA 3.27Å; A745-Y761 WeakPolarHBondContact O-CA 3.41Å; A745-Y761 WeakPolarHBondContact O-CD1 3.49Å; C746-Y761 VanDerWaalsContact SG-CE1 3.56Å; E759-Y761 HydrophobicContact CB-CE2 3.83Å; E759-Y761 VanDerWaalsContact O-CD2 3.28Å; E759-Y761 WeakPolarHBondContact O-CD2 3.29Å; E759-Y761 WeakPolarHBondContact O-CE2 3.49Å; E759-Y761 PolarHBondContact OE2-OH 2.95Å; E759-Y761 VanDerWaalsContact OE2-OH 3.09Å
762	F	90.8	Very high	75.5	Confident	10 Å²	10	42.3 Å²	42.3	4%	0.044	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	137.9	179.4	173.3	-89.9	0	0	0	111.2	S666 G667 W668 I744 A745 H764 V849 L851	S666-F762 WeakPolarHBondContact O-CE2 3.46Å; G667-F762 CarbonylContact O-C 3.13Å; G667-F762 WeakPolarHBondContact O-CA 3.08Å; W668-F762 AromaticContact CD1-CD2 3.77Å; W668-F762 HydrophobicContact CD2-CB 3.73Å; W668-F762 HydrophobicContact CD2-CD2 4.11Å; W668-F762 HydrophobicContact CD2-CG 4.43Å; W668-F762 AromaticContact CE2-CD2 3.87Å; W668-F762 HydrophobicContact CE3-CB 3.79Å; W668-F762 HydrophobicContact CG-CB 4.38Å; W668-F762 HydrophobicContact CG-CD2 4.04Å; W668-F762 HydrophobicContact CH2-CB 3.97Å; W668-F762 HydrophobicContact CZ2-CB 3.91Å; W668-F762 HydrophobicContact CZ3-CB 3.9Å; W668-F762 AromaticContact NE1-CD2 3.66Å; I744-F762 CarbonylContact C-O 3.4Å; I744-F762 WeakPolarHBondContact CA-O 3.41Å; I744-F762 WeakPolarHBondContact CB-O 3.41Å; A745-F762 HydrophobicContact CB-CB 4.21Å; A745-F762 PolarHBondContact N-O 2.82Å; A745-F762 PolarHBondContact O-N 2.8Å; A745-F762 VanDerWaalsContact O-N 3.15Å; F762-H764 AromaticContact CE1-ND1 3.93Å; F762-V849 HydrophobicContact CB-CG1 4.45Å; F762-V849 HydrophobicContact CB-CG2 4.48Å; F762-V849 HydrophobicContact CD1-CB 4.15Å; F762-V849 HydrophobicContact CD1-CG1 3.37Å; F762-V849 HydrophobicContact CE1-CB 4.31Å; F762-V849 HydrophobicContact CE1-CG1 3.63Å; F762-V849 HydrophobicContact CG-CB 4.33Å; F762-V849 HydrophobicContact CG-CG1 3.96Å; F762-V849 HydrophobicContact CG-CG2 4.47Å; F762-V849 HydrophobicContact CZ-CG1 4.42Å; F762-L851 HydrophobicContact CZ-CD2 4.24Å
763	V	91.9	Very high	77.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	117.3	177.5	-171.8	0	0	0	0	111	I613 Y614 V617 R618 G667 F669 I744	I613-V763 HydrophobicContact CG2-CG2 3.49Å; I613-V763 VanDerWaalsContact CG2-CG2 3.49Å; Y614-V763 HydrophobicContact CD2-CG1 4.03Å; V617-V763 HydrophobicContact CB-CG2 4.03Å; V617-V763 HydrophobicContact CG1-CB 4.26Å; V617-V763 HydrophobicContact CG1-CG2 3.81Å; V617-V763 HydrophobicContact CG2-CG2 4.21Å; R618-V763 HydrophobicContact CG-CG1 4.33Å; R618-V763 PolarHBondContact NH2-O 3.49Å; G667-V763 PolarHBondContact O-N 3.19Å; F669-V763 HydrophobicContact CD1-CG2 3.75Å; F669-V763 HydrophobicContact CE1-CG2 3.62Å; I744-V763 HydrophobicContact CG2-CG2 4.44Å
764	H	93	Very high	79.9	Confident	9 Å²	9	41.9 Å²	41.9	4%	0.042	23%	0.225	C	C	.	.			trans	-71.6	142.1	176.6	-65.9	-71.5	0	0	0	112	L743 F762 K850	L743-H764 PolarHBondContact O-N 2.79Å; F762-H764 AromaticContact CE1-ND1 3.93Å; H764-K850 PolarHBondContact CE1-O 3.5Å; H764-K850 VanDerWaalsContact CE1-O 3.23Å; H764-K850 PolarHBondContact ND1-O 3.24Å
765	E	91.2	Very high	82.4	Confident	65 Å²	65	38 Å²	38	30%	0.304	19%	0.185	S	C	.	.	S	Bend	trans	-84.3	-13.7	177	-70.1	158	-150.8	0	0	112.8	R618 F796 L851	R618-E765 IonicContact CZ-OE1 2.74Å; R618-E765 IonicContact NH1-OE1 3.64Å; R618-E765 PolarHBondContact NH1-OE1 2.66Å; R618-E765 IonicContact NH2-OE1 2.66Å; R618-E765 PolarHBondContact NH2-OE1 2.72Å; E765-F796 PolarHBondContact O-N 3.02Å; E765-L851 PolarHBondContact N-O 3.48Å
766	S	93.7	Very high	84.6	Confident	17 Å²	17	32 Å²	32	12%	0.119	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	153.1	174.7	56.4	0	0	0	0	111.8	H794 L851 L852 G853	S766-H794 CarbonylContact C-O 3.58Å; S766-H794 WeakPolarHBondContact CA-O 3.46Å; S766-H794 WeakPolarHBondContact CB-O 3.17Å; S766-L851 PolarHBondContact N-O 3Å; S766-L851 PolarHBondContact OG-O 2.87Å; S766-L852 VanDerWaalsContact OG-CA 3.32Å; S766-L852 WeakPolarHBondContact OG-CA 3.32Å; S766-G853 PolarHBondContact O-N 2.8Å
767	A	93.7	Very high	86.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	141.8	-179.6	0	0	0	0	0	112.9	L743 H794 F796 Y805 G853	L743-A767 HydrophobicContact CD2-CB 3.77Å; A767-H794 PolarHBondContact N-O 3.15Å; A767-H794 PolarHBondContact O-N 2.83Å; A767-F796 HydrophobicContact CB-CE2 3.85Å; A767-F796 HydrophobicContact CB-CZ 3.72Å; A767-Y805 HydrophobicContact CB-CD2 4.2Å; A767-Y805 HydrophobicContact CB-CE2 3.69Å; A767-G853 WeakPolarHBondContact CA-O 3.15Å
768	Q	93.1	Very high	88.3	Confident	15 Å²	15	20.3 Å²	20.3	7%	0.07	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	129	-179.8	-161.2	-155.4	-105.9	0	0	112.7	K791 I793 G853	Q768-K791 HydrophobicContact CG-CB 4.35Å; Q768-I793 HydrophobicContact CG-CG1 4.35Å; Q768-G853 PolarHBondContact N-O 3.45Å
769	L	93	Very high	89.5	Confident	1 Å²	1	19 Å²	19	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	159.6	163.5	-64.4	-176.5	0	0	0	110.9	K791 H792 Y805 H808 L809 I812	L769-K791 CarbonylContact O-C 3.59Å; L769-K791 WeakPolarHBondContact O-CA 3.39Å; L769-H792 PolarHBondContact N-O 3.3Å; L769-H792 PolarHBondContact O-N 3.07Å; L769-Y805 HydrophobicContact CD1-CD2 3.99Å; L769-Y805 HydrophobicContact CD1-CE2 4.02Å; L769-Y805 HydrophobicContact CD2-CD2 4.32Å; L769-Y805 HydrophobicContact CD2-CE2 3.5Å; L769-Y805 HydrophobicContact CG-CD2 3.98Å; L769-Y805 HydrophobicContact CG-CE2 3.6Å; L769-H808 HydrophobicContact CD1-CB 4.15Å; L769-L809 HydrophobicContact CD1-CB 3.91Å; L769-L809 HydrophobicContact CD2-CB 4.24Å; L769-L809 HydrophobicContact CD2-CD1 3.83Å; L769-L809 HydrophobicContact CD2-CG 4.46Å; L769-I812 HydrophobicContact CB-CD1 4.29Å; L769-I812 HydrophobicContact CD1-CD1 4.28Å
770	M	93.9	Very high	90.2	Very high	12 Å²	12	17.7 Å²	17.7	6%	0.059	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125	173.6	171.8	-174	-81.8	0	0	108.4	T772 I782 I786 Y789 P790 A863	M770-T772 HydrophobicContact CG-CG2 3.97Å; M770-T772 PolarHBondContact O-N 2.82Å; M770-T772 VanDerWaalsContact O-N 3.12Å; M770-T772 HydrophobicContact SD-CG2 4.03Å; M770-I782 HydrophobicContact SD-CD1 4.44Å; M770-I786 HydrophobicContact CE-CG2 3.78Å; M770-I786 HydrophobicContact SD-CG2 4.29Å; M770-Y789 VanDerWaalsContact CG-CB 3.41Å; M770-Y789 HydrophobicContact CG-CG 4.31Å; M770-Y789 HydrophobicContact SD-CD2 4.07Å; M770-Y789 HydrophobicContact SD-CG 4.29Å; M770-P790 CarbonylContact C-O 3.59Å; M770-P790 WeakPolarHBondContact CA-O 3.17Å; M770-A863 CarbonylContact O-C 3.52Å; M770-A863 VanDerWaalsContact O-CA 3.25Å; M770-A863 WeakPolarHBondContact O-CA 3.16Å
771	D	94.2	Very high	90.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.11	C	C	.	.			trans	-78.3	103.3	176.8	-174.1	20.5	0	0	0	111.4	S773 Y789 P790 I812 V908 A909	D771-S773 WeakPolarHBondContact OD1-CB 3.09Å; D771-S773 PolarHBondContact OD1-N 2.8Å; D771-S773 PolarHBondContact OD1-OG 2.9Å; D771-S773 PolarHBondContact OD2-OG 3.32Å; D771-Y789 WeakPolarHBondContact O-CB 3.34Å; D771-Y789 WeakPolarHBondContact O-CD1 3.33Å; D771-P790 HydrophobicContact CB-CG 4.15Å; D771-P790 PolarHBondContact N-O 3.17Å; D771-I812 HydrophobicContact CB-CD1 4.32Å; D771-I812 HydrophobicContact CB-CG1 4.34Å; D771-I812 WeakPolarHBondContact OD1-CG2 3.02Å; D771-V908 WeakPolarHBondContact OD2-CA 3.34Å; D771-A909 PolarHBondContact OD2-N 3.27Å
772	T	94.5	Very high	90.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.112	C	C	.	.			trans	-95.7	9.8	176.4	60.1	0	0	0	0	112.9	M770 T774 S775 I782 Y789 T816 A863	M770-T772 HydrophobicContact CG-CG2 3.97Å; M770-T772 PolarHBondContact O-N 2.82Å; M770-T772 VanDerWaalsContact O-N 3.12Å; M770-T772 HydrophobicContact SD-CG2 4.03Å; T772-T774 PolarHBondContact O-N 3.03Å; T772-T774 VanDerWaalsContact O-N 3.16Å; T772-S775 WeakPolarHBondContact O-CB 3.09Å; T772-S775 PolarHBondContact O-N 3.03Å; T772-I782 HydrophobicContact CG2-CD1 4Å; T772-I782 HydrophobicContact CG2-CG2 3.96Å; T772-Y789 HydrophobicContact CG2-CD1 4.45Å; T772-Y789 HydrophobicContact CG2-CD2 4.45Å; T772-Y789 HydrophobicContact CG2-CG 4.27Å; T772-T816 WeakPolarHBondContact O-CG2 3.32Å; T772-T816 WeakPolarHBondContact OG1-CG2 3.37Å; T772-T816 PolarHBondContact OG1-OG1 3.44Å; T772-A863 PolarHBondContact OG1-N 3Å
773	S	91.7	Very high	90.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.6	-174.5	67.2	0	0	0	0	113.9	D771 R910	D771-S773 WeakPolarHBondContact OD1-CB 3.09Å; D771-S773 PolarHBondContact OD1-N 2.8Å; D771-S773 PolarHBondContact OD1-OG 2.9Å; D771-S773 PolarHBondContact OD2-OG 3.32Å; S773-R910 WeakPolarHBondContact O-CD 3.43Å; S773-R910 WeakPolarHBondContact OG-CB 3.46Å; S773-R910 PolarHBondContact OG-N 2.77Å
774	T	91	Very high	90.1	Very high	65 Å²	65	25.8 Å²	25.8	40%	0.399	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-18.5	175.2	50.2	0	0	0	0	114.4	T772 A909 R910	T772-T774 PolarHBondContact O-N 3.03Å; T772-T774 VanDerWaalsContact O-N 3.16Å; T774-A909 HydrophobicContact CG2-CB 4Å; T774-R910 HydrophobicContact CG2-CB 4.35Å
775	S	91	Very high	89.9	Confident	1 Å²	1	29 Å²	29	1%	0.007	17%	0.173	C	C	.	.			trans	-51.9	143.2	-174.4	175.3	0	0	0	0	114.1	T772 I782 S783	T772-S775 WeakPolarHBondContact O-CB 3.09Å; T772-S775 PolarHBondContact O-N 3.03Å; S775-I782 WeakPolarHBondContact OG-CA 3.39Å; S775-S783 PolarHBondContact OG-N 3.17Å; S775-S783 VanDerWaalsContact OG-N 3.14Å; S775-S783 PolarHBondContact OG-OG 3.19Å
776	A	86.2	Confident	89.6	Confident	58 Å²	58	29.2 Å²	29.2	48%	0.479	18%	0.175	S	C	.	.			trans	-60.8	162.5	172.5	0	0	0	0	0	113	A778 S783	A776-A778 PolarHBondContact O-N 2.76Å; A776-S783 PolarHBondContact N-OG 2.87Å
777	A	83.8	Confident	89.4	Confident	35 Å²	35	33.6 Å²	33.6	29%	0.289	21%	0.206	S	C	.	.			trans	-89.4	87.8	-164	0	0	0	0	0	114.4	W817 A823	A777-W817 WeakPolarHBondContact CA-O 3.07Å; A777-W817 HydrophobicContact CB-CB 4Å; A777-W817 HydrophobicContact CB-CE3 4.08Å; A777-A823 VanDerWaalsContact O-CB 3.29Å; A777-A823 WeakPolarHBondContact O-CB 3.48Å
778	A	84.6	Confident	89.2	Confident	22 Å²	22	38.1 Å²	38.1	18%	0.182	23%	0.227	C	C	.	.			trans	-110.2	-174.5	-175.1	0	0	0	0	0	114.7	A776 T781 L818 G819 R820	A776-A778 PolarHBondContact O-N 2.76Å; A778-T781 VanDerWaalsContact CB-O 3.26Å; A778-T781 WeakPolarHBondContact CB-O 3.42Å; A778-L818 HydrophobicContact CB-CD2 3.99Å; A778-L818 CarbonylContact O-C 3.54Å; A778-L818 WeakPolarHBondContact O-CA 3.24Å; A778-G819 PolarHBondContact O-N 2.75Å; A778-R820 PolarHBondContact O-N 3.12Å
779	Y	83.1	Confident	89.2	Confident	31 Å²	31	37.7 Å²	37.7	12%	0.122	23%	0.225	C	C	.	.	S	Bend	trans	-84.1	-49.3	176.1	179.2	-116.3	0	0	0	114.1	G819 R821 A823 K824 D828 H872 R873	Y779-G819 VanDerWaalsContact O-CA 3.23Å; Y779-G819 WeakPolarHBondContact O-CA 3.43Å; Y779-G819 PolarHBondContact O-N 2.83Å; Y779-R821 HydrophobicContact CE2-CG 4.4Å; Y779-A823 VanDerWaalsContact CB-O 3.24Å; Y779-A823 WeakPolarHBondContact CB-O 3.42Å; Y779-A823 PolarHBondContact N-O 2.96Å; Y779-K824 HydrophobicContact CD1-CB 4.21Å; Y779-K824 HydrophobicContact CD1-CG 3.69Å; Y779-K824 HydrophobicContact CD2-CB 4.4Å; Y779-K824 HydrophobicContact CE1-CG 4.1Å; Y779-K824 HydrophobicContact CG-CB 3.91Å; Y779-K824 HydrophobicContact CG-CG 3.92Å; Y779-D828 HydrophobicContact CD1-CB 4.29Å; Y779-D828 WeakPolarHBondContact CD1-OD2 3.29Å; Y779-H872 PolarHBondContact O-CE1 3.36Å; Y779-R873 PolarHBondContact OH-NH2 3.35Å
780	M	85.8	Confident	89.1	Confident	9 Å²	9	40.9 Å²	40.9	4%	0.044	25%	0.245	C	C	.	.	S	Bend	trans	-145.1	-14.2	177.9	80.6	174.1	112.9	0	0	117.5	D828 P867 F870	M780-D828 HydrophobicContact CE-CB 3.55Å; M780-D828 VanDerWaalsContact CE-O 3.31Å; M780-D828 WeakPolarHBondContact CE-O 3.2Å; M780-D828 VanDerWaalsContact CE-OD1 3.22Å; M780-D828 WeakPolarHBondContact CE-OD1 3.24Å; M780-P867 HydrophobicContact CG-CB 4.16Å; M780-P867 HydrophobicContact SD-CB 4.24Å; M780-F870 HydrophobicContact CB-CE1 4.33Å; M780-F870 HydrophobicContact SD-CE1 4Å; M780-F870 HydrophobicContact SD-CZ 4.06Å
781	T	88.6	Confident	89	Confident	24 Å²	24	46.9 Å²	46.9	15%	0.147	27%	0.271	C	S	.	.	S	Bend	trans	-102.9	151.4	176.7	56.5	0	0	0	0	111.6	A778 L818 I860	A778-T781 VanDerWaalsContact CB-O 3.26Å; A778-T781 WeakPolarHBondContact CB-O 3.42Å; T781-L818 WeakPolarHBondContact O-CD2 3.46Å; T781-I860 CarbonylContact C-O 3.51Å; T781-I860 WeakPolarHBondContact CA-O 3.44Å; T781-I860 HydrophobicContact CG2-CD1 3.85Å; T781-I860 HydrophobicContact CG2-CG1 4.17Å
782	I	90.9	Very high	88.9	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.036	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-75.7	168.6	170.8	65.8	-168.3	0	0	0	111.4	M770 T772 S775 Y789 T816 L818 I860	M770-I782 HydrophobicContact SD-CD1 4.44Å; T772-I782 HydrophobicContact CG2-CD1 4Å; T772-I782 HydrophobicContact CG2-CG2 3.96Å; S775-I782 WeakPolarHBondContact OG-CA 3.39Å; I782-Y789 HydrophobicContact CB-CE2 4.29Å; I782-Y789 HydrophobicContact CD1-CD2 3.95Å; I782-Y789 HydrophobicContact CD1-CE2 3.64Å; I782-Y789 HydrophobicContact CG1-CE2 3.98Å; I782-T816 HydrophobicContact CG2-CG2 4.41Å; I782-L818 HydrophobicContact CG2-CD1 4.38Å; I782-I860 PolarHBondContact N-O 3.02Å
783	S	89.5	Confident	88.9	Confident	32 Å²	32	54.1 Å²	54.1	22%	0.224	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-76	144.6	169.9	30.7	0	0	0	0	111.9	S775 A776 Q788 Y789	S775-S783 PolarHBondContact OG-N 3.17Å; S775-S783 VanDerWaalsContact OG-N 3.14Å; S775-S783 PolarHBondContact OG-OG 3.19Å; A776-S783 PolarHBondContact N-OG 2.87Å; S783-Q788 PolarHBondContact O-NE2 2.88Å; S783-Y789 PolarHBondContact N-OH 3.34Å; S783-Y789 VanDerWaalsContact O-CE2 3.25Å; S783-Y789 WeakPolarHBondContact O-CE2 3.32Å; S783-Y789 PolarHBondContact O-OH 3.18Å; S783-Y789 PolarHBondContact OG-OH 2.86Å
784	E	86.2	Confident	89	Confident	139 Å²	139	54.7 Å²	54.7	65%	0.65	31%	0.31	S	S	*	.	S	Bend	trans	-82.5	161.8	170.6	-74.8	148.9	-133.2	0	0	111	Q788	E784-Q788 PolarHBondContact O-NE2 2.84Å
785	P	87.9	Confident	89.1	Confident	75 Å²	75	59.3 Å²	59.3	49%	0.487	32%	0.324	S	S	.	.	P	Polyproline II helix	cis	-71.6	155.1	-7.5	32.5	-36.2	0	0	0	112	S787 Q788	P785-S787 VanDerWaalsContact C-N 3.26Å; P785-S787 PolarHBondContact O-N 3.22Å; P785-Q788 HydrophobicContact CG-CB 4.48Å; P785-Q788 VanDerWaalsContact O-CG 3.3Å; P785-Q788 WeakPolarHBondContact O-CG 3.27Å; P785-Q788 PolarHBondContact O-NE2 3.39Å
786	I	86.1	Confident	89.2	Confident	71 Å²	71	59.8 Å²	59.8	36%	0.364	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-71.5	-24.4	-178.1	-58.2	172.7	0	0	0	111.7	M770 Q788 Y789 I860	M770-I786 HydrophobicContact CE-CG2 3.78Å; M770-I786 HydrophobicContact SD-CG2 4.29Å; I786-Q788 PolarHBondContact O-N 3.14Å; I786-Y789 WeakPolarHBondContact O-CD2 3.34Å; I786-I860 HydrophobicContact CD1-CG2 3.78Å
787	S	88.3	Confident	89.4	Confident	108 Å²	108	62.8 Å²	62.8	76%	0.755	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-64.8	-17.5	178.6	45.7	0	0	0	0	114.8	P785 Y789	P785-S787 VanDerWaalsContact C-N 3.26Å; P785-S787 PolarHBondContact O-N 3.22Å; S787-Y789 PolarHBondContact O-N 3.21Å
788	Q	90	Very high	89.8	Confident	95 Å²	95	62.7 Å²	62.7	44%	0.444	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-72.9	-9.3	-178	80.6	-167.4	-64.6	0	0	114.5	S783 E784 P785 I786	S783-Q788 PolarHBondContact O-NE2 2.88Å; E784-Q788 PolarHBondContact O-NE2 2.84Å; P785-Q788 HydrophobicContact CG-CB 4.48Å; P785-Q788 VanDerWaalsContact O-CG 3.3Å; P785-Q788 WeakPolarHBondContact O-CG 3.27Å; P785-Q788 PolarHBondContact O-NE2 3.39Å; I786-Q788 PolarHBondContact O-N 3.14Å
789	Y	92.4	Very high	90.1	Very high	7 Å²	7	61.8 Å²	61.8	3%	0.027	33%	0.328	C	S	.	.	S	Bend	trans	-102.2	124	-174.7	-57	-65.6	0	0	0	111.3	M770 D771 T772 I782 S783 I786 S787	M770-Y789 VanDerWaalsContact CG-CB 3.41Å; M770-Y789 HydrophobicContact CG-CG 4.31Å; M770-Y789 HydrophobicContact SD-CD2 4.07Å; M770-Y789 HydrophobicContact SD-CG 4.29Å; D771-Y789 WeakPolarHBondContact O-CB 3.34Å; D771-Y789 WeakPolarHBondContact O-CD1 3.33Å; T772-Y789 HydrophobicContact CG2-CD1 4.45Å; T772-Y789 HydrophobicContact CG2-CD2 4.45Å; T772-Y789 HydrophobicContact CG2-CG 4.27Å; I782-Y789 HydrophobicContact CB-CE2 4.29Å; I782-Y789 HydrophobicContact CD1-CD2 3.95Å; I782-Y789 HydrophobicContact CD1-CE2 3.64Å; I782-Y789 HydrophobicContact CG1-CE2 3.98Å; S783-Y789 PolarHBondContact N-OH 3.34Å; S783-Y789 VanDerWaalsContact O-CE2 3.25Å; S783-Y789 WeakPolarHBondContact O-CE2 3.32Å; S783-Y789 PolarHBondContact O-OH 3.18Å; S783-Y789 PolarHBondContact OG-OH 2.86Å; I786-Y789 WeakPolarHBondContact O-CD2 3.34Å; S787-Y789 PolarHBondContact O-N 3.21Å
790	P	91.8	Very high	90.5	Very high	67 Å²	67	64 Å²	64	44%	0.435	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-67.2	148.1	-179.2	28.7	-34.5	0	0	0	111.2	M770 D771	M770-P790 CarbonylContact C-O 3.59Å; M770-P790 WeakPolarHBondContact CA-O 3.17Å; D771-P790 HydrophobicContact CB-CG 4.15Å; D771-P790 PolarHBondContact N-O 3.17Å
791	K	92.5	Very high	90.9	Very high	138 Å²	138	65.8 Å²	65.8	60%	0.6	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.1	178.4	-62.5	168.3	178.4	-179.5	0	109.4	Q768 L769	Q768-K791 HydrophobicContact CG-CB 4.35Å; L769-K791 CarbonylContact O-C 3.59Å; L769-K791 WeakPolarHBondContact O-CA 3.39Å
792	H	91.8	Very high	91.1	Very high	47 Å²	47	64.6 Å²	64.6	22%	0.218	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.3	173.8	-53.8	-75.9	0	0	0	109.1	L769 H808	L769-H792 PolarHBondContact N-O 3.3Å; L769-H792 PolarHBondContact O-N 3.07Å; H792-H808 AromaticContact CD2-CE1 3.75Å; H792-H808 AromaticContact CG-CE1 3.79Å
793	I	93.6	Very high	91.2	Very high	105 Å²	105	66.4 Å²	66.4	54%	0.538	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	126.3	171.2	-60.5	171.6	0	0	0	107.5	Q768 L852	Q768-I793 HydrophobicContact CG-CG1 4.35Å; I793-L852 HydrophobicContact CD1-CD2 4.47Å; I793-L852 HydrophobicContact CG2-CD1 4Å
794	H	93.4	Very high	91.4	Very high	12 Å²	12	66 Å²	66	6%	0.056	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.8	167.2	-65.9	-110.5	0	0	0	107.8	S766 A767 F796 Y805 H808	S766-H794 CarbonylContact C-O 3.58Å; S766-H794 WeakPolarHBondContact CA-O 3.46Å; S766-H794 WeakPolarHBondContact CB-O 3.17Å; A767-H794 PolarHBondContact N-O 3.15Å; A767-H794 PolarHBondContact O-N 2.83Å; H794-F796 HydrophobicContact CB-CE1 3.96Å; H794-Y805 HydrophobicContact CB-CD2 4.2Å; H794-Y805 AromaticContact CD2-CD2 3.87Å; H794-Y805 AromaticContact CG-CD2 4Å; H794-H808 AromaticContact CE1-CG 3.93Å; H794-H808 AromaticContact CE1-ND1 3.33Å; H794-H808 PolarHBondContact CE1-ND1 3.34Å; H794-H808 VanDerWaalsContact CE1-ND1 3.33Å; H794-H808 AromaticContact NE2-CG 3.88Å; H794-H808 AromaticContact NE2-ND1 3.11Å; H794-H808 PolarHBondContact NE2-ND1 3.39Å; H794-H808 VanDerWaalsContact NE2-ND1 3.11Å
795	K	93.1	Very high	91.9	Very high	162 Å²	162	59.4 Å²	59.4	70%	0.704	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	144.7	161.4	-64	-174.2	178.3	-173.8	0	108
796	F	93.6	Very high	92.2	Very high	11 Å²	11	55.9 Å²	55.9	5%	0.048	29%	0.292	C	S	.	.			trans	-109.3	102.9	175.8	-53.4	-47.5	0	0	0	108.6	Y614 L743 E765 A767 H794 D801 V802 Y805	Y614-F796 HydrophobicContact CD2-CB 4.47Å; Y614-F796 HydrophobicContact CE2-CB 3.53Å; Y614-F796 HydrophobicContact CE2-CG 4.35Å; Y614-F796 WeakPolarHBondContact OH-CB 3.35Å; Y614-F796 PolarHBondContact OH-O 3.15Å; L743-F796 HydrophobicContact CD2-CE2 4.09Å; L743-F796 HydrophobicContact CD2-CZ 4.02Å; E765-F796 PolarHBondContact O-N 3.02Å; A767-F796 HydrophobicContact CB-CE2 3.85Å; A767-F796 HydrophobicContact CB-CZ 3.72Å; H794-F796 HydrophobicContact CB-CE1 3.96Å; F796-D801 HydrophobicContact CD1-CB 4.17Å; F796-V802 HydrophobicContact CB-CG2 4.14Å; F796-V802 HydrophobicContact CD1-CG2 3.83Å; F796-V802 HydrophobicContact CD2-CG2 4.47Å; F796-V802 HydrophobicContact CE1-CG2 4.33Å; F796-V802 HydrophobicContact CG-CG2 3.91Å; F796-Y805 HydrophobicContact CE1-CD2 4.2Å; F796-Y805 HydrophobicContact CE1-CG 4.01Å; F796-Y805 AromaticContact CZ-CD2 3.96Å; F796-Y805 HydrophobicContact CZ-CD2 3.96Å; F796-Y805 AromaticContact CZ-CG 4Å; F796-Y805 HydrophobicContact CZ-CG 4Å
797	V	90.5	Very high	92.5	Very high	121 Å²	121	52.5 Å²	52.5	73%	0.733	27%	0.274	S	S	*	.	S	Bend	trans	-98.5	-27.4	171.5	-174.3	0	0	0	0	110.2	Y614 D801	Y614-V797 VanDerWaalsContact OH-C 3.3Å; V797-D801 PolarHBondContact N-OD2 2.72Å; V797-D801 VanDerWaalsContact N-OD2 3.13Å
798	S	91.7	Very high	92.7	Very high	33 Å²	33	47.3 Å²	47.3	23%	0.231	24%	0.238	C	C	.	.	S	Bend	trans	-142.1	163.8	-177.9	68.4	0	0	0	0	112.7	Y614 N800 D801 V802	Y614-S798 PolarHBondContact OH-N 2.93Å; S798-N800 PolarHBondContact O-N 2.84Å; S798-N800 VanDerWaalsContact O-N 3.12Å; S798-N800 PolarHBondContact OG-N 2.78Å; S798-D801 PolarHBondContact N-OD2 2.98Å; S798-D801 WeakPolarHBondContact O-CB 3.44Å; S798-D801 PolarHBondContact O-N 2.81Å; S798-D801 PolarHBondContact OG-N 2.97Å; S798-D801 PolarHBondContact OG-OD2 2.95Å; S798-V802 PolarHBondContact O-N 2.77Å
799	L	90.9	Very high	92.9	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-56.5	-25.4	169.8	-169.6	66.3	0	0	0	112.9	E611 Y614 D619 W651 R803	E611-L799 HydrophobicContact CB-CD1 3.76Å; E611-L799 HydrophobicContact CG-CD1 3.9Å; E611-L799 WeakPolarHBondContact O-CD1 3.48Å; Y614-L799 HydrophobicContact CD1-CD1 4.38Å; D619-L799 WeakPolarHBondContact OD2-CB 3.42Å; D619-L799 PolarHBondContact OD2-N 3.19Å; W651-L799 HydrophobicContact CH2-CD2 4.36Å; W651-L799 HydrophobicContact CZ2-CD2 4.08Å; L799-R803 VanDerWaalsContact O-CG 3.29Å; L799-R803 WeakPolarHBondContact O-CG 3.28Å; L799-R803 PolarHBondContact O-N 3.05Å
800	N	91.7	Very high	92.9	Very high	77 Å²	77	42.9 Å²	42.9	41%	0.412	22%	0.218	S	C	.	.	H	α-helix	trans	-71.6	-35.2	175.1	-74.9	-28.7	0	0	0	112.1	S798 R803 I804	S798-N800 PolarHBondContact O-N 2.84Å; S798-N800 VanDerWaalsContact O-N 3.12Å; S798-N800 PolarHBondContact OG-N 2.78Å; N800-R803 WeakPolarHBondContact O-CB 3.41Å; N800-R803 PolarHBondContact O-N 3.33Å; N800-I804 WeakPolarHBondContact O-CB 3.5Å; N800-I804 VanDerWaalsContact O-CG1 3.29Å; N800-I804 WeakPolarHBondContact O-CG1 3.47Å; N800-I804 PolarHBondContact O-N 2.7Å
801	D	93.8	Very high	92.8	Very high	46 Å²	46	39.7 Å²	39.7	25%	0.246	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-40.9	173.2	-58.7	-59.8	0	0	0	111.4	F796 V797 S798 R803 I804 Y805	F796-D801 HydrophobicContact CD1-CB 4.17Å; V797-D801 PolarHBondContact N-OD2 2.72Å; V797-D801 VanDerWaalsContact N-OD2 3.13Å; S798-D801 PolarHBondContact N-OD2 2.98Å; S798-D801 WeakPolarHBondContact O-CB 3.44Å; S798-D801 PolarHBondContact O-N 2.81Å; S798-D801 PolarHBondContact OG-N 2.97Å; S798-D801 PolarHBondContact OG-OD2 2.95Å; D801-R803 VanDerWaalsContact C-N 3.31Å; D801-R803 PolarHBondContact O-N 2.81Å; D801-I804 PolarHBondContact O-N 2.98Å; D801-Y805 PolarHBondContact O-N 2.7Å
802	V	94	Very high	92.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57.7	-44.5	172.3	169.2	0	0	0	0	111	H610 E611 Y614 F796 S798 Y805 W806	H610-V802 WeakPolarHBondContact ND1-CG1 3.2Å; E611-V802 HydrophobicContact CG-CG1 4.06Å; Y614-V802 HydrophobicContact CD1-CG2 3.73Å; Y614-V802 HydrophobicContact CD2-CG2 3.93Å; Y614-V802 HydrophobicContact CE1-CG2 3.97Å; Y614-V802 HydrophobicContact CE2-CG2 4.18Å; Y614-V802 HydrophobicContact CG-CG2 3.71Å; F796-V802 HydrophobicContact CB-CG2 4.14Å; F796-V802 HydrophobicContact CD1-CG2 3.83Å; F796-V802 HydrophobicContact CD2-CG2 4.47Å; F796-V802 HydrophobicContact CE1-CG2 4.33Å; F796-V802 HydrophobicContact CG-CG2 3.91Å; S798-V802 PolarHBondContact O-N 2.77Å; V802-Y805 PolarHBondContact O-N 3.12Å; V802-W806 PolarHBondContact O-N 2.88Å
803	R	93.4	Very high	92.9	Very high	45 Å²	45	31 Å²	31	17%	0.17	16%	0.158	C	C	.	.	H	α-helix	trans	-66.7	-37	175.7	-72.1	167.1	171.4	164.8	3.2	112.6	E611 L799 N800 D801 W806 L807 F896	E611-R803 HydrophobicContact CG-CG 4.29Å; E611-R803 IonicContact OE1-NE 3.35Å; E611-R803 IonicContact OE2-CZ 2.67Å; E611-R803 VanDerWaalsContact OE2-CZ 3.3Å; E611-R803 IonicContact OE2-NE 3.86Å; E611-R803 PolarHBondContact OE2-NE 3.21Å; E611-R803 IonicContact OE2-NH2 2.68Å; E611-R803 PolarHBondContact OE2-NH2 2.77Å; L799-R803 VanDerWaalsContact O-CG 3.29Å; L799-R803 WeakPolarHBondContact O-CG 3.28Å; L799-R803 PolarHBondContact O-N 3.05Å; N800-R803 WeakPolarHBondContact O-CB 3.41Å; N800-R803 PolarHBondContact O-N 3.33Å; D801-R803 VanDerWaalsContact C-N 3.31Å; D801-R803 PolarHBondContact O-N 2.81Å; R803-W806 PolarHBondContact O-N 3.34Å; R803-L807 WeakPolarHBondContact O-CB 3.44Å; R803-L807 PolarHBondContact O-N 3.38Å; R803-F896 HydrophobicContact CB-CD1 4.13Å; R803-F896 HydrophobicContact CB-CD2 4.41Å; R803-F896 HydrophobicContact CB-CE1 3.49Å; R803-F896 VanDerWaalsContact CB-CE1 3.49Å; R803-F896 HydrophobicContact CB-CE2 3.79Å; R803-F896 HydrophobicContact CB-CZ 3.29Å; R803-F896 HydrophobicContact CG-CE2 4.39Å; R803-F896 HydrophobicContact CG-CZ 4.34Å
804	I	93.7	Very high	92.6	Very high	24 Å²	24	26.7 Å²	26.7	12%	0.123	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-41.4	174	-73.3	165.2	0	0	0	110.7	N800 D801 L807 H808 F896 V903 I904	N800-I804 WeakPolarHBondContact O-CB 3.5Å; N800-I804 VanDerWaalsContact O-CG1 3.29Å; N800-I804 WeakPolarHBondContact O-CG1 3.47Å; N800-I804 PolarHBondContact O-N 2.7Å; D801-I804 PolarHBondContact O-N 2.98Å; I804-L807 PolarHBondContact O-N 3Å; I804-H808 WeakPolarHBondContact O-CB 3.12Å; I804-H808 PolarHBondContact O-N 3.41Å; I804-F896 HydrophobicContact CG1-CE1 4.09Å; I804-F896 HydrophobicContact CG1-CZ 4.01Å; I804-V903 HydrophobicContact CG2-CG1 4.48Å; I804-I904 HydrophobicContact CG2-CD1 4.17Å
805	Y	94.9	Very high	92.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.2	-48.1	171.6	166.3	-79.6	0	0	0	111.7	L743 A767 L769 H794 F796 D801 V802 L807 H808 L809	L743-Y805 HydrophobicContact CD1-CE1 3.92Å; L743-Y805 HydrophobicContact CD2-CD1 4.43Å; L743-Y805 HydrophobicContact CD2-CE1 3.85Å; L743-Y805 HydrophobicContact CD2-CE2 4.22Å; L743-Y805 HydrophobicContact CG-CE1 4.34Å; A767-Y805 HydrophobicContact CB-CD2 4.2Å; A767-Y805 HydrophobicContact CB-CE2 3.69Å; L769-Y805 HydrophobicContact CD1-CD2 3.99Å; L769-Y805 HydrophobicContact CD1-CE2 4.02Å; L769-Y805 HydrophobicContact CD2-CD2 4.32Å; L769-Y805 HydrophobicContact CD2-CE2 3.5Å; L769-Y805 HydrophobicContact CG-CD2 3.98Å; L769-Y805 HydrophobicContact CG-CE2 3.6Å; H794-Y805 HydrophobicContact CB-CD2 4.2Å; H794-Y805 AromaticContact CD2-CD2 3.87Å; H794-Y805 AromaticContact CG-CD2 4Å; F796-Y805 HydrophobicContact CE1-CD2 4.2Å; F796-Y805 HydrophobicContact CE1-CG 4.01Å; F796-Y805 AromaticContact CZ-CD2 3.96Å; F796-Y805 HydrophobicContact CZ-CD2 3.96Å; F796-Y805 AromaticContact CZ-CG 4Å; F796-Y805 HydrophobicContact CZ-CG 4Å; D801-Y805 PolarHBondContact O-N 2.7Å; V802-Y805 PolarHBondContact O-N 3.12Å; Y805-L807 VanDerWaalsContact C-N 3.29Å; Y805-L807 PolarHBondContact O-N 3.45Å; Y805-H808 PolarHBondContact O-N 2.88Å; Y805-L809 HydrophobicContact CE1-CD2 4.07Å; Y805-L809 WeakPolarHBondContact O-CB 3.33Å; Y805-L809 PolarHBondContact O-N 3.31Å
806	W	94.3	Very high	92.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.7	-34	178.5	-80.5	109.7	0	0	0	112.4	F603 M606 Q607 H610 L738 L741 L743 V802 R803 L809 R810 W877	F603-W806 HydrophobicContact CB-CZ3 4.17Å; F603-W806 HydrophobicContact CD1-CH2 4.49Å; F603-W806 HydrophobicContact CD1-CZ3 4.06Å; M606-W806 HydrophobicContact CB-CH2 3.56Å; M606-W806 HydrophobicContact CB-CZ2 3.97Å; M606-W806 HydrophobicContact CB-CZ3 4.48Å; Q607-W806 HydrophobicContact CB-CD2 3.69Å; Q607-W806 HydrophobicContact CB-CE3 4.06Å; Q607-W806 HydrophobicContact CB-CG 3.93Å; Q607-W806 HydrophobicContact CB-CZ2 4.39Å; Q607-W806 HydrophobicContact CG-CB 4.09Å; Q607-W806 HydrophobicContact CG-CD2 4.03Å; Q607-W806 HydrophobicContact CG-CG 3.69Å; H610-W806 HydrophobicContact CB-CZ2 4.29Å; H610-W806 AromaticContact CG-NE1 3.88Å; H610-W806 AromaticContact ND1-NE1 3.57Å; L738-W806 HydrophobicContact CD2-CZ2 4.05Å; L741-W806 HydrophobicContact CD1-CH2 3.58Å; L741-W806 HydrophobicContact CD1-CZ2 4.32Å; L741-W806 HydrophobicContact CD1-CZ3 4.36Å; L743-W806 HydrophobicContact CD1-CH2 4.22Å; L743-W806 HydrophobicContact CD1-CZ2 3.55Å; V802-W806 PolarHBondContact O-N 2.88Å; R803-W806 PolarHBondContact O-N 3.34Å; W806-L809 HydrophobicContact CE3-CD2 3.96Å; W806-L809 HydrophobicContact CZ3-CD2 3.76Å; W806-R810 WeakPolarHBondContact O-CB 3.09Å; W806-R810 PolarHBondContact O-N 3.4Å; W806-R810 VanDerWaalsContact O-N 3.08Å; W806-W877 HydrophobicContact CE3-CH2 4.24Å; W806-W877 HydrophobicContact CE3-CZ3 4.24Å; W806-W877 HydrophobicContact CZ3-CH2 4.27Å; W806-W877 HydrophobicContact CZ3-CZ3 4.49Å
807	L	92.2	Very high	92	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.4	-44.4	172.5	-171.4	68	0	0	0	112	R803 I804 Y805 R810 A811 F896 A897 H900 I904 W915	R803-L807 WeakPolarHBondContact O-CB 3.44Å; R803-L807 PolarHBondContact O-N 3.38Å; I804-L807 PolarHBondContact O-N 3Å; Y805-L807 VanDerWaalsContact C-N 3.29Å; Y805-L807 PolarHBondContact O-N 3.45Å; L807-R810 VanDerWaalsContact CD1-NH2 3.3Å; L807-R810 PolarHBondContact O-N 2.89Å; L807-A811 WeakPolarHBondContact O-CB 3.14Å; L807-A811 PolarHBondContact O-N 3.07Å; L807-F896 HydrophobicContact CD2-CD1 4.36Å; L807-F896 HydrophobicContact CD2-CE1 4.4Å; L807-A897 HydrophobicContact CD1-CB 3.45Å; L807-A897 VanDerWaalsContact CD1-CB 3.45Å; L807-H900 HydrophobicContact CD2-CB 3.72Å; L807-I904 HydrophobicContact CB-CG1 4.45Å; L807-I904 HydrophobicContact CD2-CG1 3.71Å; L807-I904 HydrophobicContact CG-CG1 3.9Å; L807-W915 HydrophobicContact CD1-CH2 3.82Å; L807-W915 HydrophobicContact CD1-CZ3 3.57Å; L807-W915 HydrophobicContact CD2-CH2 4.38Å; L807-W915 HydrophobicContact CG-CH2 3.93Å; L807-W915 HydrophobicContact CG-CZ3 3.96Å
808	H	93.9	Very high	91.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.3	-48	179.2	-164.2	-176.4	0	0	0	111.4	L769 H792 H794 I804 Y805 R810 A811 I812 I904	L769-H808 HydrophobicContact CD1-CB 4.15Å; H792-H808 AromaticContact CD2-CE1 3.75Å; H792-H808 AromaticContact CG-CE1 3.79Å; H794-H808 AromaticContact CE1-CG 3.93Å; H794-H808 AromaticContact CE1-ND1 3.33Å; H794-H808 PolarHBondContact CE1-ND1 3.34Å; H794-H808 VanDerWaalsContact CE1-ND1 3.33Å; H794-H808 AromaticContact NE2-CG 3.88Å; H794-H808 AromaticContact NE2-ND1 3.11Å; H794-H808 PolarHBondContact NE2-ND1 3.39Å; H794-H808 VanDerWaalsContact NE2-ND1 3.11Å; I804-H808 WeakPolarHBondContact O-CB 3.12Å; I804-H808 PolarHBondContact O-N 3.41Å; Y805-H808 PolarHBondContact O-N 2.88Å; H808-R810 VanDerWaalsContact C-N 3.31Å; H808-R810 PolarHBondContact O-N 3.02Å; H808-A811 WeakPolarHBondContact O-CB 3.37Å; H808-A811 PolarHBondContact O-N 3.03Å; H808-A811 VanDerWaalsContact O-N 3.07Å; H808-I812 WeakPolarHBondContact O-CG1 3.07Å; H808-I812 PolarHBondContact O-N 3.4Å; H808-I904 HydrophobicContact CB-CD1 3.65Å
809	L	94.1	Very high	91	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-55.8	-46.3	174.2	175	61.6	0	0	0	110.9	L769 Y805 W806 A811 I812 V813 A863 L865 W877	L769-L809 HydrophobicContact CD1-CB 3.91Å; L769-L809 HydrophobicContact CD2-CB 4.24Å; L769-L809 HydrophobicContact CD2-CD1 3.83Å; L769-L809 HydrophobicContact CD2-CG 4.46Å; Y805-L809 HydrophobicContact CE1-CD2 4.07Å; Y805-L809 WeakPolarHBondContact O-CB 3.33Å; Y805-L809 PolarHBondContact O-N 3.31Å; W806-L809 HydrophobicContact CE3-CD2 3.96Å; W806-L809 HydrophobicContact CZ3-CD2 3.76Å; L809-A811 VanDerWaalsContact C-N 3.34Å; L809-A811 PolarHBondContact O-N 3.25Å; L809-I812 PolarHBondContact O-N 2.96Å; L809-V813 HydrophobicContact CD1-CG2 3.63Å; L809-V813 HydrophobicContact CG-CG2 4.29Å; L809-V813 WeakPolarHBondContact O-CB 3.26Å; L809-V813 WeakPolarHBondContact O-CG2 3.34Å; L809-V813 PolarHBondContact O-N 3.25Å; L809-A863 HydrophobicContact CD1-CB 3.46Å; L809-A863 VanDerWaalsContact CD1-CB 3.46Å; L809-L865 HydrophobicContact CD1-CD1 3.91Å; L809-W877 HydrophobicContact CD2-CH2 4.07Å; L809-W877 HydrophobicContact CG-CH2 3.93Å; L809-W877 HydrophobicContact CG-CZ2 4.32Å
810	R	91.5	Very high	90.3	Very high	9 Å²	9	23.2 Å²	23.2	3%	0.034	11%	0.111	C	C	.	.	H	α-helix	trans	-60.4	-40.1	175.4	175.9	167.5	51.3	-166.3	-8.7	112.2	W806 L807 H808 L814 W877	W806-R810 WeakPolarHBondContact O-CB 3.09Å; W806-R810 PolarHBondContact O-N 3.4Å; W806-R810 VanDerWaalsContact O-N 3.08Å; L807-R810 VanDerWaalsContact CD1-NH2 3.3Å; L807-R810 PolarHBondContact O-N 2.89Å; H808-R810 VanDerWaalsContact C-N 3.31Å; H808-R810 PolarHBondContact O-N 3.02Å; R810-L814 HydrophobicContact CG-CD1 3.86Å; R810-L814 VanDerWaalsContact O-CB 3.31Å; R810-L814 WeakPolarHBondContact O-CB 3.46Å; R810-L814 VanDerWaalsContact O-CG 3.31Å; R810-L814 WeakPolarHBondContact O-CG 3.49Å; R810-L814 PolarHBondContact O-N 3.33Å; R810-W877 HydrophobicContact CB-CE3 4.09Å; R810-W877 HydrophobicContact CB-CH2 4.05Å; R810-W877 HydrophobicContact CB-CZ3 3.72Å; R810-W877 HydrophobicContact CG-CE3 4.08Å; R810-W877 HydrophobicContact CG-CZ3 4.24Å
811	A	91	Very high	89.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66	-49.2	178.2	0	0	0	0	0	112.6	L807 H808 L809 S815 I904 V908 L911 W915	L807-A811 WeakPolarHBondContact O-CB 3.14Å; L807-A811 PolarHBondContact O-N 3.07Å; H808-A811 WeakPolarHBondContact O-CB 3.37Å; H808-A811 PolarHBondContact O-N 3.03Å; H808-A811 VanDerWaalsContact O-N 3.07Å; L809-A811 VanDerWaalsContact C-N 3.34Å; L809-A811 PolarHBondContact O-N 3.25Å; A811-S815 WeakPolarHBondContact O-CB 3.03Å; A811-S815 PolarHBondContact O-N 3.23Å; A811-S815 PolarHBondContact O-OG 3.36Å; A811-I904 HydrophobicContact CB-CG2 3.4Å; A811-I904 VanDerWaalsContact CB-CG2 3.4Å; A811-V908 HydrophobicContact CB-CG2 4.02Å; A811-L911 HydrophobicContact CB-CD1 4.04Å; A811-W915 HydrophobicContact CB-CD2 4.06Å; A811-W915 HydrophobicContact CB-CE3 3.6Å; A811-W915 HydrophobicContact CB-CH2 4.2Å; A811-W915 HydrophobicContact CB-CZ3 3.68Å
812	I	93.1	Very high	88.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.5	-52.1	174.9	-64.5	166.3	0	0	0	110	L769 D771 H808 L809 L814 S815 T816 A863 V908	L769-I812 HydrophobicContact CB-CD1 4.29Å; L769-I812 HydrophobicContact CD1-CD1 4.28Å; D771-I812 HydrophobicContact CB-CD1 4.32Å; D771-I812 HydrophobicContact CB-CG1 4.34Å; D771-I812 WeakPolarHBondContact OD1-CG2 3.02Å; H808-I812 WeakPolarHBondContact O-CG1 3.07Å; H808-I812 PolarHBondContact O-N 3.4Å; L809-I812 PolarHBondContact O-N 2.96Å; I812-L814 PolarHBondContact O-N 2.94Å; I812-S815 CarbonylContact O-C 3.48Å; I812-S815 WeakPolarHBondContact O-CA 3.49Å; I812-S815 PolarHBondContact O-N 3.2Å; I812-T816 PolarHBondContact O-N 2.78Å; I812-T816 PolarHBondContact O-OG1 3.1Å; I812-A863 HydrophobicContact CB-CB 4.46Å; I812-A863 HydrophobicContact CG2-CB 3.84Å; I812-V908 HydrophobicContact CG1-CG1 4.4Å; I812-V908 HydrophobicContact CG1-CG2 3.92Å
813	V	92.1	Very high	86.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-68.6	-31.9	-171.7	169.5	0	0	0	0	113.3	L809 S815 A862 A863 A871 W877	L809-V813 HydrophobicContact CD1-CG2 3.63Å; L809-V813 HydrophobicContact CG-CG2 4.29Å; L809-V813 WeakPolarHBondContact O-CB 3.26Å; L809-V813 WeakPolarHBondContact O-CG2 3.34Å; L809-V813 PolarHBondContact O-N 3.25Å; V813-S815 VanDerWaalsContact C-N 3.31Å; V813-A862 HydrophobicContact CG2-CB 4.29Å; V813-A863 HydrophobicContact CG2-CB 3.69Å; V813-A871 HydrophobicContact CG1-CB 3.71Å; V813-A871 WeakPolarHBondContact CG1-O 3.34Å; V813-A871 HydrophobicContact CG2-CB 4.01Å; V813-W877 HydrophobicContact CB-CZ2 4.2Å; V813-W877 HydrophobicContact CG1-CZ2 4Å; V813-W877 HydrophobicContact CG2-CZ2 4.45Å
814	L	87.9	Confident	85.7	Confident	15 Å²	15	35.7 Å²	35.7	8%	0.079	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-1.7	172.7	-63.5	178.8	0	0	0	113.3	R810 I812 I874 F920 R937	R810-L814 HydrophobicContact CG-CD1 3.86Å; R810-L814 VanDerWaalsContact O-CB 3.31Å; R810-L814 WeakPolarHBondContact O-CB 3.46Å; R810-L814 VanDerWaalsContact O-CG 3.31Å; R810-L814 WeakPolarHBondContact O-CG 3.49Å; R810-L814 PolarHBondContact O-N 3.33Å; I812-L814 PolarHBondContact O-N 2.94Å; L814-I874 HydrophobicContact CD2-CG1 4.45Å; L814-F920 HydrophobicContact CD1-CD1 4.37Å; L814-F920 HydrophobicContact CD2-CD1 4.31Å; L814-F920 HydrophobicContact CD2-CE1 4.49Å; L814-R937 PolarHBondContact O-NH2 2.99Å
815	S	89.6	Confident	84.6	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.007	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-33	174.7	-57.9	0	0	0	0	113.1	A811 I812 V813 W817 R910 N912	A811-S815 WeakPolarHBondContact O-CB 3.03Å; A811-S815 PolarHBondContact O-N 3.23Å; A811-S815 PolarHBondContact O-OG 3.36Å; I812-S815 CarbonylContact O-C 3.48Å; I812-S815 WeakPolarHBondContact O-CA 3.49Å; I812-S815 PolarHBondContact O-N 3.2Å; V813-S815 VanDerWaalsContact C-N 3.31Å; S815-W817 PolarHBondContact O-N 2.84Å; S815-R910 WeakPolarHBondContact CB-O 3.44Å; S815-N912 WeakPolarHBondContact OG-CB 3.2Å; S815-N912 PolarHBondContact OG-N 2.57Å
816	T	90.7	Very high	83	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.055	23%	0.23	C	C	.	.	S	Bend	trans	-57.6	129.9	174.7	-47.5	0	0	0	0	111.4	T772 I782 I812 L818 A862	T772-T816 WeakPolarHBondContact O-CG2 3.32Å; T772-T816 WeakPolarHBondContact OG1-CG2 3.37Å; T772-T816 PolarHBondContact OG1-OG1 3.44Å; I782-T816 HydrophobicContact CG2-CG2 4.41Å; I812-T816 PolarHBondContact O-N 2.78Å; I812-T816 PolarHBondContact O-OG1 3.1Å; T816-L818 HydrophobicContact CG2-CD1 4.02Å; T816-L818 HydrophobicContact CG2-CD2 4.38Å; T816-L818 HydrophobicContact CG2-CG 3.7Å; T816-L818 PolarHBondContact O-N 2.75Å; T816-A862 HydrophobicContact CG2-CB 3.91Å
817	W	86.3	Confident	81.5	Confident	88 Å²	88	52.8 Å²	52.8	33%	0.333	26%	0.263	S	S	.	.			trans	-79.7	33.9	-167.9	-78.6	55.4	0	0	0	116.2	A777 S815	A777-W817 WeakPolarHBondContact CA-O 3.07Å; A777-W817 HydrophobicContact CB-CB 4Å; A777-W817 HydrophobicContact CB-CE3 4.08Å; S815-W817 PolarHBondContact O-N 2.84Å
818	L	84.9	Confident	80.1	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.11	27%	0.268	C	S	.	.			trans	-86.4	168.8	-175.3	-54.7	-174.8	0	0	0	114.5	A778 T781 I782 T816 A862 H872	A778-L818 HydrophobicContact CB-CD2 3.99Å; A778-L818 CarbonylContact O-C 3.54Å; A778-L818 WeakPolarHBondContact O-CA 3.24Å; T781-L818 WeakPolarHBondContact O-CD2 3.46Å; I782-L818 HydrophobicContact CG2-CD1 4.38Å; T816-L818 HydrophobicContact CG2-CD1 4.02Å; T816-L818 HydrophobicContact CG2-CD2 4.38Å; T816-L818 HydrophobicContact CG2-CG 3.7Å; T816-L818 PolarHBondContact O-N 2.75Å; L818-A862 HydrophobicContact CD1-CB 3.91Å; L818-H872 HydrophobicContact CB-CB 3.75Å; L818-H872 HydrophobicContact CD1-CB 4.43Å
819	G	77	Confident	78.2	Confident	29 Å²	29	60.4 Å²	60.4	30%	0.299	30%	0.298	S	S	.	.			trans	93.9	4.9	177.2	0	0	0	0	0	115.1	A778 Y779 R821	A778-G819 PolarHBondContact O-N 2.75Å; Y779-G819 VanDerWaalsContact O-CA 3.23Å; Y779-G819 WeakPolarHBondContact O-CA 3.43Å; Y779-G819 PolarHBondContact O-N 2.83Å; G819-R821 PolarHBondContact O-N 3.4Å; G819-R821 VanDerWaalsContact O-N 3.16Å
820	R	76.5	Confident	76.3	Confident	123 Å²	123	65.3 Å²	65.3	46%	0.464	33%	0.329	S	S	.	.			trans	-69	108.4	176.1	-74.2	-163.5	177.8	-157.2	3.6	110.6	A778 S822 A823	A778-R820 PolarHBondContact O-N 3.12Å; R820-S822 PolarHBondContact O-N 2.78Å; R820-S822 VanDerWaalsContact O-N 3.11Å; R820-A823 HydrophobicContact CB-CB 4.08Å; R820-A823 PolarHBondContact O-N 3.43Å
821	R	71.6	Confident	75	Confident	209 Å²	209	70.3 Å²	70.3	79%	0.789	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-18.7	177.6	-69.5	-168.6	-179	-156.1	0.8	115	Y779 G819	Y779-R821 HydrophobicContact CE2-CG 4.4Å; G819-R821 PolarHBondContact O-N 3.4Å; G819-R821 VanDerWaalsContact O-N 3.16Å
822	S	67.6	Low	73.8	Confident	113 Å²	113	71.6 Å²	71.6	79%	0.79	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-22.3	175.5	53	0	0	0	0	113.2	R820 K824	R820-S822 PolarHBondContact O-N 2.78Å; R820-S822 VanDerWaalsContact O-N 3.11Å; S822-K824 VanDerWaalsContact C-N 3.33Å
823	A	67.9	Low	72.3	Confident	40 Å²	40	81.3 Å²	81.3	33%	0.331	39%	0.393	S	S	.	.	S	Bend	trans	-103.2	43.3	178.1	0	0	0	0	0	110.3	A777 Y779 R820	A777-A823 VanDerWaalsContact O-CB 3.29Å; A777-A823 WeakPolarHBondContact O-CB 3.48Å; Y779-A823 VanDerWaalsContact CB-O 3.24Å; Y779-A823 WeakPolarHBondContact CB-O 3.42Å; Y779-A823 PolarHBondContact N-O 2.96Å; R820-A823 HydrophobicContact CB-CB 4.08Å; R820-A823 PolarHBondContact O-N 3.43Å
824	K	69.5	Low	71	Confident	67 Å²	67	84.5 Å²	84.5	29%	0.291	41%	0.41	S	S	.	.			trans	-103.6	118.6	-177.8	-178.1	-154.7	165.2	-66.8	0	108.5	Y779 S822 D828 F829	Y779-K824 HydrophobicContact CD1-CB 4.21Å; Y779-K824 HydrophobicContact CD1-CG 3.69Å; Y779-K824 HydrophobicContact CD2-CB 4.4Å; Y779-K824 HydrophobicContact CE1-CG 4.1Å; Y779-K824 HydrophobicContact CG-CB 3.91Å; Y779-K824 HydrophobicContact CG-CG 3.92Å; S822-K824 VanDerWaalsContact C-N 3.33Å; K824-D828 VanDerWaalsContact CA-OD2 3.29Å; K824-D828 WeakPolarHBondContact CA-OD2 3.48Å; K824-D828 HydrophobicContact CG-CB 4.05Å; K824-D828 WeakPolarHBondContact CG-OD2 3.49Å; K824-F829 VanDerWaalsContact CE-CZ 3.46Å; K824-F829 VanDerWaalsContact NZ-CE2 3.28Å
825	R	69.3	Low	70.1	Confident	146 Å²	146	87.6 Å²	87.6	55%	0.551	43%	0.433	S	S	*	.			trans	-70.1	158.6	177.3	-66	-179.8	176.5	169.8	-2.6	110.4	D827 D828	R825-D827 PolarHBondContact O-N 2.9Å; R825-D828 PolarHBondContact N-OD2 2.82Å
826	P	62	Low	69.3	Low	106 Å²	106	95.1 Å²	95.1	69%	0.688	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-44.9	171.6	-23.9	34.8	0	0	0	111.1	D828	P826-D828 PolarHBondContact O-N 3.27Å
827	D	63.2	Low	68.4	Low	131 Å²	131	95.1 Å²	95.1	70%	0.701	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	4.6	-166.5	-31.9	-74.3	0	0	0	113.8	R825 F829	R825-D827 PolarHBondContact O-N 2.9Å; D827-F829 PolarHBondContact O-N 3.14Å
828	D	63.5	Low	67.9	Low	19 Å²	19	93.8 Å²	93.8	10%	0.102	46%	0.459	C	S	.	.			trans	-65.4	22.5	174.2	-85.6	-37.8	0	0	0	113.8	Y779 M780 K824 R825 P826	Y779-D828 HydrophobicContact CD1-CB 4.29Å; Y779-D828 WeakPolarHBondContact CD1-OD2 3.29Å; M780-D828 HydrophobicContact CE-CB 3.55Å; M780-D828 VanDerWaalsContact CE-O 3.31Å; M780-D828 WeakPolarHBondContact CE-O 3.2Å; M780-D828 VanDerWaalsContact CE-OD1 3.22Å; M780-D828 WeakPolarHBondContact CE-OD1 3.24Å; K824-D828 VanDerWaalsContact CA-OD2 3.29Å; K824-D828 WeakPolarHBondContact CA-OD2 3.48Å; K824-D828 HydrophobicContact CG-CB 4.05Å; K824-D828 WeakPolarHBondContact CG-OD2 3.49Å; R825-D828 PolarHBondContact N-OD2 2.82Å; P826-D828 PolarHBondContact O-N 3.27Å
829	F	52.2	Low	67.5	Low	141 Å²	141	96.8 Å²	96.8	62%	0.618	49%	0.486	S	S	*	.			trans	-148.4	147.5	-175.9	-66.5	-58.6	0	0	0	112.3	K824 D827	K824-F829 VanDerWaalsContact CE-CZ 3.46Å; K824-F829 VanDerWaalsContact NZ-CE2 3.28Å; D827-F829 PolarHBondContact O-N 3.14Å
830	P	55.8	Low	67.6	Low	103 Å²	103	98 Å²	98	67%	0.669	49%	0.49	S	S	*	.	P	Polyproline II helix	cis	-100.1	151.6	3.9	36.6	-31.9	0	0	0	113.2	P832	P830-P832 WeakPolarHBondContact O-CD 3.43Å
831	R	62.6	Low	67.9	Low	114 Å²	114	92.6 Å²	92.6	43%	0.43	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-60.7	123.8	167.6	-177.2	-177.8	-175.4	-94.6	-11.9	109	D834 Y868	R831-D834 IonicContact CZ-OD1 3.87Å; R831-D834 IonicContact NH1-OD1 3.7Å; R831-D834 PolarHBondContact NH1-OD1 2.6Å; R831-D834 IonicContact NH2-OD1 2.76Å; R831-D834 PolarHBondContact NH2-OD1 3.25Å; R831-Y868 HydrophobicContact CB-CD1 4.34Å; R831-Y868 HydrophobicContact CG-CD1 4.08Å
832	P	65.7	Low	68.4	Low	28 Å²	28	85.1 Å²	85.1	18%	0.182	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-56.7	154.9	177.4	-26.4	34.9	0	0	0	112.4	P830 Y836 L837 Y868	P830-P832 WeakPolarHBondContact O-CD 3.43Å; P832-Y836 HydrophobicContact CB-CD1 3.89Å; P832-Y836 HydrophobicContact CB-CG 4.41Å; P832-L837 HydrophobicContact CB-CD2 4.07Å; P832-L837 HydrophobicContact CB-CG 4.15Å; P832-L837 HydrophobicContact CG-CD2 4.26Å; P832-Y868 HydrophobicContact CG-CD2 4.03Å; P832-Y868 HydrophobicContact CG-CE2 3.92Å; P832-Y868 HydrophobicContact CG-CG 4.42Å
833	R	61.9	Low	69.2	Low	203 Å²	203	84.1 Å²	84.1	77%	0.766	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-62.5	141.8	169.8	-63.7	-174.7	-174.8	178.5	5.8	108.4	S835 Y836 L837	R833-S835 PolarHBondContact O-N 2.8Å; R833-Y836 WeakPolarHBondContact O-CB 3.41Å; R833-Y836 PolarHBondContact O-N 2.84Å; R833-L837 PolarHBondContact O-N 2.87Å; R833-L837 VanDerWaalsContact O-N 3.16Å
834	D	65.7	Low	69.9	Low	68 Å²	68	85.4 Å²	85.4	36%	0.364	43%	0.425	S	S	.	.	H	α-helix	trans	-57.5	-22.8	176.8	-75.1	1.8	0	0	0	112	W736 R831 K838	W736-D834 HydrophobicContact CH2-CB 3.88Å; W736-D834 HydrophobicContact CZ2-CB 3.89Å; R831-D834 IonicContact CZ-OD1 3.87Å; R831-D834 IonicContact NH1-OD1 3.7Å; R831-D834 PolarHBondContact NH1-OD1 2.6Å; R831-D834 IonicContact NH2-OD1 2.76Å; R831-D834 PolarHBondContact NH2-OD1 3.25Å; D834-K838 PolarHBondContact O-N 3.29Å
835	S	68.3	Low	70.4	Confident	80 Å²	80	84.9 Å²	84.9	56%	0.559	43%	0.425	S	S	*	.	H	α-helix	trans	-72.4	-37.6	171.1	60.6	0	0	0	0	114.4	R833 L837 K838 A839	R833-S835 PolarHBondContact O-N 2.8Å; S835-L837 VanDerWaalsContact C-N 3.29Å; S835-K838 PolarHBondContact O-N 2.97Å; S835-A839 WeakPolarHBondContact O-CB 3.39Å; S835-A839 PolarHBondContact O-N 3.19Å
836	Y	73.7	Confident	70.9	Confident	160 Å²	160	79.7 Å²	79.7	63%	0.627	41%	0.407	S	S	*	.	H	α-helix	trans	-66.1	-38.4	174.1	-178.9	-85.5	0	0	0	110.1	P832 R833 A839 S840	P832-Y836 HydrophobicContact CB-CD1 3.89Å; P832-Y836 HydrophobicContact CB-CG 4.41Å; R833-Y836 WeakPolarHBondContact O-CB 3.41Å; R833-Y836 PolarHBondContact O-N 2.84Å; Y836-A839 PolarHBondContact O-N 2.97Å; Y836-S840 PolarHBondContact O-N 3.3Å
837	L	71.6	Confident	71.6	Confident	8 Å²	8	81.2 Å²	81.2	4%	0.042	41%	0.409	C	S	.	.	H	α-helix	trans	-62.5	-47.4	173.1	-63.3	176.5	0	0	0	111.2	W736 Y740 P832 R833 S835 A839 S840	W736-L837 HydrophobicContact CH2-CB 4.26Å; W736-L837 HydrophobicContact CZ3-CB 3.89Å; Y740-L837 HydrophobicContact CE2-CB 3.76Å; Y740-L837 WeakPolarHBondContact CE2-O 3.29Å; Y740-L837 WeakPolarHBondContact OH-CA 3.47Å; Y740-L837 WeakPolarHBondContact OH-CB 3.24Å; Y740-L837 WeakPolarHBondContact OH-CD2 3.33Å; Y740-L837 PolarHBondContact OH-O 2.82Å; P832-L837 HydrophobicContact CB-CD2 4.07Å; P832-L837 HydrophobicContact CB-CG 4.15Å; P832-L837 HydrophobicContact CG-CD2 4.26Å; R833-L837 PolarHBondContact O-N 2.87Å; R833-L837 VanDerWaalsContact O-N 3.16Å; S835-L837 VanDerWaalsContact C-N 3.29Å; L837-A839 PolarHBondContact O-N 2.89Å; L837-S840 PolarHBondContact O-N 3.09Å; L837-S840 VanDerWaalsContact O-N 3.1Å
838	K	75.9	Confident	72.2	Confident	61 Å²	61	80.9 Å²	80.9	27%	0.265	40%	0.403	S	S	.	.	H	α-helix	trans	-58.8	-34.1	175.1	-157.3	-152.7	-179.4	-160	0	112.7	W736 E759 D834 S835	W736-K838 HydrophobicContact CB-CG 4.1Å; W736-K838 HydrophobicContact CD2-CG 4.42Å; W736-K838 HydrophobicContact CG-CG 4.06Å; E759-K838 VanDerWaalsContact OE1-CE 3.31Å; E759-K838 WeakPolarHBondContact OE1-CE 3.35Å; E759-K838 IonicContact OE1-NZ 2.58Å; E759-K838 PolarHBondContact OE1-NZ 3.12Å; E759-K838 VanDerWaalsContact OE2-CE 3.24Å; E759-K838 WeakPolarHBondContact OE2-CE 3.31Å; E759-K838 IonicContact OE2-NZ 2.71Å; E759-K838 PolarHBondContact OE2-NZ 3.33Å; D834-K838 PolarHBondContact O-N 3.29Å; S835-K838 PolarHBondContact O-N 2.97Å
839	A	77.3	Confident	73	Confident	83 Å²	83	80.9 Å²	80.9	69%	0.686	40%	0.404	S	S	*	.	H	α-helix	trans	-75	-20.5	178	0	0	0	0	0	114.1	S835 Y836 L837	S835-A839 WeakPolarHBondContact O-CB 3.39Å; S835-A839 PolarHBondContact O-N 3.19Å; Y836-A839 PolarHBondContact O-N 2.97Å; L837-A839 PolarHBondContact O-N 2.89Å
840	S	77.6	Confident	74.3	Confident	55 Å²	55	81.7 Å²	81.7	39%	0.385	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	16.3	179.5	102.1	0	0	0	0	113.8	Y740 Y836 L837	Y740-S840 PolarHBondContact OH-OG 2.93Å; Y836-S840 PolarHBondContact O-N 3.3Å; L837-S840 PolarHBondContact O-N 3.09Å; L837-S840 VanDerWaalsContact O-N 3.1Å
841	L	82.3	Confident	75.6	Confident	10 Å²	10	81.2 Å²	81.2	5%	0.052	40%	0.399	C	S	.	.	S	Bend	trans	-84.8	136.1	175	-75.3	171	0	0	0	110.2	W736 Y740 V856	W736-L841 HydrophobicContact CB-CD1 3.75Å; Y740-L841 HydrophobicContact CD1-CD2 4.35Å; Y740-L841 HydrophobicContact CD2-CD2 3.66Å; Y740-L841 HydrophobicContact CD2-CG 4.27Å; Y740-L841 HydrophobicContact CE1-CD2 4.41Å; Y740-L841 HydrophobicContact CE2-CD1 4.46Å; Y740-L841 HydrophobicContact CE2-CD2 3.76Å; Y740-L841 HydrophobicContact CE2-CG 3.98Å; Y740-L841 HydrophobicContact CG-CD2 3.99Å; L841-V856 HydrophobicContact CD2-CG2 4.14Å
842	P	83.5	Confident	76.8	Confident	52 Å²	52	78.2 Å²	78.2	34%	0.338	39%	0.391	S	S	.	.			trans	-60.9	143.6	172.3	27.4	-33.9	0	0	0	110.4	Y844 V856	P842-Y844 HydrophobicContact CB-CE2 3.77Å; P842-Y844 HydrophobicContact CG-CE2 3.84Å; P842-V856 HydrophobicContact CG-CG2 4.06Å
843	R	83.7	Confident	77.9	Confident	91 Å²	91	76.9 Å²	76.9	34%	0.343	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.6	175.1	-58.9	-49.5	-167.4	127.3	-6.6	108.8	S747 N748 E759	S747-R843 WeakPolarHBondContact O-CD 3.3Å; S747-R843 PolarHBondContact O-NH1 2.83Å; N748-R843 HydrophobicContact CB-CB 4.28Å; E759-R843 IonicContact OE1-CZ 2.58Å; E759-R843 IonicContact OE1-NH1 2.88Å; E759-R843 PolarHBondContact OE1-NH1 3.44Å; E759-R843 IonicContact OE1-NH2 2.65Å; E759-R843 PolarHBondContact OE1-NH2 2.85Å
844	Y	83.2	Confident	79.1	Confident	68 Å²	68	71.1 Å²	71.1	27%	0.267	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	144.2	-175.8	-58.7	-96.4	0	0	0	110.2	A745 C746 S747 N748 P842 V849	A745-Y844 HydrophobicContact CB-CD2 3.77Å; A745-Y844 HydrophobicContact CB-CE2 3.9Å; C746-Y844 PolarHBondContact O-N 3.01Å; S747-Y844 CarbonylContact C-O 3.54Å; S747-Y844 WeakPolarHBondContact CA-O 3.4Å; N748-Y844 PolarHBondContact N-O 2.93Å; P842-Y844 HydrophobicContact CB-CE2 3.77Å; P842-Y844 HydrophobicContact CG-CE2 3.84Å; Y844-V849 HydrophobicContact CD1-CG2 4.19Å; Y844-V849 HydrophobicContact CD2-CG2 4.47Å; Y844-V849 HydrophobicContact CG-CG2 3.83Å
845	N	80	Confident	80.3	Confident	55 Å²	55	68 Å²	68	29%	0.294	35%	0.348	S	S	.	.			trans	-72.1	159.3	160.2	-60.9	-32.1	0	0	0	109	S751 D847 Q848	S751-N845 PolarHBondContact OG-OD1 2.77Å; S751-N845 VanDerWaalsContact OG-OD1 3.12Å; N845-D847 PolarHBondContact O-N 3.36Å; N845-D847 VanDerWaalsContact O-N 3.12Å; N845-Q848 HydrophobicContact CB-CB 4.42Å; N845-Q848 HydrophobicContact CB-CG 4.15Å; N845-Q848 PolarHBondContact ND2-OE1 3.3Å; N845-Q848 PolarHBondContact O-N 3.35Å; N845-Q848 VanDerWaalsContact O-N 3.09Å
846	F	79.7	Confident	81.2	Confident	37 Å²	37	65.4 Å²	65.4	16%	0.162	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-33.7	-169.7	-66.3	-58.5	0	0	0	113.8	L664 P665 W668 S751 Y760	L664-F846 HydrophobicContact CD2-CD1 3.94Å; L664-F846 HydrophobicContact CD2-CD2 4.2Å; L664-F846 HydrophobicContact CD2-CE1 3.7Å; L664-F846 HydrophobicContact CD2-CE2 3.95Å; L664-F846 HydrophobicContact CD2-CG 4.2Å; L664-F846 HydrophobicContact CD2-CZ 3.71Å; P665-F846 HydrophobicContact CG-CB 4.3Å; W668-F846 AromaticContact CD2-CD1 3.73Å; W668-F846 HydrophobicContact CD2-CD1 3.73Å; W668-F846 HydrophobicContact CD2-CE1 4.21Å; W668-F846 AromaticContact CE2-CD1 3.58Å; W668-F846 HydrophobicContact CE3-CD1 4.04Å; W668-F846 HydrophobicContact CE3-CE1 4.12Å; W668-F846 HydrophobicContact CG-CD1 4.26Å; W668-F846 HydrophobicContact CH2-CD1 4.1Å; W668-F846 HydrophobicContact CZ2-CB 4.48Å; W668-F846 AromaticContact CZ2-CD1 3.78Å; W668-F846 HydrophobicContact CZ2-CD1 3.78Å; W668-F846 HydrophobicContact CZ3-CD1 4.23Å; W668-F846 HydrophobicContact CZ3-CE1 4.29Å; W668-F846 AromaticContact NE1-CD1 3.95Å; W668-F846 PolarHBondContact NE1-O 2.81Å; S751-F846 WeakPolarHBondContact O-CE2 3.15Å; Y760-F846 HydrophobicContact CD2-CZ 4.37Å; Y760-F846 HydrophobicContact CG-CE1 4.33Å
847	D	76.4	Confident	81.4	Confident	139 Å²	139	59.4 Å²	59.4	74%	0.743	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-5.3	-175.8	-33.2	-76.7	0	0	0	113.9	N845	N845-D847 PolarHBondContact O-N 3.36Å; N845-D847 VanDerWaalsContact O-N 3.12Å
848	Q	76.8	Confident	81.8	Confident	123 Å²	123	62.2 Å²	62.2	58%	0.575	33%	0.334	S	S	*	.			trans	-103.8	10.3	-169.1	-65.9	-177.7	-10.4	0	0	113.9	N845	N845-Q848 HydrophobicContact CB-CB 4.42Å; N845-Q848 HydrophobicContact CB-CG 4.15Å; N845-Q848 PolarHBondContact ND2-OE1 3.3Å; N845-Q848 PolarHBondContact O-N 3.35Å; N845-Q848 VanDerWaalsContact O-N 3.09Å
849	V	78.9	Confident	82.4	Confident	20 Å²	20	63 Å²	63	12%	0.121	34%	0.336	C	S	.	.			trans	-87.9	125.5	-178.3	-173.4	0	0	0	0	111.4	W668 A745 F762 Y844	W668-V849 HydrophobicContact CH2-CG2 3.99Å; W668-V849 HydrophobicContact CZ2-CG2 3.45Å; W668-V849 VanDerWaalsContact CZ2-CG2 3.45Å; A745-V849 HydrophobicContact CB-CG1 3.76Å; A745-V849 HydrophobicContact CB-CG2 4.18Å; F762-V849 HydrophobicContact CB-CG1 4.45Å; F762-V849 HydrophobicContact CB-CG2 4.48Å; F762-V849 HydrophobicContact CD1-CB 4.15Å; F762-V849 HydrophobicContact CD1-CG1 3.37Å; F762-V849 HydrophobicContact CE1-CB 4.31Å; F762-V849 HydrophobicContact CE1-CG1 3.63Å; F762-V849 HydrophobicContact CG-CB 4.33Å; F762-V849 HydrophobicContact CG-CG1 3.96Å; F762-V849 HydrophobicContact CG-CG2 4.47Å; F762-V849 HydrophobicContact CZ-CG1 4.42Å; Y844-V849 HydrophobicContact CD1-CG2 4.19Å; Y844-V849 HydrophobicContact CD2-CG2 4.47Å; Y844-V849 HydrophobicContact CG-CG2 3.83Å
850	K	80.5	Confident	83	Confident	158 Å²	158	61.7 Å²	61.7	69%	0.687	32%	0.316	S	S	*	.			trans	-70.4	135.8	173.1	-62.4	-173.4	178.1	-172.7	0	110.8	H764 L852	H764-K850 PolarHBondContact CE1-O 3.5Å; H764-K850 VanDerWaalsContact CE1-O 3.23Å; H764-K850 PolarHBondContact ND1-O 3.24Å; K850-L852 PolarHBondContact O-N 2.73Å
851	L	82.2	Confident	83.6	Confident	92 Å²	92	59.2 Å²	59.2	48%	0.482	30%	0.299	S	S	.	.	S	Bend	trans	-61.3	-29	174.5	-54.2	-179.1	0	0	0	112.6	F762 E765 S766	F762-L851 HydrophobicContact CZ-CD2 4.24Å; E765-L851 PolarHBondContact N-O 3.48Å; S766-L851 PolarHBondContact N-O 3Å; S766-L851 PolarHBondContact OG-O 2.87Å
852	L	88.6	Confident	84	Confident	51 Å²	51	58.9 Å²	58.9	27%	0.267	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	110.8	168.6	178.9	62.2	0	0	0	110.8	S766 I793 K850 E854	S766-L852 VanDerWaalsContact OG-CA 3.32Å; S766-L852 WeakPolarHBondContact OG-CA 3.32Å; I793-L852 HydrophobicContact CD1-CD2 4.47Å; I793-L852 HydrophobicContact CG2-CD1 4Å; K850-L852 PolarHBondContact O-N 2.73Å; L852-E854 HydrophobicContact CG-CG 4.44Å
853	G	87.5	Confident	84.5	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	129.4	169.2	0	0	0	0	0	112	G742 S766 A767 Q768	G742-G853 CarbonylContact O-C 3.39Å; G742-G853 VanDerWaalsContact O-CA 3.3Å; G742-G853 WeakPolarHBondContact O-CA 3.34Å; S766-G853 PolarHBondContact O-N 2.8Å; A767-G853 WeakPolarHBondContact CA-O 3.15Å; Q768-G853 PolarHBondContact N-O 3.45Å
854	E	88.9	Confident	84.8	Confident	82 Å²	82	52.2 Å²	52.2	38%	0.383	27%	0.267	S	S	.	.			trans	-117.3	143.2	176.2	-56.8	-170.3	177.2	0	0	112.1	G742 L852 V856 R859	G742-E854 WeakPolarHBondContact CA-O 3.45Å; L852-E854 HydrophobicContact CG-CG 4.44Å; E854-V856 PolarHBondContact O-N 3.48Å; E854-R859 IonicContact OE2-CZ 2.68Å; E854-R859 IonicContact OE2-NH1 3.49Å; E854-R859 PolarHBondContact OE2-NH1 3.23Å; E854-R859 IonicContact OE2-NH2 3.11Å; E854-R859 PolarHBondContact OE2-NH2 3.35Å
855	P	90.2	Very high	85.2	Confident	3 Å²	3	49 Å²	49	2%	0.019	25%	0.254	C	S	.	.			trans	-57.6	132.6	177.3	-27.1	34.9	0	0	0	113.8	R859 L865	P855-R859 VanDerWaalsContact O-CZ 3.27Å; P855-R859 PolarHBondContact O-NE 2.83Å; P855-R859 PolarHBondContact O-NH2 3.19Å; P855-L865 HydrophobicContact CB-CD2 3.8Å; P855-L865 HydrophobicContact CG-CD2 3.79Å
856	V	87.1	Confident	85.6	Confident	24 Å²	24	46.8 Å²	46.8	15%	0.145	24%	0.242	C	C	.	.			trans	-72.9	135.2	178.3	-179.8	0	0	0	0	110.1	S739 Y740 L841 P842 E854	S739-V856 WeakPolarHBondContact O-CG2 3.24Å; Y740-V856 HydrophobicContact CD1-CB 3.76Å; Y740-V856 HydrophobicContact CD1-CG1 4.1Å; Y740-V856 HydrophobicContact CE1-CB 4.07Å; Y740-V856 HydrophobicContact CE1-CG1 3.85Å; Y740-V856 PolarHBondContact O-N 2.74Å; L841-V856 HydrophobicContact CD2-CG2 4.14Å; P842-V856 HydrophobicContact CG-CG2 4.06Å; E854-V856 PolarHBondContact O-N 3.48Å
857	G	77.4	Confident	85.9	Confident	34 Å²	34	45.4 Å²	45.4	35%	0.351	24%	0.237	S	C	.	.	S	Bend	trans	-68.8	177.3	-168.8	0	0	0	0	0	116.4	N866	G857-N866 PolarHBondContact O-ND2 3.37Å
858	P	80.9	Confident	86.3	Confident	68 Å²	68	41.5 Å²	41.5	44%	0.442	21%	0.212	S	C	.	.			cis	-75.4	137.6	-6.5	30.5	-34.3	0	0	0	111.7	I860 N866 P867	P858-I860 HydrophobicContact CB-CD1 4.33Å; P858-I860 HydrophobicContact CB-CG1 4.23Å; P858-I860 HydrophobicContact CG-CD1 4.24Å; P858-I860 HydrophobicContact CG-CG1 4.24Å; P858-I860 PolarHBondContact O-N 2.88Å; P858-N866 WeakPolarHBondContact O-CA 3.01Å; P858-P867 WeakPolarHBondContact O-CD 3.18Å
859	R	88.7	Confident	86.7	Confident	78 Å²	78	36 Å²	36	29%	0.294	19%	0.187	S	C	.	.			trans	-80	37.2	-170.6	-63.5	-171.4	-179.4	162.7	7.5	114.7	E854 P855 G864	E854-R859 IonicContact OE2-CZ 2.68Å; E854-R859 IonicContact OE2-NH1 3.49Å; E854-R859 PolarHBondContact OE2-NH1 3.23Å; E854-R859 IonicContact OE2-NH2 3.11Å; E854-R859 PolarHBondContact OE2-NH2 3.35Å; P855-R859 VanDerWaalsContact O-CZ 3.27Å; P855-R859 PolarHBondContact O-NE 2.83Å; P855-R859 PolarHBondContact O-NH2 3.19Å; R859-G864 VanDerWaalsContact CA-O 3.23Å; R859-G864 WeakPolarHBondContact CA-O 3.41Å; R859-G864 VanDerWaalsContact CB-O 3.23Å; R859-G864 WeakPolarHBondContact CB-O 3.18Å; R859-G864 WeakPolarHBondContact CG-O 3.32Å
860	I	89.7	Confident	87	Confident	55 Å²	55	36.3 Å²	36.3	28%	0.282	19%	0.187	S	C	.	.			trans	-103.9	5	-169.6	64.1	178	0	0	0	114.1	T781 I782 I786 P858 P867	T781-I860 CarbonylContact C-O 3.51Å; T781-I860 WeakPolarHBondContact CA-O 3.44Å; T781-I860 HydrophobicContact CG2-CD1 3.85Å; T781-I860 HydrophobicContact CG2-CG1 4.17Å; I782-I860 PolarHBondContact N-O 3.02Å; I786-I860 HydrophobicContact CD1-CG2 3.78Å; P858-I860 HydrophobicContact CB-CD1 4.33Å; P858-I860 HydrophobicContact CB-CG1 4.23Å; P858-I860 HydrophobicContact CG-CD1 4.24Å; P858-I860 HydrophobicContact CG-CG1 4.24Å; P858-I860 PolarHBondContact O-N 2.88Å; I860-P867 HydrophobicContact CD1-CG 4.23Å; I860-P867 HydrophobicContact CG1-CG 3.81Å
861	G	88.9	Confident	87.4	Confident	2 Å²	2	29 Å²	29	2%	0.021	16%	0.155	C	C	.	.	S	Bend	trans	-96.9	178.7	174.5	0	0	0	0	0	113.2	A863 G864 L865	G861-A863 PolarHBondContact O-N 3.09Å; G861-G864 PolarHBondContact O-N 3Å; G861-L865 WeakPolarHBondContact CA-O 3.42Å; G861-L865 PolarHBondContact N-O 2.91Å
862	A	91.2	Very high	87.6	Confident	3 Å²	3	25.5 Å²	25.5	3%	0.025	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-55.8	138.3	175.8	0	0	0	0	0	111.8	V813 T816 L818 G864 L865 A871 H872	V813-A862 HydrophobicContact CG2-CB 4.29Å; T816-A862 HydrophobicContact CG2-CB 3.91Å; L818-A862 HydrophobicContact CD1-CB 3.91Å; A862-G864 VanDerWaalsContact C-N 3.26Å; A862-G864 PolarHBondContact O-N 3.37Å; A862-L865 WeakPolarHBondContact O-CB 3.12Å; A862-L865 WeakPolarHBondContact O-CG 3.48Å; A862-L865 PolarHBondContact O-N 3.44Å; A862-A871 HydrophobicContact CB-CB 4.43Å; A862-H872 HydrophobicContact CB-CB 4.28Å
863	A	93.1	Very high	87.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	60.4	22.8	-171.3	0	0	0	0	0	115.9	M770 T772 L809 I812 V813 G861 L865	M770-A863 CarbonylContact O-C 3.52Å; M770-A863 VanDerWaalsContact O-CA 3.25Å; M770-A863 WeakPolarHBondContact O-CA 3.16Å; T772-A863 PolarHBondContact OG1-N 3Å; L809-A863 HydrophobicContact CD1-CB 3.46Å; L809-A863 VanDerWaalsContact CD1-CB 3.46Å; I812-A863 HydrophobicContact CB-CB 4.46Å; I812-A863 HydrophobicContact CG2-CB 3.84Å; V813-A863 HydrophobicContact CG2-CB 3.69Å; G861-A863 PolarHBondContact O-N 3.09Å; A863-L865 HydrophobicContact CB-CD1 4.49Å; A863-L865 HydrophobicContact CB-CG 4.27Å; A863-L865 PolarHBondContact O-N 2.81Å
864	G	90.2	Very high	86.9	Confident	3 Å²	3	29.3 Å²	29.3	3%	0.031	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	73.5	10.7	-175.6	0	0	0	0	0	113.8	R859 G861 A862	R859-G864 VanDerWaalsContact CA-O 3.23Å; R859-G864 WeakPolarHBondContact CA-O 3.41Å; R859-G864 VanDerWaalsContact CB-O 3.23Å; R859-G864 WeakPolarHBondContact CB-O 3.18Å; R859-G864 WeakPolarHBondContact CG-O 3.32Å; G861-G864 PolarHBondContact O-N 3Å; A862-G864 VanDerWaalsContact C-N 3.26Å; A862-G864 PolarHBondContact O-N 3.37Å
865	L	91.7	Very high	86.3	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.16	C	C	.	.			trans	-83.8	159.4	-177.9	-56.8	-179.7	0	0	0	112.1	L741 L809 P855 G861 A862 A863 A871	L741-L865 HydrophobicContact CD2-CD1 3.55Å; L741-L865 HydrophobicContact CD2-CD2 3.69Å; L741-L865 HydrophobicContact CD2-CG 4.19Å; L809-L865 HydrophobicContact CD1-CD1 3.91Å; P855-L865 HydrophobicContact CB-CD2 3.8Å; P855-L865 HydrophobicContact CG-CD2 3.79Å; G861-L865 WeakPolarHBondContact CA-O 3.42Å; G861-L865 PolarHBondContact N-O 2.91Å; A862-L865 WeakPolarHBondContact O-CB 3.12Å; A862-L865 WeakPolarHBondContact O-CG 3.48Å; A862-L865 PolarHBondContact O-N 3.44Å; A863-L865 HydrophobicContact CB-CD1 4.49Å; A863-L865 HydrophobicContact CB-CG 4.27Å; A863-L865 PolarHBondContact O-N 2.81Å; L865-A871 HydrophobicContact CD1-CB 4.08Å
866	N	88.5	Confident	86	Confident	8 Å²	8	31.2 Å²	31.2	4%	0.043	17%	0.167	C	C	.	.			trans	-54.3	125.7	172.5	-179.1	-54	0	0	0	111.7	Y740 G857 P858 Y868 M869	Y740-N866 HydrophobicContact CD1-CB 4.26Å; G857-N866 PolarHBondContact O-ND2 3.37Å; P858-N866 WeakPolarHBondContact O-CA 3.01Å; N866-Y868 VanDerWaalsContact C-N 3.27Å; N866-Y868 PolarHBondContact O-N 3.08Å; N866-Y868 WeakPolarHBondContact OD1-CB 3.43Å; N866-Y868 WeakPolarHBondContact OD1-CD2 3.46Å; N866-Y868 PolarHBondContact OD1-N 3.41Å; N866-M869 HydrophobicContact CB-CG 4.23Å; N866-M869 VanDerWaalsContact O-CB 3.22Å; N866-M869 WeakPolarHBondContact O-CB 3.42Å; N866-M869 PolarHBondContact O-N 2.83Å
867	P	86.8	Confident	86	Confident	8 Å²	8	30.5 Å²	30.5	5%	0.052	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-62.2	-30.3	-172.3	25.5	-36.4	0	0	0	113.4	M780 P858 I860 M869 F870	M780-P867 HydrophobicContact CG-CB 4.16Å; M780-P867 HydrophobicContact SD-CB 4.24Å; P858-P867 WeakPolarHBondContact O-CD 3.18Å; I860-P867 HydrophobicContact CD1-CG 4.23Å; I860-P867 HydrophobicContact CG1-CG 3.81Å; P867-M869 PolarHBondContact O-N 3.21Å; P867-M869 VanDerWaalsContact O-N 3.14Å; P867-F870 PolarHBondContact O-N 2.95Å
868	Y	84.4	Confident	85.9	Confident	58 Å²	58	29.8 Å²	29.8	23%	0.227	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-68.9	-8.7	177.1	-57.9	-62.7	0	0	0	113.6	R831 P832 N866 F870	R831-Y868 HydrophobicContact CB-CD1 4.34Å; R831-Y868 HydrophobicContact CG-CD1 4.08Å; P832-Y868 HydrophobicContact CG-CD2 4.03Å; P832-Y868 HydrophobicContact CG-CE2 3.92Å; P832-Y868 HydrophobicContact CG-CG 4.42Å; N866-Y868 VanDerWaalsContact C-N 3.27Å; N866-Y868 PolarHBondContact O-N 3.08Å; N866-Y868 WeakPolarHBondContact OD1-CB 3.43Å; N866-Y868 WeakPolarHBondContact OD1-CD2 3.46Å; N866-Y868 PolarHBondContact OD1-N 3.41Å; Y868-F870 VanDerWaalsContact C-N 3.27Å; Y868-F870 VanDerWaalsContact O-CD2 3.27Å; Y868-F870 WeakPolarHBondContact O-CD2 3.48Å
869	M	84.6	Confident	85.7	Confident	7 Å²	7	26.5 Å²	26.5	3%	0.034	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-71.4	-21.7	167.7	-68	-72.6	-93.6	0	0	112.7	K602 F603 M606 K737 L741 N866 P867 A871	K602-M869 VanDerWaalsContact NZ-CA 3.29Å; K602-M869 PolarHBondContact NZ-O 3.41Å; K602-M869 PolarHBondContact NZ-SD 2.66Å; F603-M869 HydrophobicContact CZ-CB 4.49Å; M606-M869 HydrophobicContact CE-CE 4.37Å; M606-M869 HydrophobicContact SD-CE 4.33Å; K737-M869 HydrophobicContact CB-CE 4.24Å; K737-M869 WeakPolarHBondContact O-CE 3.27Å; L741-M869 HydrophobicContact CD2-CE 3.88Å; L741-M869 HydrophobicContact CG-CE 4.16Å; N866-M869 HydrophobicContact CB-CG 4.23Å; N866-M869 VanDerWaalsContact O-CB 3.22Å; N866-M869 WeakPolarHBondContact O-CB 3.42Å; N866-M869 PolarHBondContact O-N 2.83Å; P867-M869 PolarHBondContact O-N 3.21Å; P867-M869 VanDerWaalsContact O-N 3.14Å; M869-A871 VanDerWaalsContact C-N 3.35Å; M869-A871 PolarHBondContact O-N 2.9Å
870	F	86.1	Confident	84.8	Confident	27 Å²	27	23.6 Å²	23.6	12%	0.118	12%	0.12	C	C	.	.			trans	51.9	45.3	-177.4	-67.4	-78.6	0	0	0	113.8	M780 P867 Y868 H872 R873 N876	M780-F870 HydrophobicContact CB-CE1 4.33Å; M780-F870 HydrophobicContact SD-CE1 4Å; M780-F870 HydrophobicContact SD-CZ 4.06Å; P867-F870 PolarHBondContact O-N 2.95Å; Y868-F870 VanDerWaalsContact C-N 3.27Å; Y868-F870 VanDerWaalsContact O-CD2 3.27Å; Y868-F870 WeakPolarHBondContact O-CD2 3.48Å; F870-H872 VanDerWaalsContact C-N 3.32Å; F870-H872 AromaticContact CD1-CE1 3.86Å; F870-H872 PolarHBondContact O-N 3.49Å; F870-R873 HydrophobicContact CB-CG 4.14Å; F870-R873 PolarHBondContact O-N 3.4Å; F870-N876 PolarHBondContact O-ND2 3.22Å
871	A	89.2	Confident	83.8	Confident	4 Å²	4	22.8 Å²	22.8	3%	0.033	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-49.1	-178.6	0	0	0	0	0	112.4	F603 V813 A862 L865 M869 R873 W877	F603-A871 HydrophobicContact CE2-CB 4.33Å; F603-A871 HydrophobicContact CZ-CB 3.94Å; V813-A871 HydrophobicContact CG1-CB 3.71Å; V813-A871 WeakPolarHBondContact CG1-O 3.34Å; V813-A871 HydrophobicContact CG2-CB 4.01Å; A862-A871 HydrophobicContact CB-CB 4.43Å; L865-A871 HydrophobicContact CD1-CB 4.08Å; M869-A871 VanDerWaalsContact C-N 3.35Å; M869-A871 PolarHBondContact O-N 2.9Å; A871-R873 PolarHBondContact O-N 3.04Å; A871-W877 PolarHBondContact O-NE1 3.02Å
872	H	86.1	Confident	82.7	Confident	19 Å²	19	29 Å²	29	9%	0.088	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-8.4	-178.1	64.8	-107.2	0	0	0	116.2	Y779 L818 A862 F870 I874	Y779-H872 PolarHBondContact O-CE1 3.36Å; L818-H872 HydrophobicContact CB-CB 3.75Å; L818-H872 HydrophobicContact CD1-CB 4.43Å; A862-H872 HydrophobicContact CB-CB 4.28Å; F870-H872 VanDerWaalsContact C-N 3.32Å; F870-H872 AromaticContact CD1-CE1 3.86Å; F870-H872 PolarHBondContact O-N 3.49Å; H872-I874 PolarHBondContact O-N 2.81Å
873	R	83.3	Confident	81.6	Confident	88 Å²	88	30.8 Å²	30.8	33%	0.332	15%	0.15	S	C	.	.			trans	-87.5	112.5	-175.1	-69.4	-162.6	169.4	-172.8	-2.1	111.7	Y779 F870 A871 P875 N876	Y779-R873 PolarHBondContact OH-NH2 3.35Å; F870-R873 HydrophobicContact CB-CG 4.14Å; F870-R873 PolarHBondContact O-N 3.4Å; A871-R873 PolarHBondContact O-N 3.04Å; R873-P875 VanDerWaalsContact C-N 3.3Å; R873-P875 VanDerWaalsContact O-N 3.08Å; R873-N876 VanDerWaalsContact O-CB 3.29Å; R873-N876 WeakPolarHBondContact O-CB 3.46Å; R873-N876 PolarHBondContact O-N 2.93Å
874	I	78.4	Confident	80.4	Confident	43 Å²	43	32.5 Å²	32.5	22%	0.221	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-40.2	-47.6	174.8	-54.2	167.6	0	0	0	113.6	L814 H872 N876 W877 V878 F920	L814-I874 HydrophobicContact CD2-CG1 4.45Å; H872-I874 PolarHBondContact O-N 2.81Å; I874-N876 PolarHBondContact O-N 3.4Å; I874-W877 PolarHBondContact O-N 3.11Å; I874-V878 HydrophobicContact CG2-CG2 4.4Å; I874-V878 PolarHBondContact O-N 3.33Å; I874-F920 HydrophobicContact CB-CD1 4.38Å; I874-F920 HydrophobicContact CD1-CD1 3.93Å; I874-F920 HydrophobicContact CD1-CE1 3.48Å; I874-F920 VanDerWaalsContact CD1-CE1 3.48Å; I874-F920 HydrophobicContact CG1-CD1 3.81Å; I874-F920 HydrophobicContact CG1-CE1 3.68Å; I874-F920 HydrophobicContact CG2-CD1 3.75Å; I874-F920 HydrophobicContact CG2-CE1 4.42Å
875	P	75.1	Confident	79.8	Confident	91 Å²	91	32.6 Å²	32.6	59%	0.591	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-63.5	-9.3	-179.7	-23.1	36.4	0	0	0	115.8	R873	R873-P875 VanDerWaalsContact C-N 3.3Å; R873-P875 VanDerWaalsContact O-N 3.08Å
876	N	85.3	Confident	79.1	Confident	34 Å²	34	32.8 Å²	32.8	18%	0.182	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-85.7	-15	172.1	-68.8	-21.3	0	0	0	112.6	G601 K602 F603 F870 R873 I874	G601-N876 CarbonylContact C-O 3.44Å; K602-N876 HydrophobicContact CB-CB 3.96Å; K602-N876 PolarHBondContact N-O 3.11Å; F603-N876 HydrophobicContact CD2-CB 3.65Å; F603-N876 HydrophobicContact CE2-CB 3.78Å; F603-N876 PolarHBondContact N-O 2.86Å; F870-N876 PolarHBondContact O-ND2 3.22Å; R873-N876 VanDerWaalsContact O-CB 3.29Å; R873-N876 WeakPolarHBondContact O-CB 3.46Å; R873-N876 PolarHBondContact O-N 2.93Å; I874-N876 PolarHBondContact O-N 3.4Å
877	W	85.6	Confident	78.5	Confident	9 Å²	9	36 Å²	36	3%	0.034	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-2.9	179.5	-64.8	95.7	0	0	0	113.9	F603 V604 W806 L809 R810 V813 A871 I874 V879	F603-W877 HydrophobicContact CB-CD2 3.92Å; F603-W877 HydrophobicContact CB-CE3 3.73Å; F603-W877 HydrophobicContact CB-CH2 3.77Å; F603-W877 HydrophobicContact CB-CZ2 3.95Å; F603-W877 HydrophobicContact CB-CZ3 3.66Å; F603-W877 HydrophobicContact CD1-CH2 4.28Å; F603-W877 HydrophobicContact CD1-CZ2 4.14Å; F603-W877 HydrophobicContact CD2-CD2 4.24Å; F603-W877 AromaticContact CD2-CE2 3.73Å; F603-W877 AromaticContact CD2-CZ2 3.95Å; F603-W877 HydrophobicContact CD2-CZ2 3.95Å; F603-W877 AromaticContact CD2-NE1 3.79Å; F603-W877 HydrophobicContact CG-CD2 4.3Å; F603-W877 AromaticContact CG-CE2 3.89Å; F603-W877 AromaticContact CG-CH2 3.97Å; F603-W877 HydrophobicContact CG-CH2 3.97Å; F603-W877 AromaticContact CG-CZ2 3.73Å; F603-W877 HydrophobicContact CG-CZ2 3.73Å; F603-W877 HydrophobicContact CG-CZ3 4.35Å; V604-W877 WeakPolarHBondContact CG2-O 3.2Å; W806-W877 HydrophobicContact CE3-CH2 4.24Å; W806-W877 HydrophobicContact CE3-CZ3 4.24Å; W806-W877 HydrophobicContact CZ3-CH2 4.27Å; W806-W877 HydrophobicContact CZ3-CZ3 4.49Å; L809-W877 HydrophobicContact CD2-CH2 4.07Å; L809-W877 HydrophobicContact CG-CH2 3.93Å; L809-W877 HydrophobicContact CG-CZ2 4.32Å; R810-W877 HydrophobicContact CB-CE3 4.09Å; R810-W877 HydrophobicContact CB-CH2 4.05Å; R810-W877 HydrophobicContact CB-CZ3 3.72Å; R810-W877 HydrophobicContact CG-CE3 4.08Å; R810-W877 HydrophobicContact CG-CZ3 4.24Å; V813-W877 HydrophobicContact CB-CZ2 4.2Å; V813-W877 HydrophobicContact CG1-CZ2 4Å; V813-W877 HydrophobicContact CG2-CZ2 4.45Å; A871-W877 PolarHBondContact O-NE1 3.02Å; I874-W877 PolarHBondContact O-N 3.11Å; W877-V879 PolarHBondContact O-N 2.92Å
878	V	76	Confident	78.2	Confident	19 Å²	19	37.9 Å²	37.9	12%	0.115	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-65	126	177.9	167.2	0	0	0	0	110.5	G601 I874 L923	G601-V878 WeakPolarHBondContact CA-O 3.23Å; G601-V878 PolarHBondContact N-O 3.43Å; I874-V878 HydrophobicContact CG2-CG2 4.4Å; I874-V878 PolarHBondContact O-N 3.33Å; V878-L923 HydrophobicContact CG1-CB 3.63Å; V878-L923 HydrophobicContact CG2-CB 4.13Å; V878-L923 HydrophobicContact CG2-CD1 3.58Å; V878-L923 HydrophobicContact CG2-CG 4.47Å
879	V	76.1	Confident	78.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-84.6	138	162	-158.4	0	0	0	0	109.2	V604 W877 L890 M893 M921	V604-V879 HydrophobicContact CG1-CG2 4.48Å; V604-V879 HydrophobicContact CG2-CG2 4.16Å; W877-V879 PolarHBondContact O-N 2.92Å; V879-L890 HydrophobicContact CB-CB 4.17Å; V879-L890 HydrophobicContact CB-CD1 4.23Å; V879-L890 HydrophobicContact CG1-CB 3.8Å; V879-L890 HydrophobicContact CG2-CD1 4.36Å; V879-M893 HydrophobicContact CG2-SD 4.24Å; V879-M921 CarbonylContact C-O 3.45Å; V879-M921 WeakPolarHBondContact CA-O 3.27Å; V879-M921 WeakPolarHBondContact CB-O 3.42Å; V879-M921 HydrophobicContact CG2-CE 3.9Å; V879-M921 HydrophobicContact CG2-SD 4.43Å; V879-M921 PolarHBondContact N-O 3.16Å
880	N	71.3	Confident	78.1	Confident	16 Å²	16	35.6 Å²	35.6	9%	0.086	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-90	170.7	174.5	-152.7	-36.8	0	0	0	110	S599 R882 E886 S924	S599-N880 VanDerWaalsContact C-ND2 3.32Å; S599-N880 VanDerWaalsContact CA-ND2 3.35Å; S599-N880 WeakPolarHBondContact CA-ND2 3.34Å; S599-N880 WeakPolarHBondContact CB-ND2 3.33Å; S599-N880 WeakPolarHBondContact O-CB 3.27Å; S599-N880 PolarHBondContact O-ND2 3.42Å; N880-R882 WeakPolarHBondContact OD1-CD 3.4Å; N880-R882 WeakPolarHBondContact OD1-CG 3.33Å; N880-E886 WeakPolarHBondContact CB-OE2 3.2Å; N880-E886 VanDerWaalsContact CG-OE2 3.31Å; N880-E886 PolarHBondContact OD1-OE2 3.18Å; N880-S924 WeakPolarHBondContact OD1-CB 3.37Å; N880-S924 PolarHBondContact OD1-OG 2.7Å
881	T	68.5	Low	77.9	Confident	38 Å²	38	38.9 Å²	38.9	23%	0.233	20%	0.197	C	C	.	.			trans	-154.5	54.3	-174.7	58.8	0	0	0	0	110	E886 L887 L890 S924	T881-E886 PolarHBondContact N-OE2 3.13Å; T881-E886 VanDerWaalsContact N-OE2 3.14Å; T881-L887 HydrophobicContact CG2-CD1 4.16Å; T881-L890 HydrophobicContact CG2-CD2 3.34Å; T881-S924 PolarHBondContact OG1-O 2.74Å
882	R	64.6	Low	77.7	Confident	133 Å²	133	42.6 Å²	42.6	50%	0.502	21%	0.214	S	C	.	.	S	Bend	trans	-87.8	-39.3	179	-74.5	153.3	155.5	-151.4	-19.2	113.1	E691 N880 E886	E691-R882 IonicContact OE1-NH2 3.47Å; N880-R882 WeakPolarHBondContact OD1-CD 3.4Å; N880-R882 WeakPolarHBondContact OD1-CG 3.33Å; R882-E886 WeakPolarHBondContact CB-OE2 3.5Å; R882-E886 PolarHBondContact N-OE2 3.37Å
883	N	67.8	Low	77.7	Confident	40 Å²	40	42 Å²	42	21%	0.214	21%	0.212	C	C	.	.	S	Bend	trans	-129	178.4	-178.4	63.8	12.7	0	0	0	110.1	C885 E886 L887	N883-C885 PolarHBondContact OD1-SG 3.41Å; N883-E886 PolarHBondContact O-N 2.9Å; N883-E886 VanDerWaalsContact OD1-CB 3.29Å; N883-E886 WeakPolarHBondContact OD1-CB 3.47Å; N883-E886 WeakPolarHBondContact OD1-CG 3.18Å; N883-E886 PolarHBondContact OD1-N 3.48Å; N883-L887 PolarHBondContact O-N 3.42Å
884	A	69.3	Low	77.6	Confident	36 Å²	36	40.7 Å²	40.7	30%	0.298	21%	0.208	S	C	.	.	H	α-helix	trans	-63.1	-46.5	-175.6	0	0	0	0	0	113	L700 E886 L887 E888	L700-A884 WeakPolarHBondContact O-CB 3.32Å; A884-E886 VanDerWaalsContact C-N 3.3Å; A884-E886 PolarHBondContact O-N 3.46Å; A884-L887 PolarHBondContact O-N 2.95Å; A884-L887 VanDerWaalsContact O-N 3.11Å; A884-E888 WeakPolarHBondContact O-CB 3.22Å; A884-E888 PolarHBondContact O-N 3.27Å
885	C	76.3	Confident	77.9	Confident	6 Å²	6	44.2 Å²	44.2	4%	0.041	23%	0.227	C	C	.	.	H	α-helix	trans	-65.1	-30.2	-178.3	66.1	0	0	0	0	113.7	Q685 N883 N889	Q685-C885 PolarHBondContact NE2-O 3.16Å; N883-C885 PolarHBondContact OD1-SG 3.41Å; C885-N889 WeakPolarHBondContact O-CB 3.34Å; C885-N889 PolarHBondContact O-N 3.22Å
886	E	77.7	Confident	78.5	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.019	21%	0.205	C	C	.	.	H	α-helix	trans	-69.9	-39.5	171.8	-75.4	-173.1	175.4	0	0	112.6	S599 Q685 N880 T881 R882 N883 A884 L890	S599-E886 WeakPolarHBondContact CB-OE1 3.16Å; S599-E886 PolarHBondContact OG-OE1 3.47Å; Q685-E886 HydrophobicContact CG-CG 4.05Å; N880-E886 WeakPolarHBondContact CB-OE2 3.2Å; N880-E886 VanDerWaalsContact CG-OE2 3.31Å; N880-E886 PolarHBondContact OD1-OE2 3.18Å; T881-E886 PolarHBondContact N-OE2 3.13Å; T881-E886 VanDerWaalsContact N-OE2 3.14Å; R882-E886 WeakPolarHBondContact CB-OE2 3.5Å; R882-E886 PolarHBondContact N-OE2 3.37Å; N883-E886 PolarHBondContact O-N 2.9Å; N883-E886 VanDerWaalsContact OD1-CB 3.29Å; N883-E886 WeakPolarHBondContact OD1-CB 3.47Å; N883-E886 WeakPolarHBondContact OD1-CG 3.18Å; N883-E886 PolarHBondContact OD1-N 3.48Å; A884-E886 VanDerWaalsContact C-N 3.3Å; A884-E886 PolarHBondContact O-N 3.46Å; E886-L890 PolarHBondContact O-N 3.37Å
887	L	75.1	Confident	78.5	Confident	76 Å²	76	40 Å²	40	40%	0.398	20%	0.198	S	C	.	.	H	α-helix	trans	-67.8	-42.8	177.1	177.7	61.6	0	0	0	111.7	T881 N883 A884 L890 E891	T881-L887 HydrophobicContact CG2-CD1 4.16Å; N883-L887 PolarHBondContact O-N 3.42Å; A884-L887 PolarHBondContact O-N 2.95Å; A884-L887 VanDerWaalsContact O-N 3.11Å; L887-L890 HydrophobicContact CD1-CD2 4.41Å; L887-L890 WeakPolarHBondContact O-CB 3.32Å; L887-L890 PolarHBondContact O-N 2.99Å; L887-E891 PolarHBondContact O-N 3.35Å; L887-E891 VanDerWaalsContact O-N 3.09Å
888	E	81.1	Confident	78.3	Confident	48 Å²	48	44.6 Å²	44.6	22%	0.224	22%	0.223	C	C	.	.	H	α-helix	trans	-67.8	-41.6	-179.4	-171.7	171.6	131	0	0	112.3	R706 A884 L890 E891 Q892	R706-E888 IonicContact CZ-OE1 3.52Å; R706-E888 IonicContact CZ-OE2 2.63Å; R706-E888 IonicContact NH1-OE2 2.7Å; R706-E888 PolarHBondContact NH1-OE2 3.23Å; R706-E888 VanDerWaalsContact NH2-CD 3.28Å; R706-E888 IonicContact NH2-OE1 3.41Å; R706-E888 PolarHBondContact NH2-OE1 2.96Å; R706-E888 IonicContact NH2-OE2 2.7Å; R706-E888 PolarHBondContact NH2-OE2 3.41Å; A884-E888 WeakPolarHBondContact O-CB 3.22Å; A884-E888 PolarHBondContact O-N 3.27Å; E888-L890 VanDerWaalsContact C-N 3.29Å; E888-L890 PolarHBondContact O-N 2.9Å; E888-E891 CarbonylContact O-C 3.59Å; E888-E891 WeakPolarHBondContact O-CA 3.26Å; E888-E891 PolarHBondContact O-N 3.09Å; E888-Q892 HydrophobicContact CG-CG 4.42Å; E888-Q892 WeakPolarHBondContact O-CG 3.44Å; E888-Q892 PolarHBondContact O-N 3.31Å; E888-Q892 PolarHBondContact OE1-NE2 3.14Å
889	N	83.5	Confident	78.9	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.064	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-41.7	171.8	179.5	17.6	0	0	0	111.5	Q685 C885 E891 M893	Q685-N889 PolarHBondContact OE1-ND2 2.74Å; C885-N889 WeakPolarHBondContact O-CB 3.34Å; C885-N889 PolarHBondContact O-N 3.22Å; N889-E891 PolarHBondContact O-N 2.91Å; N889-M893 VanDerWaalsContact O-CB 3.28Å; N889-M893 WeakPolarHBondContact O-CB 3.41Å; N889-M893 VanDerWaalsContact O-CG 3.29Å; N889-M893 WeakPolarHBondContact O-CG 3.2Å; N889-M893 PolarHBondContact O-N 2.77Å; N889-M893 WeakPolarHBondContact OD1-CE 3.22Å
890	L	83.6	Confident	79.4	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-31	171.8	165.7	67.1	0	0	0	112	V879 T881 E886 L887 E888 K894 M921 A922	V879-L890 HydrophobicContact CB-CB 4.17Å; V879-L890 HydrophobicContact CB-CD1 4.23Å; V879-L890 HydrophobicContact CG1-CB 3.8Å; V879-L890 HydrophobicContact CG2-CD1 4.36Å; T881-L890 HydrophobicContact CG2-CD2 3.34Å; E886-L890 PolarHBondContact O-N 3.37Å; L887-L890 HydrophobicContact CD1-CD2 4.41Å; L887-L890 WeakPolarHBondContact O-CB 3.32Å; L887-L890 PolarHBondContact O-N 2.99Å; E888-L890 VanDerWaalsContact C-N 3.29Å; E888-L890 PolarHBondContact O-N 2.9Å; L890-K894 HydrophobicContact CD1-CG 4.5Å; L890-K894 WeakPolarHBondContact O-CG 3.17Å; L890-K894 PolarHBondContact O-N 2.79Å; L890-K894 VanDerWaalsContact O-N 3.15Å; L890-M921 HydrophobicContact CD1-CB 3.52Å; L890-M921 HydrophobicContact CD1-CE 4.34Å; L890-A922 HydrophobicContact CD1-CB 4.36Å; L890-A922 HydrophobicContact CD2-CB 3.73Å
891	E	81.6	Confident	80	Confident	95 Å²	95	50.4 Å²	50.4	44%	0.444	26%	0.257	S	S	.	.	H	α-helix	trans	-83.1	-45.5	-178.7	-77.8	169.1	179.7	0	0	113.2	L887 E888 N889 M893 K894 L895	L887-E891 PolarHBondContact O-N 3.35Å; L887-E891 VanDerWaalsContact O-N 3.09Å; E888-E891 CarbonylContact O-C 3.59Å; E888-E891 WeakPolarHBondContact O-CA 3.26Å; E888-E891 PolarHBondContact O-N 3.09Å; N889-E891 PolarHBondContact O-N 2.91Å; E891-M893 VanDerWaalsContact C-N 3.3Å; E891-M893 PolarHBondContact O-N 2.86Å; E891-K894 HydrophobicContact CG-CD 4.23Å; E891-K894 WeakPolarHBondContact O-CB 3.31Å; E891-K894 PolarHBondContact O-N 3.27Å; E891-K894 VanDerWaalsContact O-N 3.08Å; E891-K894 IonicContact OE1-NZ 2.7Å; E891-K894 PolarHBondContact OE1-NZ 3.2Å; E891-L895 WeakPolarHBondContact O-CB 3.3Å; E891-L895 PolarHBondContact O-N 2.85Å
892	Q	85.6	Confident	80.9	Confident	82 Å²	82	54.2 Å²	54.2	38%	0.383	27%	0.273	S	S	.	.	H	α-helix	trans	-54.7	-46	168.4	-66.1	175.5	2	0	0	110.8	E888 K894 L895 F896	E888-Q892 HydrophobicContact CG-CG 4.42Å; E888-Q892 WeakPolarHBondContact O-CG 3.44Å; E888-Q892 PolarHBondContact O-N 3.31Å; E888-Q892 PolarHBondContact OE1-NE2 3.14Å; Q892-K894 PolarHBondContact O-N 2.86Å; Q892-L895 PolarHBondContact O-N 3.4Å; Q892-F896 WeakPolarHBondContact O-CB 3.49Å; Q892-F896 PolarHBondContact O-N 3.44Å
893	M	86.6	Confident	81.9	Confident	8 Å²	8	48.9 Å²	48.9	4%	0.039	26%	0.255	C	S	.	.	H	α-helix	trans	-67.2	-27.9	176.2	-73.6	-159	-173.4	0	0	114.5	V604 Q607 V879 N889 E891 A897 M921	V604-M893 HydrophobicContact CG1-CE 4.07Å; Q607-M893 VanDerWaalsContact CD-CE 3.45Å; Q607-M893 HydrophobicContact CG-CE 4.2Å; Q607-M893 VanDerWaalsContact OE1-CE 3.31Å; V879-M893 HydrophobicContact CG2-SD 4.24Å; N889-M893 VanDerWaalsContact O-CB 3.28Å; N889-M893 WeakPolarHBondContact O-CB 3.41Å; N889-M893 VanDerWaalsContact O-CG 3.29Å; N889-M893 WeakPolarHBondContact O-CG 3.2Å; N889-M893 PolarHBondContact O-N 2.77Å; N889-M893 WeakPolarHBondContact OD1-CE 3.22Å; E891-M893 VanDerWaalsContact C-N 3.3Å; E891-M893 PolarHBondContact O-N 2.86Å; M893-A897 WeakPolarHBondContact O-CB 3.45Å; M893-A897 PolarHBondContact O-N 3.01Å; M893-M921 HydrophobicContact CB-CE 3.54Å; M893-M921 HydrophobicContact CG-CE 4.41Å; M893-M921 HydrophobicContact SD-CE 4.01Å
894	K	81.6	Confident	82.8	Confident	60 Å²	60	47 Å²	47	26%	0.261	25%	0.245	S	C	.	.	H	α-helix	trans	-70.1	-52.3	171.2	-74.7	161.9	-161.6	152	0	109.7	L890 E891 Q892 A897 I898	L890-K894 HydrophobicContact CD1-CG 4.5Å; L890-K894 WeakPolarHBondContact O-CG 3.17Å; L890-K894 PolarHBondContact O-N 2.79Å; L890-K894 VanDerWaalsContact O-N 3.15Å; E891-K894 HydrophobicContact CG-CD 4.23Å; E891-K894 WeakPolarHBondContact O-CB 3.31Å; E891-K894 PolarHBondContact O-N 3.27Å; E891-K894 VanDerWaalsContact O-N 3.08Å; E891-K894 IonicContact OE1-NZ 2.7Å; E891-K894 PolarHBondContact OE1-NZ 3.2Å; Q892-K894 PolarHBondContact O-N 2.86Å; K894-A897 CarbonylContact O-C 3.53Å; K894-A897 PolarHBondContact O-N 3.12Å; K894-A897 VanDerWaalsContact O-N 3.14Å; K894-I898 WeakPolarHBondContact O-CG1 3.38Å; K894-I898 PolarHBondContact O-N 2.92Å
895	L	83.2	Confident	83.4	Confident	116 Å²	116	47.7 Å²	47.7	61%	0.607	25%	0.25	S	S	*	.	H	α-helix	trans	-59.4	-52.1	-174.3	-175.8	63.2	0	0	0	110.1	E891 Q892 A897 I898 T899	E891-L895 WeakPolarHBondContact O-CB 3.3Å; E891-L895 PolarHBondContact O-N 2.85Å; Q892-L895 PolarHBondContact O-N 3.4Å; L895-A897 PolarHBondContact O-N 3.26Å; L895-I898 WeakPolarHBondContact O-CB 3.45Å; L895-I898 PolarHBondContact O-N 3.26Å; L895-T899 PolarHBondContact O-N 3.13Å; L895-T899 PolarHBondContact O-OG1 3.21Å; L895-T899 VanDerWaalsContact O-OG1 3.13Å
896	F	88.6	Confident	83.8	Confident	31 Å²	31	54.9 Å²	54.9	14%	0.136	28%	0.278	C	S	.	.	H	α-helix	trans	-57.2	-37.8	176.5	-165.8	-82.3	0	0	0	112.8	R803 I804 L807 Q892 H900	R803-F896 HydrophobicContact CB-CD1 4.13Å; R803-F896 HydrophobicContact CB-CD2 4.41Å; R803-F896 HydrophobicContact CB-CE1 3.49Å; R803-F896 VanDerWaalsContact CB-CE1 3.49Å; R803-F896 HydrophobicContact CB-CE2 3.79Å; R803-F896 HydrophobicContact CB-CZ 3.29Å; R803-F896 HydrophobicContact CG-CE2 4.39Å; R803-F896 HydrophobicContact CG-CZ 4.34Å; I804-F896 HydrophobicContact CG1-CE1 4.09Å; I804-F896 HydrophobicContact CG1-CZ 4.01Å; L807-F896 HydrophobicContact CD2-CD1 4.36Å; L807-F896 HydrophobicContact CD2-CE1 4.4Å; Q892-F896 WeakPolarHBondContact O-CB 3.49Å; Q892-F896 PolarHBondContact O-N 3.44Å; F896-H900 AromaticContact CD1-ND1 3.52Å; F896-H900 AromaticContact CD2-CE1 3.65Å; F896-H900 AromaticContact CD2-ND1 3.63Å; F896-H900 HydrophobicContact CE1-CB 4.2Å; F896-H900 AromaticContact CE1-CE1 3.96Å; F896-H900 AromaticContact CE1-CG 3.81Å; F896-H900 AromaticContact CE1-ND1 3.34Å; F896-H900 VanDerWaalsContact CE1-ND1 3.34Å; F896-H900 WeakPolarHBondContact CE1-ND1 3.39Å; F896-H900 AromaticContact CE2-CE1 3.27Å; F896-H900 WeakPolarHBondContact CE2-CE1 3.39Å; F896-H900 AromaticContact CE2-ND1 3.47Å; F896-H900 WeakPolarHBondContact CE2-ND1 3.44Å; F896-H900 AromaticContact CG-ND1 3.65Å; F896-H900 AromaticContact CZ-CE1 3.43Å; F896-H900 VanDerWaalsContact CZ-CE1 3.43Å; F896-H900 WeakPolarHBondContact CZ-CE1 3.45Å; F896-H900 AromaticContact CZ-CG 3.92Å; F896-H900 AromaticContact CZ-ND1 3.31Å; F896-H900 VanDerWaalsContact CZ-ND1 3.31Å; F896-H900 WeakPolarHBondContact CZ-ND1 3.24Å; F896-H900 WeakPolarHBondContact O-CB 3.26Å; F896-H900 PolarHBondContact O-N 2.91Å; F896-H900 PolarHBondContact O-ND1 3.17Å; F896-H900 VanDerWaalsContact O-ND1 3.07Å
897	A	84.7	Confident	84.3	Confident	5 Å²	5	58.9 Å²	58.9	4%	0.041	29%	0.292	C	S	.	.	H	α-helix	trans	-75	-20.9	178.2	0	0	0	0	0	114.2	L807 M893 K894 L895 S901 Q916	L807-A897 HydrophobicContact CD1-CB 3.45Å; L807-A897 VanDerWaalsContact CD1-CB 3.45Å; M893-A897 WeakPolarHBondContact O-CB 3.45Å; M893-A897 PolarHBondContact O-N 3.01Å; K894-A897 CarbonylContact O-C 3.53Å; K894-A897 PolarHBondContact O-N 3.12Å; K894-A897 VanDerWaalsContact O-N 3.14Å; L895-A897 PolarHBondContact O-N 3.26Å; A897-S901 WeakPolarHBondContact O-CB 3.35Å; A897-S901 PolarHBondContact O-N 2.85Å; A897-Q916 HydrophobicContact CB-CG 4.43Å; A897-Q916 PolarHBondContact O-NE2 2.92Å
898	I	82.7	Confident	84.9	Confident	107 Å²	107	55.5 Å²	55.5	55%	0.549	28%	0.275	S	S	.	.	H	α-helix	trans	-80.8	-51.7	171.2	-70.8	158.7	0	0	0	109.3	K894 L895 H900 S901	K894-I898 WeakPolarHBondContact O-CG1 3.38Å; K894-I898 PolarHBondContact O-N 2.92Å; L895-I898 WeakPolarHBondContact O-CB 3.45Å; L895-I898 PolarHBondContact O-N 3.26Å; I898-H900 PolarHBondContact O-N 2.92Å; I898-S901 WeakPolarHBondContact O-CB 3.32Å; I898-S901 PolarHBondContact O-N 2.62Å; I898-S901 PolarHBondContact O-OG 2.91Å
899	T	86.9	Confident	85.3	Confident	75 Å²	75	57 Å²	57	46%	0.46	30%	0.296	S	S	.	.	H	α-helix	trans	-56.3	-55.2	179.1	-52	0	0	0	0	111.3	L895 S901 H902	L895-T899 PolarHBondContact O-N 3.13Å; L895-T899 PolarHBondContact O-OG1 3.21Å; L895-T899 VanDerWaalsContact O-OG1 3.13Å; T899-S901 PolarHBondContact O-N 3.31Å; T899-H902 PolarHBondContact O-CE1 2.64Å; T899-H902 PolarHBondContact O-ND1 3.06Å
900	H	88.1	Confident	85.4	Confident	42 Å²	42	62 Å²	62	19%	0.194	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	18.8	-178.5	-53.4	92	0	0	0	113.3	L807 F896 I898 H902 V903	L807-H900 HydrophobicContact CD2-CB 3.72Å; F896-H900 AromaticContact CD1-ND1 3.52Å; F896-H900 AromaticContact CD2-CE1 3.65Å; F896-H900 AromaticContact CD2-ND1 3.63Å; F896-H900 HydrophobicContact CE1-CB 4.2Å; F896-H900 AromaticContact CE1-CE1 3.96Å; F896-H900 AromaticContact CE1-CG 3.81Å; F896-H900 AromaticContact CE1-ND1 3.34Å; F896-H900 VanDerWaalsContact CE1-ND1 3.34Å; F896-H900 WeakPolarHBondContact CE1-ND1 3.39Å; F896-H900 AromaticContact CE2-CE1 3.27Å; F896-H900 WeakPolarHBondContact CE2-CE1 3.39Å; F896-H900 AromaticContact CE2-ND1 3.47Å; F896-H900 WeakPolarHBondContact CE2-ND1 3.44Å; F896-H900 AromaticContact CG-ND1 3.65Å; F896-H900 AromaticContact CZ-CE1 3.43Å; F896-H900 VanDerWaalsContact CZ-CE1 3.43Å; F896-H900 WeakPolarHBondContact CZ-CE1 3.45Å; F896-H900 AromaticContact CZ-CG 3.92Å; F896-H900 AromaticContact CZ-ND1 3.31Å; F896-H900 VanDerWaalsContact CZ-ND1 3.31Å; F896-H900 WeakPolarHBondContact CZ-ND1 3.24Å; F896-H900 WeakPolarHBondContact O-CB 3.26Å; F896-H900 PolarHBondContact O-N 2.91Å; F896-H900 PolarHBondContact O-ND1 3.17Å; F896-H900 VanDerWaalsContact O-ND1 3.07Å; I898-H900 PolarHBondContact O-N 2.92Å; H900-H902 VanDerWaalsContact C-N 3.34Å; H900-H902 PolarHBondContact O-N 3.41Å; H900-V903 HydrophobicContact CB-CG2 4.21Å; H900-V903 PolarHBondContact O-N 2.87Å
901	S	83.9	Confident	85.5	Confident	39 Å²	39	64.1 Å²	64.1	27%	0.273	32%	0.324	S	S	.	.	H	α-helix	trans	-57.6	-46.9	177.7	58.6	0	0	0	0	112.2	A897 I898 T899 I904 A905	A897-S901 WeakPolarHBondContact O-CB 3.35Å; A897-S901 PolarHBondContact O-N 2.85Å; I898-S901 WeakPolarHBondContact O-CB 3.32Å; I898-S901 PolarHBondContact O-N 2.62Å; I898-S901 PolarHBondContact O-OG 2.91Å; T899-S901 PolarHBondContact O-N 3.31Å; S901-I904 PolarHBondContact O-N 2.91Å; S901-A905 WeakPolarHBondContact O-CB 3.46Å; S901-A905 PolarHBondContact O-N 3.3Å
902	H	86.6	Confident	85.4	Confident	119 Å²	119	61.2 Å²	61.2	55%	0.551	31%	0.312	S	S	*	.	H	α-helix	trans	-62.1	-42.2	-179.3	66.4	-84.3	0	0	0	112	T899 H900 I904 A905 Y906	T899-H902 PolarHBondContact O-CE1 2.64Å; T899-H902 PolarHBondContact O-ND1 3.06Å; H900-H902 VanDerWaalsContact C-N 3.34Å; H900-H902 PolarHBondContact O-N 3.41Å; H902-I904 PolarHBondContact O-N 2.94Å; H902-I904 VanDerWaalsContact O-N 3.16Å; H902-A905 PolarHBondContact O-N 3.32Å; H902-A905 VanDerWaalsContact O-N 3.14Å; H902-Y906 WeakPolarHBondContact O-CD1 3.23Å
903	V	85.9	Confident	84.7	Confident	21 Å²	21	65.5 Å²	65.5	13%	0.127	33%	0.329	C	S	.	.	H	α-helix	trans	-56.1	-33	177.8	-170.8	0	0	0	0	112.4	I804 H900 Y906 R907	I804-V903 HydrophobicContact CG2-CG1 4.48Å; H900-V903 HydrophobicContact CB-CG2 4.21Å; H900-V903 PolarHBondContact O-N 2.87Å; V903-Y906 WeakPolarHBondContact O-CE1 3.23Å; V903-R907 VanDerWaalsContact O-CD 3.27Å; V903-R907 WeakPolarHBondContact O-CD 3.49Å; V903-R907 WeakPolarHBondContact O-CG 3.47Å; V903-R907 PolarHBondContact O-NE 3.01Å
904	I	86.8	Confident	83.6	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-96.8	-23.5	-178.5	-56.6	-51.5	0	0	0	112.2	I804 L807 H808 A811 S901 H902 Y906 R907 V908 W915	I804-I904 HydrophobicContact CG2-CD1 4.17Å; L807-I904 HydrophobicContact CB-CG1 4.45Å; L807-I904 HydrophobicContact CD2-CG1 3.71Å; L807-I904 HydrophobicContact CG-CG1 3.9Å; H808-I904 HydrophobicContact CB-CD1 3.65Å; A811-I904 HydrophobicContact CB-CG2 3.4Å; A811-I904 VanDerWaalsContact CB-CG2 3.4Å; S901-I904 PolarHBondContact O-N 2.91Å; H902-I904 PolarHBondContact O-N 2.94Å; H902-I904 VanDerWaalsContact O-N 3.16Å; I904-Y906 VanDerWaalsContact C-N 3.32Å; I904-Y906 PolarHBondContact O-N 3.49Å; I904-R907 PolarHBondContact O-N 2.92Å; I904-R907 VanDerWaalsContact O-N 3.13Å; I904-V908 HydrophobicContact CG2-CG2 4.08Å; I904-W915 HydrophobicContact CB-CH2 4.06Å; I904-W915 HydrophobicContact CB-CZ2 4.36Å; I904-W915 HydrophobicContact CG2-CH2 3.91Å; I904-W915 HydrophobicContact CG2-CZ2 4.24Å; I904-W915 HydrophobicContact CG2-CZ3 4.47Å
905	A	81.5	Confident	83	Confident	50 Å²	50	64.9 Å²	64.9	41%	0.413	33%	0.329	S	S	.	.	H	α-helix	trans	-59.7	-39.1	-176.2	0	0	0	0	0	113.5	S901 H902 L911	S901-A905 WeakPolarHBondContact O-CB 3.46Å; S901-A905 PolarHBondContact O-N 3.3Å; H902-A905 PolarHBondContact O-N 3.32Å; H902-A905 VanDerWaalsContact O-N 3.14Å; A905-L911 HydrophobicContact CB-CD2 4.32Å
906	Y	85	Confident	82.2	Confident	158 Å²	158	62.6 Å²	62.6	62%	0.62	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-11.7	177.7	66.6	-101.6	0	0	0	114.3	H902 V903 I904	H902-Y906 WeakPolarHBondContact O-CD1 3.23Å; V903-Y906 WeakPolarHBondContact O-CE1 3.23Å; I904-Y906 VanDerWaalsContact C-N 3.32Å; I904-Y906 PolarHBondContact O-N 3.49Å
907	R	87.1	Confident	80.8	Confident	87 Å²	87	62.7 Å²	62.7	33%	0.328	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-16.3	-173.9	-63.5	-174.1	-176.1	-154.1	-2.3	114.6	V903 I904	V903-R907 VanDerWaalsContact O-CD 3.27Å; V903-R907 WeakPolarHBondContact O-CD 3.49Å; V903-R907 WeakPolarHBondContact O-CG 3.47Å; V903-R907 PolarHBondContact O-NE 3.01Å; I904-R907 PolarHBondContact O-N 2.92Å; I904-R907 VanDerWaalsContact O-N 3.13Å
908	V	89.2	Confident	79.1	Confident	6 Å²	6	65.5 Å²	65.5	4%	0.036	34%	0.339	C	S	.	.			trans	-112.4	106.4	-175.2	-177.2	0	0	0	0	110.2	D771 A811 I812 I904 R910 L911	D771-V908 WeakPolarHBondContact OD2-CA 3.34Å; A811-V908 HydrophobicContact CB-CG2 4.02Å; I812-V908 HydrophobicContact CG1-CG1 4.4Å; I812-V908 HydrophobicContact CG1-CG2 3.92Å; I904-V908 HydrophobicContact CG2-CG2 4.08Å; V908-R910 PolarHBondContact O-N 3.48Å; V908-L911 HydrophobicContact CB-CB 4.18Å; V908-L911 HydrophobicContact CB-CD1 4.15Å; V908-L911 HydrophobicContact CG1-CB 4.28Å; V908-L911 HydrophobicContact CG1-CD1 4.23Å; V908-L911 HydrophobicContact CG2-CD1 4.5Å; V908-L911 PolarHBondContact O-N 3.07Å; V908-L911 VanDerWaalsContact O-N 3.11Å
909	A	87.8	Confident	77.2	Confident	79 Å²	79	61.6 Å²	61.6	65%	0.653	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.7	-169.3	0	0	0	0	0	114.2	D771 T774	D771-A909 PolarHBondContact OD2-N 3.27Å; T774-A909 HydrophobicContact CG2-CB 4Å
910	R	86.8	Confident	75.7	Confident	118 Å²	118	58.5 Å²	58.5	45%	0.445	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	52.1	174.1	-158	-172	-172.8	169.8	9.7	112.4	S773 T774 S815 V908 N912	S773-R910 WeakPolarHBondContact O-CD 3.43Å; S773-R910 WeakPolarHBondContact OG-CB 3.46Å; S773-R910 PolarHBondContact OG-N 2.77Å; T774-R910 HydrophobicContact CG2-CB 4.35Å; S815-R910 WeakPolarHBondContact CB-O 3.44Å; V908-R910 PolarHBondContact O-N 3.48Å; R910-N912 PolarHBondContact O-N 2.95Å
911	L	84.5	Confident	73.8	Confident	48 Å²	48	56.9 Å²	56.9	25%	0.251	29%	0.294	S	S	.	.			trans	-54.6	122.1	179.8	-173.5	62.5	0	0	0	112.8	A811 A905 V908 K913 W915	A811-L911 HydrophobicContact CB-CD1 4.04Å; A905-L911 HydrophobicContact CB-CD2 4.32Å; V908-L911 HydrophobicContact CB-CB 4.18Å; V908-L911 HydrophobicContact CB-CD1 4.15Å; V908-L911 HydrophobicContact CG1-CB 4.28Å; V908-L911 HydrophobicContact CG1-CD1 4.23Å; V908-L911 HydrophobicContact CG2-CD1 4.5Å; V908-L911 PolarHBondContact O-N 3.07Å; V908-L911 VanDerWaalsContact O-N 3.11Å; L911-K913 PolarHBondContact O-N 3.04Å; L911-W915 HydrophobicContact CD1-CD2 4.03Å; L911-W915 HydrophobicContact CD1-CG 3.82Å
912	N	80	Confident	71.8	Confident	35 Å²	35	56.2 Å²	56.2	19%	0.187	29%	0.291	C	S	.	.			trans	-89	114.5	-173.9	-166.5	-19.9	0	0	0	110.4	S815 R910 N914 W915 R937	S815-N912 WeakPolarHBondContact OG-CB 3.2Å; S815-N912 PolarHBondContact OG-N 2.57Å; R910-N912 PolarHBondContact O-N 2.95Å; N912-N914 VanDerWaalsContact C-N 3.26Å; N912-N914 PolarHBondContact O-N 2.83Å; N912-W915 WeakPolarHBondContact O-CB 3.43Å; N912-W915 PolarHBondContact O-N 2.95Å; N912-R937 VanDerWaalsContact CB-NH1 3.29Å; N912-R937 VanDerWaalsContact CG-CZ 3.47Å; N912-R937 PolarHBondContact O-NH1 3.14Å; N912-R937 WeakPolarHBondContact OD1-CD 3.3Å; N912-R937 PolarHBondContact OD1-NE 3.45Å; N912-R937 PolarHBondContact OD1-NH1 2.97Å
913	K	71	Confident	69.8	Low	171 Å²	171	53 Å²	53	74%	0.743	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-26.6	-162.6	-59.7	-162.3	178.5	-165.3	0	118.4	L911	L911-K913 PolarHBondContact O-N 3.04Å
914	N	64.8	Low	67.3	Low	46 Å²	46	53.3 Å²	53.3	25%	0.246	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	16.1	180	-60.6	-79.2	0	0	0	114.4	N912 Q916 S917 F920 W936 R937	N912-N914 VanDerWaalsContact C-N 3.26Å; N912-N914 PolarHBondContact O-N 2.83Å; N914-Q916 PolarHBondContact O-N 3.2Å; N914-S917 VanDerWaalsContact O-CB 3.27Å; N914-S917 WeakPolarHBondContact O-CB 3.49Å; N914-S917 PolarHBondContact O-N 3.23Å; N914-F920 HydrophobicContact CB-CE2 4.01Å; N914-F920 WeakPolarHBondContact O-CD2 3.14Å; N914-F920 WeakPolarHBondContact O-CE2 3.37Å; N914-W936 HydrophobicContact CB-CD2 4.48Å; N914-W936 HydrophobicContact CB-CE3 3.97Å; N914-W936 HydrophobicContact CB-CH2 4.2Å; N914-W936 HydrophobicContact CB-CZ3 3.82Å; N914-W936 VanDerWaalsContact CG-CZ3 3.42Å; N914-W936 WeakPolarHBondContact OD1-CZ3 3.16Å; N914-R937 HydrophobicContact CB-CG 4.48Å
915	W	69.1	Low	64.6	Low	10 Å²	10	61.8 Å²	61.8	4%	0.038	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-34.7	-167.4	68.7	-80.2	0	0	0	115.2	L807 A811 I904 L911 N912 S917	L807-W915 HydrophobicContact CD1-CH2 3.82Å; L807-W915 HydrophobicContact CD1-CZ3 3.57Å; L807-W915 HydrophobicContact CD2-CH2 4.38Å; L807-W915 HydrophobicContact CG-CH2 3.93Å; L807-W915 HydrophobicContact CG-CZ3 3.96Å; A811-W915 HydrophobicContact CB-CD2 4.06Å; A811-W915 HydrophobicContact CB-CE3 3.6Å; A811-W915 HydrophobicContact CB-CH2 4.2Å; A811-W915 HydrophobicContact CB-CZ3 3.68Å; I904-W915 HydrophobicContact CB-CH2 4.06Å; I904-W915 HydrophobicContact CB-CZ2 4.36Å; I904-W915 HydrophobicContact CG2-CH2 3.91Å; I904-W915 HydrophobicContact CG2-CZ2 4.24Å; I904-W915 HydrophobicContact CG2-CZ3 4.47Å; L911-W915 HydrophobicContact CD1-CD2 4.03Å; L911-W915 HydrophobicContact CD1-CG 3.82Å; N912-W915 WeakPolarHBondContact O-CB 3.43Å; N912-W915 PolarHBondContact O-N 2.95Å; W915-S917 VanDerWaalsContact C-N 3.31Å
916	Q	65.5	Low	62.1	Low	68 Å²	68	63.2 Å²	63.2	32%	0.318	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-13.6	174.2	-65.8	151.8	-33.2	0	0	113.8	A897 N914 S918	A897-Q916 HydrophobicContact CB-CG 4.43Å; A897-Q916 PolarHBondContact O-NE2 2.92Å; N914-Q916 PolarHBondContact O-N 3.2Å; Q916-S918 PolarHBondContact O-N 3.1Å
917	S	59.3	Low	59.4	Low	33 Å²	33	65.6 Å²	65.6	23%	0.231	33%	0.326	C	S	.	.			trans	-63.7	137	-154.8	-168.8	0	0	0	0	112.9	N914 W915 S919 F920 M921 W936	N914-S917 VanDerWaalsContact O-CB 3.27Å; N914-S917 WeakPolarHBondContact O-CB 3.49Å; N914-S917 PolarHBondContact O-N 3.23Å; W915-S917 VanDerWaalsContact C-N 3.31Å; S917-S919 PolarHBondContact O-N 2.88Å; S917-F920 WeakPolarHBondContact O-CB 3.37Å; S917-F920 PolarHBondContact O-N 3.25Å; S917-M921 PolarHBondContact O-N 3.3Å; S917-W936 VanDerWaalsContact CB-CZ2 3.49Å; S917-W936 WeakPolarHBondContact OG-CH2 3.39Å; S917-W936 WeakPolarHBondContact OG-CZ2 3.48Å
918	S	48.1	Very low	56.5	Low	64 Å²	64	64.6 Å²	64.6	45%	0.448	34%	0.343	S	S	.	.	H	α-helix	trans	-53.3	-22.5	-176.1	60.3	0	0	0	0	114.6	Q916 M921 A922	Q916-S918 PolarHBondContact O-N 3.1Å; S918-M921 PolarHBondContact O-N 3.44Å; S918-A922 WeakPolarHBondContact O-CB 3.22Å; S918-A922 PolarHBondContact O-N 3.07Å
919	S	43.9	Very low	53.4	Low	25 Å²	25	68.8 Å²	68.8	18%	0.175	37%	0.369	C	S	.	.	H	α-helix	trans	-84.9	-7.9	175.9	-38.5	0	0	0	0	114.8	S917 N998	S917-S919 PolarHBondContact O-N 2.88Å; S919-N998 PolarHBondContact OG-ND2 3.44Å
920	F	54	Low	50.4	Low	9 Å²	9	70.8 Å²	70.8	4%	0.039	37%	0.368	C	S	.	.	H	α-helix	trans	-79.7	-43.6	158.4	-78.1	-85.2	0	0	0	110.4	L814 I874 N914 S917 W936 R937	L814-F920 HydrophobicContact CD1-CD1 4.37Å; L814-F920 HydrophobicContact CD2-CD1 4.31Å; L814-F920 HydrophobicContact CD2-CE1 4.49Å; I874-F920 HydrophobicContact CB-CD1 4.38Å; I874-F920 HydrophobicContact CD1-CD1 3.93Å; I874-F920 HydrophobicContact CD1-CE1 3.48Å; I874-F920 VanDerWaalsContact CD1-CE1 3.48Å; I874-F920 HydrophobicContact CG1-CD1 3.81Å; I874-F920 HydrophobicContact CG1-CE1 3.68Å; I874-F920 HydrophobicContact CG2-CD1 3.75Å; I874-F920 HydrophobicContact CG2-CE1 4.42Å; N914-F920 HydrophobicContact CB-CE2 4.01Å; N914-F920 WeakPolarHBondContact O-CD2 3.14Å; N914-F920 WeakPolarHBondContact O-CE2 3.37Å; S917-F920 WeakPolarHBondContact O-CB 3.37Å; S917-F920 PolarHBondContact O-N 3.25Å; F920-W936 AromaticContact CD1-CD1 3.88Å; F920-W936 AromaticContact CD2-CD1 3.41Å; F920-W936 VanDerWaalsContact CD2-CD1 3.41Å; F920-W936 HydrophobicContact CD2-CD2 4.21Å; F920-W936 AromaticContact CD2-CE2 3.76Å; F920-W936 HydrophobicContact CD2-CG 4.04Å; F920-W936 HydrophobicContact CD2-CZ2 4.46Å; F920-W936 AromaticContact CD2-NE1 3.23Å; F920-W936 HydrophobicContact CE1-CB 4.12Å; F920-W936 AromaticContact CE1-CD1 3.65Å; F920-W936 HydrophobicContact CE1-CG 4.07Å; F920-W936 HydrophobicContact CE2-CB 3.92Å; F920-W936 AromaticContact CE2-CD1 3.14Å; F920-W936 AromaticContact CE2-CD2 3.55Å; F920-W936 HydrophobicContact CE2-CD2 3.55Å; F920-W936 AromaticContact CE2-CE2 3.59Å; F920-W936 HydrophobicContact CE2-CE3 4.37Å; F920-W936 AromaticContact CE2-CG 3.3Å; F920-W936 HydrophobicContact CE2-CG 3.3Å; F920-W936 HydrophobicContact CE2-CZ2 4.44Å; F920-W936 AromaticContact CE2-NE1 3.32Å; F920-W936 VanDerWaalsContact CE2-NE1 3.32Å; F920-W936 AromaticContact CG-CD1 3.74Å; F920-W936 AromaticContact CG-NE1 3.76Å; F920-W936 HydrophobicContact CZ-CB 3.4Å; F920-W936 VanDerWaalsContact CZ-CB 3.4Å; F920-W936 AromaticContact CZ-CD1 3.23Å; F920-W936 HydrophobicContact CZ-CD2 4.03Å; F920-W936 AromaticContact CZ-CG 3.29Å; F920-W936 HydrophobicContact CZ-CG 3.29Å; F920-W936 AromaticContact CZ-NE1 3.93Å; F920-R937 VanDerWaalsContact CE2-NH2 3.25Å; F920-R937 VanDerWaalsContact CZ-CZ 3.43Å
921	M	49.2	Very low	47.5	Very low	9 Å²	9	67.5 Å²	67.5	4%	0.044	37%	0.371	C	S	.	.	H	α-helix	trans	-71.9	-43.1	-173.4	-64.3	-73.4	-76.4	0	0	112.2	V879 L890 M893 S917 S918	V879-M921 CarbonylContact C-O 3.45Å; V879-M921 WeakPolarHBondContact CA-O 3.27Å; V879-M921 WeakPolarHBondContact CB-O 3.42Å; V879-M921 HydrophobicContact CG2-CE 3.9Å; V879-M921 HydrophobicContact CG2-SD 4.43Å; V879-M921 PolarHBondContact N-O 3.16Å; L890-M921 HydrophobicContact CD1-CB 3.52Å; L890-M921 HydrophobicContact CD1-CE 4.34Å; M893-M921 HydrophobicContact CB-CE 3.54Å; M893-M921 HydrophobicContact CG-CE 4.41Å; M893-M921 HydrophobicContact SD-CE 4.01Å; S917-M921 PolarHBondContact O-N 3.3Å; S918-M921 PolarHBondContact O-N 3.44Å
922	A	42.3	Very low	44.7	Very low	25 Å²	25	66.5 Å²	66.5	21%	0.207	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-113.9	126.6	-172.9	0	0	0	0	0	113.3	L890 S918	L890-A922 HydrophobicContact CD1-CB 4.36Å; L890-A922 HydrophobicContact CD2-CB 3.73Å; S918-A922 WeakPolarHBondContact O-CB 3.22Å; S918-A922 PolarHBondContact O-N 3.07Å
923	L	43.3	Very low	42.1	Very low	50 Å²	50	69.9 Å²	69.9	26%	0.262	38%	0.38	S	S	.	.			trans	-135.8	4.7	-176.9	-121.7	159.2	0	0	0	114.8	V878 R933	V878-L923 HydrophobicContact CG1-CB 3.63Å; V878-L923 HydrophobicContact CG2-CB 4.13Å; V878-L923 HydrophobicContact CG2-CD1 3.58Å; V878-L923 HydrophobicContact CG2-CG 4.47Å; L923-R933 HydrophobicContact CD2-CB 3.59Å; L923-R933 HydrophobicContact CG-CB 4.47Å
924	S	34.1	Very low	39.9	Very low	29 Å²	29	63.2 Å²	63.2	20%	0.203	36%	0.356	C	S	.	.			trans	-101.4	107.7	-171.3	-152.7	0	0	0	0	114.8	N880 T881	N880-S924 WeakPolarHBondContact OD1-CB 3.37Å; N880-S924 PolarHBondContact OD1-OG 2.7Å; T881-S924 PolarHBondContact OG1-O 2.74Å
925	K	29.9	Very low	38	Very low	177 Å²	177	61.9 Å²	61.9	77%	0.77	35%	0.348	S	S	*	.	S	Bend	trans	177.4	45.9	148.9	-115.2	-172.1	177.3	-178.1	0	109.3
926	Y	28.8	Very low	35.9	Very low	80 Å²	80	64 Å²	64	31%	0.314	36%	0.356	S	S	.	.			trans	-157.4	55.6	-159.7	-115.6	-78.7	0	0	0	113.9	L930 A932 R933	Y926-L930 HydrophobicContact CD1-CB 3.67Å; Y926-L930 HydrophobicContact CE1-CB 3.12Å; Y926-L930 HydrophobicContact CE1-CD1 4.34Å; Y926-L930 HydrophobicContact CE1-CG 4.28Å; Y926-L930 HydrophobicContact CE2-CD1 4.38Å; Y926-A932 HydrophobicContact CD1-CB 3.38Å; Y926-A932 HydrophobicContact CD2-CB 4.13Å; Y926-A932 HydrophobicContact CE1-CB 3.04Å; Y926-A932 HydrophobicContact CE2-CB 3.93Å; Y926-A932 HydrophobicContact CG-CB 3.88Å; Y926-R933 HydrophobicContact CD2-CG 4.35Å
927	K	28.6	Very low	34	Very low	208 Å²	208	63.4 Å²	63.4	90%	0.904	35%	0.35	S	S	*	.	S	Bend	trans	-147.3	-32.7	176.5	-86.6	-174.5	-176.9	163	0	114.4
928	G	25.9	Very low	32.4	Very low	67 Å²	67	63.8 Å²	63.8	69%	0.691	35%	0.353	S	S	*	.	S	Bend	trans	-85.6	111.8	158.5	0	0	0	0	0	107.4
929	T	24.5	Very low	31.4	Very low	94 Å²	94	62.6 Å²	62.6	58%	0.577	35%	0.347	S	S	*	.	S	Bend	trans	59	166.3	-163	77.5	0	0	0	0	115.1
930	L	25	Very low	30.7	Very low	121 Å²	121	65.5 Å²	65.5	63%	0.634	36%	0.361	S	S	*	.			trans	66.4	149.5	167.1	-49.7	155.3	0	0	0	118.5	Y926	Y926-L930 HydrophobicContact CD1-CB 3.67Å; Y926-L930 HydrophobicContact CE1-CB 3.12Å; Y926-L930 HydrophobicContact CE1-CD1 4.34Å; Y926-L930 HydrophobicContact CE1-CG 4.28Å; Y926-L930 HydrophobicContact CE2-CD1 4.38Å
931	G	26.2	Very low	29.6	Very low	49 Å²	49	67.9 Å²	67.9	51%	0.505	38%	0.377	S	S	.	.			trans	-115	61.4	-172.1	0	0	0	0	0	117.3
932	A	24.5	Very low	28.4	Very low	27 Å²	27	76 Å²	76	22%	0.223	42%	0.415	C	S	.	.			trans	-134.5	-176.7	175.7	0	0	0	0	0	109.3	Y926	Y926-A932 HydrophobicContact CD1-CB 3.38Å; Y926-A932 HydrophobicContact CD2-CB 4.13Å; Y926-A932 HydrophobicContact CE1-CB 3.04Å; Y926-A932 HydrophobicContact CE2-CB 3.93Å; Y926-A932 HydrophobicContact CG-CB 3.88Å
933	R	25.5	Very low	27.5	Very low	106 Å²	106	78.4 Å²	78.4	40%	0.4	44%	0.442	S	S	.	.			cis	-109.7	140	1.7	-91.2	169.5	171.5	160.9	-4.7	109.5	L923 Y926	L923-R933 HydrophobicContact CD2-CB 3.59Å; L923-R933 HydrophobicContact CG-CB 4.47Å; Y926-R933 HydrophobicContact CD2-CG 4.35Å
934	A	25.2	Very low	26.5	Very low	30 Å²	30	80.5 Å²	80.5	25%	0.248	47%	0.467	C	S	.	.				77.6	125.8	103.3	0	0	0	0	0	112.8
935	R	24.2	Very low	26	Very low	19 Å²	19	87 Å²	87	7%	0.072	50%	0.499	C	S	.	.				67.8	115.4	84.3	-156.7	154.3	-67.1	-133.4	-4.2	108.3	R988 Y991 Q992 Y996	R935-R988 PolarHBondContact NH2-O 2.75Å; R935-Y991 VanDerWaalsContact CZ-O 3.27Å; R935-Y991 PolarHBondContact NH1-O 3.26Å; R935-Y991 PolarHBondContact NH2-O 2.95Å; R935-Q992 VanDerWaalsContact CA-CD 3.5Å; R935-Q992 HydrophobicContact CB-CG 4.28Å; R935-Q992 HydrophobicContact CG-CG 3.86Å; R935-Q992 VanDerWaalsContact NE-CG 3.27Å; R935-Q992 VanDerWaalsContact NH2-CG 3.33Å; R935-Y996 PolarHBondContact NH1-O 2.82Å; R935-Y996 VanDerWaalsContact NH1-O 3.1Å
936	W	25.4	Very low	25.6	Very low	54 Å²	54	89.2 Å²	89.2	21%	0.205	50%	0.502	C	S	.	.			cis	-138.6	-171.5	48.7	-51.6	78.1	0	0	0	113	N914 S917 F920	N914-W936 HydrophobicContact CB-CD2 4.48Å; N914-W936 HydrophobicContact CB-CE3 3.97Å; N914-W936 HydrophobicContact CB-CH2 4.2Å; N914-W936 HydrophobicContact CB-CZ3 3.82Å; N914-W936 VanDerWaalsContact CG-CZ3 3.42Å; N914-W936 WeakPolarHBondContact OD1-CZ3 3.16Å; S917-W936 VanDerWaalsContact CB-CZ2 3.49Å; S917-W936 WeakPolarHBondContact OG-CH2 3.39Å; S917-W936 WeakPolarHBondContact OG-CZ2 3.48Å; F920-W936 AromaticContact CD1-CD1 3.88Å; F920-W936 AromaticContact CD2-CD1 3.41Å; F920-W936 VanDerWaalsContact CD2-CD1 3.41Å; F920-W936 HydrophobicContact CD2-CD2 4.21Å; F920-W936 AromaticContact CD2-CE2 3.76Å; F920-W936 HydrophobicContact CD2-CG 4.04Å; F920-W936 HydrophobicContact CD2-CZ2 4.46Å; F920-W936 AromaticContact CD2-NE1 3.23Å; F920-W936 HydrophobicContact CE1-CB 4.12Å; F920-W936 AromaticContact CE1-CD1 3.65Å; F920-W936 HydrophobicContact CE1-CG 4.07Å; F920-W936 HydrophobicContact CE2-CB 3.92Å; F920-W936 AromaticContact CE2-CD1 3.14Å; F920-W936 AromaticContact CE2-CD2 3.55Å; F920-W936 HydrophobicContact CE2-CD2 3.55Å; F920-W936 AromaticContact CE2-CE2 3.59Å; F920-W936 HydrophobicContact CE2-CE3 4.37Å; F920-W936 AromaticContact CE2-CG 3.3Å; F920-W936 HydrophobicContact CE2-CG 3.3Å; F920-W936 HydrophobicContact CE2-CZ2 4.44Å; F920-W936 AromaticContact CE2-NE1 3.32Å; F920-W936 VanDerWaalsContact CE2-NE1 3.32Å; F920-W936 AromaticContact CG-CD1 3.74Å; F920-W936 AromaticContact CG-NE1 3.76Å; F920-W936 HydrophobicContact CZ-CB 3.4Å; F920-W936 VanDerWaalsContact CZ-CB 3.4Å; F920-W936 AromaticContact CZ-CD1 3.23Å; F920-W936 HydrophobicContact CZ-CD2 4.03Å; F920-W936 AromaticContact CZ-CG 3.29Å; F920-W936 HydrophobicContact CZ-CG 3.29Å; F920-W936 AromaticContact CZ-NE1 3.93Å
937	R	25.9	Very low	25.4	Very low	55 Å²	55	93 Å²	93	21%	0.208	53%	0.526	C	S	.	.			cis	-155	149.4	7.9	-151.6	-172	-65.3	-149.1	0.6	110.5	L814 N912 N914 F920	L814-R937 PolarHBondContact O-NH2 2.99Å; N912-R937 VanDerWaalsContact CB-NH1 3.29Å; N912-R937 VanDerWaalsContact CG-CZ 3.47Å; N912-R937 PolarHBondContact O-NH1 3.14Å; N912-R937 WeakPolarHBondContact OD1-CD 3.3Å; N912-R937 PolarHBondContact OD1-NE 3.45Å; N912-R937 PolarHBondContact OD1-NH1 2.97Å; N914-R937 HydrophobicContact CB-CG 4.48Å; F920-R937 VanDerWaalsContact CE2-NH2 3.25Å; F920-R937 VanDerWaalsContact CZ-CZ 3.43Å
938	S	25.8	Very low	25.1	Very low	41 Å²	41	89 Å²	89	29%	0.287	52%	0.515	S	S	.	.			trans	-138.2	141.8	149.6	63.2	0	0	0	0	108.3	Q992 R993	S938-Q992 PolarHBondContact OG-O 3.33Å; S938-R993 VanDerWaalsContact OG-C 3.32Å; S938-R993 VanDerWaalsContact OG-CA 3.3Å; S938-R993 WeakPolarHBondContact OG-CA 3.47Å; S938-R993 PolarHBondContact OG-O 3.1Å
939	A	27	Very low	25	Very low	40 Å²	40	95.8 Å²	95.8	33%	0.331	52%	0.519	S	S	.	.			trans	-166	100.2	171	0	0	0	0	0	109.8
940	N	29.6	Very low	24.9	Very low	85 Å²	85	99.1 Å²	99.1	46%	0.455	53%	0.528	S	S	.	.			trans	-65.8	-175.8	165.2	-118.8	38.2	0	0	0	110.8	R1082	N940-R1082 VanDerWaalsContact N-CZ 3.3Å; N940-R1082 PolarHBondContact O-NH1 3.33Å; N940-R1082 PolarHBondContact O-NH2 3.1Å
941	P	31.3	Very low	24.8	Very low	60 Å²	60	99.4 Å²	99.4	39%	0.39	53%	0.531	S	S	.	.			cis	-141.8	-168.9	19.2	46.8	-28.9	0	0	0	117.3
942	E	22.6	Very low	24.7	Very low	178 Å²	178	108.3 Å²	108.3	83%	0.832	55%	0.551	S	S	*	*			trans	65.9	153.4	155.3	-74.3	122.1	-125.3	0	0	120
943	G	24.3	Very low	24.6	Very low	76 Å²	76	111.4 Å²	111.4	78%	0.784	57%	0.57	S	S	*	*			trans	123.2	119	-177.5	0	0	0	0	0	114.2
944	A	22.9	Very low	24.5	Very low	94 Å²	94	114 Å²	114	78%	0.777	58%	0.584	S	S	*	*			trans	-29.3	159.5	165.2	0	0	0	0	0	117.9
945	L	23.2	Very low	24.4	Very low	166 Å²	166	119.8 Å²	119.8	87%	0.869	61%	0.606	S	S	*	*			cis	-153.3	-178	14	-126.6	157.1	0	0	0	111.4
946	R	22.1	Very low	24.5	Very low	223 Å²	223	122.6 Å²	122.6	84%	0.842	63%	0.633	S	S	*	*			trans	-74.8	156.2	174.4	-66.3	170.8	169.5	155.2	-7	111.8
947	I	24.4	Very low	24.5	Very low	161 Å²	161	128.6 Å²	128.6	83%	0.826	66%	0.661	S	S	*	*				172.4	104	117.8	-85.1	155.8	0	0	0	110.6
948	D	22.5	Very low	24.4	Very low	123 Å²	123	134.8 Å²	134.8	66%	0.658	70%	0.696	S	S	*	*				54.8	159.4	124.8	-145.6	18.5	0	0	0	124.9
949	R	22.6	Very low	24.4	Very low	209 Å²	209	135.6 Å²	135.6	79%	0.789	71%	0.711	S	S	*	*			trans	71	89.3	161.4	-75.3	156.3	-157.4	-130.1	-5.8	120.7
950	E	22.6	Very low	24.5	Very low	164 Å²	164	137.9 Å²	137.9	77%	0.766	73%	0.729	S	S	*	*				13.4	161.2	114.4	-53.4	-165	138.7	0	0	122.6
951	N	23	Very low	24.5	Very low	128 Å²	128	138.8 Å²	138.8	68%	0.684	74%	0.743	S	S	*	*			trans	70.9	106	158.4	-61.9	-45.4	0	0	0	118.1
952	Y	24.1	Very low	24.4	Very low	236 Å²	236	146.7 Å²	146.7	93%	0.925	77%	0.765	S	S	*	*				-151.7	131.8	101.7	-119.4	-88	0	0	0	112.4
953	C	23.2	Very low	24.7	Very low	92 Å²	92	144.6 Å²	144.6	62%	0.622	76%	0.759	S	S	*	*			trans	-73.8	178.5	162.3	-87.5	0	0	0	0	109.8
954	K	23	Very low	25.1	Very low	159 Å²	159	147.5 Å²	147.5	69%	0.691	76%	0.755	S	S	*	*			cis	-167.6	158.7	-3.1	-117.2	165.1	-172.2	178.6	0	106.3
955	E	23.5	Very low	25.6	Very low	152 Å²	152	146.4 Å²	146.4	71%	0.71	75%	0.746	S	S	*	*			trans	55	165.9	151.8	-81.6	118.9	-138.1	0	0	120
956	A	25.5	Very low	25.9	Very low	78 Å²	78	146 Å²	146	65%	0.645	74%	0.738	S	S	*	*			cis	-139.9	117.7	-24.3	0	0	0	0	0	112.7
957	K	26.6	Very low	26.2	Very low	181 Å²	181	141.1 Å²	141.1	79%	0.787	73%	0.728	S	S	*	*				49.4	76.7	118.6	-53.2	162.9	-172.5	162.5	0	119.6
958	I	23.7	Very low	26.6	Very low	185 Å²	185	136.3 Å²	136.3	95%	0.949	72%	0.718	S	S	*	*			trans	-165.3	136.5	139.7	-96.2	142.2	0	0	0	108
959	G	25.4	Very low	27.1	Very low	58 Å²	58	133.9 Å²	133.9	60%	0.598	72%	0.715	S	S	*	*			trans	137.8	171.4	165.9	0	0	0	0	0	119.1	S961	G959-S961 VanDerWaalsContact C-N 3.25Å; G959-S961 PolarHBondContact O-N 2.84Å
960	A	28.5	Very low	27.4	Very low	87 Å²	87	132 Å²	132	72%	0.719	72%	0.715	S	S	*	*			trans	56	-17.3	165.3	0	0	0	0	0	121.1	R962 L963	A960-R962 VanDerWaalsContact C-N 3.27Å; A960-R962 PolarHBondContact O-N 3.18Å; A960-R962 VanDerWaalsContact O-N 3.14Å; A960-L963 PolarHBondContact O-N 3.05Å
961	S	29.8	Very low	27.8	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-19	-171.5	62	0	0	0	0	115.8	G959	G959-S961 VanDerWaalsContact C-N 3.25Å; G959-S961 PolarHBondContact O-N 2.84Å
962	R	30	Very low	28.1	Very low	226 Å²	226	130.2 Å²	130.2	85%	0.853	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-26.6	179.9	-78.8	-178.5	170.7	166.5	-2.1	115	A960	A960-R962 VanDerWaalsContact C-N 3.27Å; A960-R962 PolarHBondContact O-N 3.18Å; A960-R962 VanDerWaalsContact O-N 3.14Å
963	L	29	Very low	28.2	Very low	134 Å²	134	128.2 Å²	128.2	70%	0.702	72%	0.718	S	S	*	*	H	α-helix	trans	-79.7	-42.1	-172.7	-143.3	77.9	0	0	0	113	A960 A965 F966 L967	A960-L963 PolarHBondContact O-N 3.05Å; L963-A965 VanDerWaalsContact C-N 3.27Å; L963-A965 PolarHBondContact O-N 2.61Å; L963-F966 WeakPolarHBondContact O-CB 3.25Å; L963-F966 PolarHBondContact O-N 2.97Å; L963-L967 PolarHBondContact O-N 2.63Å
964	L	32.3	Very low	28.4	Very low	136 Å²	136	127.2 Å²	127.2	71%	0.712	72%	0.723	S	S	*	*	H	α-helix	trans	-69.1	-24.4	177.2	-76.1	166.1	0	0	0	113	F966 G968	L964-F966 VanDerWaalsContact C-N 3.3Å; L964-F966 PolarHBondContact O-N 2.68Å; L964-G968 PolarHBondContact O-N 3.47Å
965	A	33	Very low	28.6	Very low	72 Å²	72	129.7 Å²	129.7	60%	0.595	73%	0.734	S	S	*	*	H	α-helix	trans	-66.3	-31	172.9	0	0	0	0	0	112.6	L963	L963-A965 VanDerWaalsContact C-N 3.27Å; L963-A965 PolarHBondContact O-N 2.61Å
966	F	28.8	Very low	28.8	Very low	158 Å²	158	129.6 Å²	129.6	69%	0.693	74%	0.737	S	S	*	*	H	α-helix	trans	-73.6	-46.7	177.3	-169.1	-111.4	0	0	0	111.7	L963 L964	L963-F966 WeakPolarHBondContact O-CB 3.25Å; L963-F966 PolarHBondContact O-N 2.97Å; L964-F966 VanDerWaalsContact C-N 3.3Å; L964-F966 PolarHBondContact O-N 2.68Å
967	L	28.3	Very low	28.9	Very low	120 Å²	120	129.7 Å²	129.7	63%	0.628	74%	0.738	S	S	*	*	H	α-helix	trans	-75.1	-28.5	-178.5	-71.5	166.8	0	0	0	113.7	L963 A969	L963-L967 PolarHBondContact O-N 2.63Å; L967-A969 PolarHBondContact O-N 2.87Å
968	G	32.7	Very low	29	Very low	60 Å²	60	130.4 Å²	130.4	62%	0.619	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-20.3	176.2	0	0	0	0	0	114.7	L964	L964-G968 PolarHBondContact O-N 3.47Å
969	A	32.9	Very low	29.3	Very low	71 Å²	71	129.4 Å²	129.4	59%	0.587	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-23	-171.8	0	0	0	0	0	114.9	L967 L971	L967-A969 PolarHBondContact O-N 2.87Å; A969-L971 PolarHBondContact O-N 3.21Å
970	Q	30.3	Very low	29.4	Very low	170 Å²	170	136.4 Å²	136.4	79%	0.794	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-15.4	-171.5	-72.3	-155.1	2.8	0	0	115.5	A972	Q970-A972 PolarHBondContact O-N 3.32Å; Q970-A972 VanDerWaalsContact O-N 3.14Å
971	L	29.8	Very low	29.3	Very low	168 Å²	168	136.9 Å²	136.9	88%	0.88	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	17.8	-176	-72.8	171.1	0	0	0	114.9	A969 K973	A969-L971 PolarHBondContact O-N 3.21Å; L971-K973 PolarHBondContact O-N 2.85Å
972	A	29.2	Very low	29.1	Very low	86 Å²	86	135.2 Å²	135.2	71%	0.711	73%	0.729	S	S	*	*			trans	-89.7	45.5	-175	0	0	0	0	0	115.2	Q970	Q970-A972 PolarHBondContact O-N 3.32Å; Q970-A972 VanDerWaalsContact O-N 3.14Å
973	K	26.9	Very low	29	Very low	194 Å²	194	132.4 Å²	132.4	84%	0.843	72%	0.724	S	S	*	*			trans	-141.7	92.3	173.9	-69.1	-174.6	-179.2	173.7	0	113.1	L971	L971-K973 PolarHBondContact O-N 2.85Å
974	G	26.3	Very low	28.9	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	72%	0.718	S	S	*	*			trans	173	91.6	171.8	0	0	0	0	0	120.4
975	K	29	Very low	28.9	Very low	210 Å²	210	130.9 Å²	130.9	91%	0.913	71%	0.712	S	S	*	*			trans	60.9	101.4	147.6	-61.1	-178.1	178.6	-179.2	0	119.1	A977	K975-A977 PolarHBondContact O-N 3.33Å
976	I	26.4	Very low	28.9	Very low	151 Å²	151	130.5 Å²	130.5	77%	0.774	71%	0.705	S	S	*	*			trans	-74.4	96.4	166.4	-60.5	165.5	0	0	0	110.1
977	A	27.2	Very low	29.4	Very low	80 Å²	80	124.6 Å²	124.6	66%	0.661	68%	0.68	S	S	*	*			trans	-176.6	93.2	159.3	0	0	0	0	0	112	K975	K975-A977 PolarHBondContact O-N 3.33Å
978	K	29.6	Very low	29.9	Very low	196 Å²	196	121.9 Å²	121.9	85%	0.852	66%	0.661	S	S	*	*			trans	-178.4	-0.7	163.9	-108.5	144.4	-164.8	163.7	0	120.2	K980	K978-K980 PolarHBondContact O-N 3.41Å
979	R	29.2	Very low	30.4	Very low	164 Å²	164	125 Å²	125	62%	0.619	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-74	-14.7	-158.9	-81.3	-167.7	-174.5	163.5	10.4	119.5	S981	R979-S981 VanDerWaalsContact C-N 3.3Å; R979-S981 PolarHBondContact O-N 2.78Å
980	K	27.8	Very low	31.1	Very low	205 Å²	205	123.4 Å²	123.4	89%	0.891	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-68.8	-17.4	-175.7	-78.8	-171.2	174.9	-177.1	0	115.1	K978	K978-K980 PolarHBondContact O-N 3.41Å
981	S	26.8	Very low	31.9	Very low	97 Å²	97	115.9 Å²	115.9	68%	0.678	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-92.3	8.9	-169.5	74.9	0	0	0	0	116.6	R979	R979-S981 VanDerWaalsContact C-N 3.3Å; R979-S981 PolarHBondContact O-N 2.78Å
982	A	26.4	Very low	32.7	Very low	69 Å²	69	109.1 Å²	109.1	57%	0.57	56%	0.563	S	S	*	*	S	Bend	trans	-91.2	-31.2	-170	0	0	0	0	0	114.9	H985	A982-H985 VanDerWaalsContact O-CB 3.28Å; A982-H985 WeakPolarHBondContact O-CB 3.07Å; A982-H985 PolarHBondContact O-N 2.98Å
983	F	26.3	Very low	33.8	Very low	167 Å²	167	113.6 Å²	113.6	73%	0.732	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-36.9	-165.5	-150.4	-101.2	0	0	0	113.5	H985 S986	F983-H985 PolarHBondContact O-N 2.7Å; F983-S986 PolarHBondContact O-OG 2.84Å
984	L	27.9	Very low	34.9	Very low	111 Å²	111	104.8 Å²	104.8	58%	0.581	52%	0.524	S	S	*	.	H	α-helix	trans	-65.8	-13.8	172.4	-75.8	162.4	0	0	0	113.5	R988	L984-R988 WeakPolarHBondContact O-CB 3.41Å
985	H	32.9	Very low	36.1	Very low	127 Å²	127	102.4 Å²	102.4	59%	0.588	50%	0.499	S	S	*	.	H	α-helix	trans	-86.4	-14.7	-172.8	-153.4	73.6	0	0	0	113.8	A982 F983 R989	A982-H985 VanDerWaalsContact O-CB 3.28Å; A982-H985 WeakPolarHBondContact O-CB 3.07Å; A982-H985 PolarHBondContact O-N 2.98Å; F983-H985 PolarHBondContact O-N 2.7Å; H985-R989 PolarHBondContact NE2-NH2 2.88Å; H985-R989 VanDerWaalsContact O-CD 3.32Å; H985-R989 WeakPolarHBondContact O-CD 3.4Å; H985-R989 WeakPolarHBondContact O-CG 3.43Å
986	S	32.9	Very low	37.4	Very low	64 Å²	64	92.9 Å²	92.9	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-80.4	-65.8	174	53.5	0	0	0	0	111.1	F983 R988 R989 M990	F983-S986 PolarHBondContact O-OG 2.84Å; S986-R988 VanDerWaalsContact C-N 3.27Å; S986-R988 PolarHBondContact O-N 3.32Å; S986-R989 WeakPolarHBondContact O-CB 3.17Å; S986-R989 PolarHBondContact O-N 3.41Å; S986-M990 PolarHBondContact O-N 3.18Å
987	H	39.2	Very low	38.6	Very low	34 Å²	34	88.7 Å²	88.7	16%	0.157	44%	0.439	C	S	.	.	H	α-helix	trans	-52.4	-43.7	-178.6	-69.6	-97.6	0	0	0	111.7	R989 M990 Y991 N1070	H987-R989 PolarHBondContact O-N 3.46Å; H987-M990 VanDerWaalsContact O-CB 3.25Å; H987-M990 WeakPolarHBondContact O-CB 3.25Å; H987-M990 PolarHBondContact O-N 3.35Å; H987-Y991 HydrophobicContact CB-CE2 4.16Å; H987-Y991 WeakPolarHBondContact O-CD2 3.48Å; H987-Y991 PolarHBondContact O-N 3.45Å; H987-N1070 PolarHBondContact CE1-OD1 3.48Å; H987-N1070 PolarHBondContact ND1-OD1 3.02Å
988	R	38.2	Very low	39.5	Very low	63 Å²	63	87.2 Å²	87.2	24%	0.238	42%	0.42	C	S	.	.	H	α-helix	trans	-60.8	-23.2	-179.7	-151.8	-163.2	-164.1	107.8	3.7	113.5	R935 L984 S986 Q992	R935-R988 PolarHBondContact NH2-O 2.75Å; L984-R988 WeakPolarHBondContact O-CB 3.41Å; S986-R988 VanDerWaalsContact C-N 3.27Å; S986-R988 PolarHBondContact O-N 3.32Å; R988-Q992 VanDerWaalsContact O-CD 3.32Å; R988-Q992 VanDerWaalsContact O-CG 3.24Å; R988-Q992 WeakPolarHBondContact O-CG 3.29Å; R988-Q992 PolarHBondContact O-NE2 2.96Å
989	R	44.2	Very low	40.3	Very low	125 Å²	125	80.5 Å²	80.5	47%	0.472	40%	0.395	S	S	.	.	H	α-helix	trans	-84.6	-26.7	173.6	-69.3	174.1	167.7	-153.8	-12.2	113.2	H985 S986 H987 Q992 R993	H985-R989 PolarHBondContact NE2-NH2 2.88Å; H985-R989 VanDerWaalsContact O-CD 3.32Å; H985-R989 WeakPolarHBondContact O-CD 3.4Å; H985-R989 WeakPolarHBondContact O-CG 3.43Å; S986-R989 WeakPolarHBondContact O-CB 3.17Å; S986-R989 PolarHBondContact O-N 3.41Å; H987-R989 PolarHBondContact O-N 3.46Å; R989-Q992 WeakPolarHBondContact O-CB 3.16Å; R989-Q992 PolarHBondContact O-N 2.7Å; R989-R993 PolarHBondContact O-N 2.81Å
990	M	46.2	Very low	41.4	Very low	38 Å²	38	74.7 Å²	74.7	19%	0.187	38%	0.375	C	S	.	.	H	α-helix	trans	-61.6	-58.1	174.5	-165.9	175.7	77.9	0	0	109.8	S986 H987 Q992 R993 Q994 N1070 V1073	S986-M990 PolarHBondContact O-N 3.18Å; H987-M990 VanDerWaalsContact O-CB 3.25Å; H987-M990 WeakPolarHBondContact O-CB 3.25Å; H987-M990 PolarHBondContact O-N 3.35Å; M990-Q992 PolarHBondContact O-N 2.89Å; M990-R993 PolarHBondContact O-N 2.87Å; M990-Q994 PolarHBondContact O-N 3.47Å; M990-N1070 WeakPolarHBondContact CE-OD1 3.4Å; M990-V1073 HydrophobicContact CE-CB 4.25Å; M990-V1073 HydrophobicContact CE-CG1 3.9Å; M990-V1073 HydrophobicContact CG-CG1 4.4Å; M990-V1073 HydrophobicContact SD-CG1 4.46Å
991	Y	47.6	Very low	42.7	Very low	13 Å²	13	65.3 Å²	65.3	5%	0.051	34%	0.335	C	S	.	.	H	α-helix	trans	-65.9	5.1	174.3	-49	-78.2	0	0	0	114.9	R935 H987 Y996 L1004 I1069 V1073	R935-Y991 VanDerWaalsContact CZ-O 3.27Å; R935-Y991 PolarHBondContact NH1-O 3.26Å; R935-Y991 PolarHBondContact NH2-O 2.95Å; H987-Y991 HydrophobicContact CB-CE2 4.16Å; H987-Y991 WeakPolarHBondContact O-CD2 3.48Å; H987-Y991 PolarHBondContact O-N 3.45Å; Y991-Y996 HydrophobicContact CD1-CD2 4.34Å; Y991-Y996 HydrophobicContact CD1-CE2 4.13Å; Y991-L1004 HydrophobicContact CD1-CD1 3.93Å; Y991-L1004 HydrophobicContact CE1-CD1 4.26Å; Y991-I1069 HydrophobicContact CE1-CG2 4.48Å; Y991-I1069 VanDerWaalsContact OH-CG2 3.31Å; Y991-I1069 WeakPolarHBondContact OH-CG2 3.13Å; Y991-V1073 HydrophobicContact CE1-CG2 3.91Å
992	Q	47.6	Very low	43.6	Very low	25 Å²	25	69 Å²	69	12%	0.117	33%	0.334	C	S	.	.	H	α-helix	trans	-93.1	-44.5	168.9	-74.3	169.7	39.7	0	0	111	R935 S938 R988 R989 M990 Q994 G995	R935-Q992 VanDerWaalsContact CA-CD 3.5Å; R935-Q992 HydrophobicContact CB-CG 4.28Å; R935-Q992 HydrophobicContact CG-CG 3.86Å; R935-Q992 VanDerWaalsContact NE-CG 3.27Å; R935-Q992 VanDerWaalsContact NH2-CG 3.33Å; S938-Q992 PolarHBondContact OG-O 3.33Å; R988-Q992 VanDerWaalsContact O-CD 3.32Å; R988-Q992 VanDerWaalsContact O-CG 3.24Å; R988-Q992 WeakPolarHBondContact O-CG 3.29Å; R988-Q992 PolarHBondContact O-NE2 2.96Å; R989-Q992 WeakPolarHBondContact O-CB 3.16Å; R989-Q992 PolarHBondContact O-N 2.7Å; M990-Q992 PolarHBondContact O-N 2.89Å; Q992-Q994 VanDerWaalsContact C-N 3.27Å; Q992-Q994 PolarHBondContact O-N 2.92Å; Q992-G995 PolarHBondContact O-N 2.8Å; Q992-G995 VanDerWaalsContact O-N 3.16Å
993	R	50.8	Low	44.6	Very low	181 Å²	181	68.2 Å²	68.2	68%	0.683	32%	0.32	S	S	*	.	H	α-helix	trans	-61.5	-40.3	-178.5	-70.1	169.5	170.8	-172.8	-8.9	110.9	S938 R989 M990 G995 T1081	S938-R993 VanDerWaalsContact OG-C 3.32Å; S938-R993 VanDerWaalsContact OG-CA 3.3Å; S938-R993 WeakPolarHBondContact OG-CA 3.47Å; S938-R993 PolarHBondContact OG-O 3.1Å; R989-R993 PolarHBondContact O-N 2.81Å; M990-R993 PolarHBondContact O-N 2.87Å; R993-G995 PolarHBondContact O-N 3.38Å; R993-G995 VanDerWaalsContact O-N 3.09Å; R993-T1081 VanDerWaalsContact O-O 3.08Å
994	Q	51.7	Low	45.9	Very low	9 Å²	9	60.7 Å²	60.7	4%	0.042	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	0.7	176.8	-58.5	-64.1	24.7	0	0	115.9	M990 Q992 Y996 V1073 L1083	M990-Q994 PolarHBondContact O-N 3.47Å; Q992-Q994 VanDerWaalsContact C-N 3.27Å; Q992-Q994 PolarHBondContact O-N 2.92Å; Q994-Y996 VanDerWaalsContact C-N 3.35Å; Q994-Y996 HydrophobicContact CB-CD2 3.68Å; Q994-Y996 HydrophobicContact CB-CE2 3.48Å; Q994-Y996 VanDerWaalsContact CB-CE2 3.48Å; Q994-Y996 HydrophobicContact CG-CE2 4.18Å; Q994-Y996 PolarHBondContact O-N 3.19Å; Q994-V1073 HydrophobicContact CG-CG1 4.17Å; Q994-V1073 PolarHBondContact NE2-O 3.02Å; Q994-L1083 HydrophobicContact CB-CD1 4.04Å; Q994-L1083 HydrophobicContact CB-CG 4.36Å; Q994-L1083 HydrophobicContact CG-CD1 4.38Å
995	G	50.8	Low	46.9	Very low	22 Å²	22	58.6 Å²	58.6	23%	0.227	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	19.6	171.4	0	0	0	0	0	116.2	Q992 R993 K1088	Q992-G995 PolarHBondContact O-N 2.8Å; Q992-G995 VanDerWaalsContact O-N 3.16Å; R993-G995 PolarHBondContact O-N 3.38Å; R993-G995 VanDerWaalsContact O-N 3.09Å; G995-K1088 PolarHBondContact O-NZ 3.4Å
996	Y	56.3	Low	47.5	Very low	9 Å²	9	56 Å²	56	4%	0.035	27%	0.269	C	S	.	.			trans	-64.3	137.1	175.1	-69.8	-75.8	0	0	0	112.5	R935 Y991 Q994 E1000 L1004 L1083 K1088 V1091 F1092	R935-Y996 PolarHBondContact NH1-O 2.82Å; R935-Y996 VanDerWaalsContact NH1-O 3.1Å; Y991-Y996 HydrophobicContact CD1-CD2 4.34Å; Y991-Y996 HydrophobicContact CD1-CE2 4.13Å; Q994-Y996 VanDerWaalsContact C-N 3.35Å; Q994-Y996 HydrophobicContact CB-CD2 3.68Å; Q994-Y996 HydrophobicContact CB-CE2 3.48Å; Q994-Y996 VanDerWaalsContact CB-CE2 3.48Å; Q994-Y996 HydrophobicContact CG-CE2 4.18Å; Q994-Y996 PolarHBondContact O-N 3.19Å; Y996-E1000 WeakPolarHBondContact CA-OE2 3.2Å; Y996-E1000 HydrophobicContact CD1-CB 3.99Å; Y996-E1000 WeakPolarHBondContact CD1-OE2 2.94Å; Y996-L1004 HydrophobicContact CD1-CD1 4.02Å; Y996-L1004 HydrophobicContact CD2-CD1 4.34Å; Y996-L1004 HydrophobicContact CE1-CD1 3.94Å; Y996-L1004 HydrophobicContact CE2-CD1 4.27Å; Y996-L1004 HydrophobicContact CG-CD1 4.22Å; Y996-L1083 HydrophobicContact CE1-CD1 4.42Å; Y996-L1083 HydrophobicContact CE2-CD1 3.95Å; Y996-L1083 WeakPolarHBondContact OH-CD1 3.29Å; Y996-K1088 HydrophobicContact CD1-CD 4.33Å; Y996-K1088 HydrophobicContact CD1-CG 4.46Å; Y996-K1088 HydrophobicContact CE1-CB 4.38Å; Y996-K1088 HydrophobicContact CE1-CD 4.5Å; Y996-K1088 HydrophobicContact CE1-CG 4.14Å; Y996-V1091 WeakPolarHBondContact OH-CB 3.32Å; Y996-V1091 WeakPolarHBondContact OH-CG1 3.34Å; Y996-F1092 AromaticContact CD1-CE2 3.72Å; Y996-F1092 HydrophobicContact CD1-CE2 3.72Å; Y996-F1092 HydrophobicContact CD1-CZ 4.3Å; Y996-F1092 HydrophobicContact CE1-CD2 4.19Å; Y996-F1092 AromaticContact CE1-CE2 3.59Å; Y996-F1092 HydrophobicContact CE1-CE2 3.59Å; Y996-F1092 HydrophobicContact CE1-CZ 4.3Å
997	T	51.7	Low	48.4	Very low	64 Å²	64	55.3 Å²	55.3	39%	0.393	26%	0.26	S	S	.	.			trans	-63.5	168.7	174.4	65.6	0	0	0	0	112.2	T999 E1000 L1001	T997-T999 PolarHBondContact O-N 3.07Å; T997-T999 PolarHBondContact OG1-N 2.92Å; T997-E1000 VanDerWaalsContact CB-OE1 3.24Å; T997-E1000 WeakPolarHBondContact CB-OE1 3.4Å; T997-E1000 WeakPolarHBondContact CG2-OE1 3.16Å; T997-E1000 PolarHBondContact N-OE2 2.67Å; T997-E1000 WeakPolarHBondContact OG1-CB 3.31Å; T997-E1000 VanDerWaalsContact OG1-CG 3.23Å; T997-E1000 WeakPolarHBondContact OG1-CG 3.37Å; T997-E1000 PolarHBondContact OG1-N 3.49Å; T997-E1000 VanDerWaalsContact OG1-N 3.15Å; T997-E1000 PolarHBondContact OG1-OE1 2.95Å; T997-L1001 WeakPolarHBondContact O-CB 3.31Å; T997-L1001 PolarHBondContact O-N 2.95Å
998	N	45.1	Very low	48.8	Very low	48 Å²	48	55.2 Å²	55.2	26%	0.257	26%	0.259	S	S	.	.	H	α-helix	trans	-63.5	-28.5	173.5	-93.4	-40.6	0	0	0	112.4	S919 R1002	S919-N998 PolarHBondContact OG-ND2 3.44Å; N998-R1002 VanDerWaalsContact O-CG 3.24Å; N998-R1002 WeakPolarHBondContact O-CG 3.45Å; N998-R1002 PolarHBondContact O-N 2.82Å; N998-R1002 VanDerWaalsContact O-N 3.09Å
999	T	46.1	Very low	48.9	Very low	55 Å²	55	54.5 Å²	54.5	34%	0.337	26%	0.264	S	S	.	.	H	α-helix	trans	-78.6	-48	178.9	-46.8	0	0	0	0	110.9	T997 L1001 R1002 L1003 F1038	T997-T999 PolarHBondContact O-N 3.07Å; T997-T999 PolarHBondContact OG1-N 2.92Å; T999-L1001 VanDerWaalsContact C-N 3.27Å; T999-L1001 PolarHBondContact O-N 2.84Å; T999-R1002 WeakPolarHBondContact O-CA 3.31Å; T999-R1002 WeakPolarHBondContact O-CB 3.22Å; T999-R1002 PolarHBondContact O-N 3.49Å; T999-L1003 WeakPolarHBondContact O-CG 3.43Å; T999-L1003 PolarHBondContact O-N 3.15Å; T999-F1038 HydrophobicContact CG2-CE1 4.33Å; T999-F1038 HydrophobicContact CG2-CZ 3.99Å
1000	E	53.9	Low	48.8	Very low	42 Å²	42	50.3 Å²	50.3	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-54.5	-42.4	170.3	-72.2	153.7	-126.2	0	0	111.9	Y996 T997 L1003 L1004 F1092	Y996-E1000 WeakPolarHBondContact CA-OE2 3.2Å; Y996-E1000 HydrophobicContact CD1-CB 3.99Å; Y996-E1000 WeakPolarHBondContact CD1-OE2 2.94Å; T997-E1000 VanDerWaalsContact CB-OE1 3.24Å; T997-E1000 WeakPolarHBondContact CB-OE1 3.4Å; T997-E1000 WeakPolarHBondContact CG2-OE1 3.16Å; T997-E1000 PolarHBondContact N-OE2 2.67Å; T997-E1000 WeakPolarHBondContact OG1-CB 3.31Å; T997-E1000 VanDerWaalsContact OG1-CG 3.23Å; T997-E1000 WeakPolarHBondContact OG1-CG 3.37Å; T997-E1000 PolarHBondContact OG1-N 3.49Å; T997-E1000 VanDerWaalsContact OG1-N 3.15Å; T997-E1000 PolarHBondContact OG1-OE1 2.95Å; E1000-L1003 PolarHBondContact O-N 2.62Å; E1000-L1004 WeakPolarHBondContact O-CG 3.38Å; E1000-L1004 PolarHBondContact O-N 2.76Å; E1000-F1092 HydrophobicContact CB-CE2 3.68Å; E1000-F1092 HydrophobicContact CB-CZ 3.56Å; E1000-F1092 HydrophobicContact CG-CE2 3.53Å; E1000-F1092 HydrophobicContact CG-CZ 3.82Å
1001	L	53.5	Low	48.7	Very low	8 Å²	8	49.1 Å²	49.1	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-44.2	173.4	-179.8	66.9	0	0	0	112.1	T997 T999 L1003 L1004 V1005	T997-L1001 WeakPolarHBondContact O-CB 3.31Å; T997-L1001 PolarHBondContact O-N 2.95Å; T999-L1001 VanDerWaalsContact C-N 3.27Å; T999-L1001 PolarHBondContact O-N 2.84Å; L1001-L1003 VanDerWaalsContact C-N 3.29Å; L1001-L1003 PolarHBondContact O-N 2.9Å; L1001-L1004 PolarHBondContact O-N 2.99Å; L1001-V1005 HydrophobicContact CD1-CG2 3.83Å; L1001-V1005 HydrophobicContact CG-CG2 4.12Å; L1001-V1005 VanDerWaalsContact O-CB 3.29Å; L1001-V1005 WeakPolarHBondContact O-CB 3.23Å; L1001-V1005 VanDerWaalsContact O-CG2 3.25Å; L1001-V1005 WeakPolarHBondContact O-CG2 3.44Å; L1001-V1005 PolarHBondContact O-N 2.86Å
1002	R	45.5	Very low	48.4	Very low	175 Å²	175	52.1 Å²	52.1	66%	0.66	27%	0.266	S	S	*	.	H	α-helix	trans	-59.5	-45	177.7	-76.5	169.8	-166.8	-165.4	6.2	109.5	N998 T999 V1005 L1006	N998-R1002 VanDerWaalsContact O-CG 3.24Å; N998-R1002 WeakPolarHBondContact O-CG 3.45Å; N998-R1002 PolarHBondContact O-N 2.82Å; N998-R1002 VanDerWaalsContact O-N 3.09Å; T999-R1002 WeakPolarHBondContact O-CA 3.31Å; T999-R1002 WeakPolarHBondContact O-CB 3.22Å; T999-R1002 PolarHBondContact O-N 3.49Å; R1002-V1005 PolarHBondContact O-N 3.16Å; R1002-L1006 WeakPolarHBondContact O-CB 3.24Å; R1002-L1006 PolarHBondContact O-N 3.33Å
1003	L	49	Very low	47.9	Very low	52 Å²	52	54.3 Å²	54.3	27%	0.272	28%	0.281	S	S	.	.	H	α-helix	trans	-60.9	-51.2	176.4	-68.4	165.9	0	0	0	112.2	T999 E1000 L1001 V1005 L1006 L1007 F1092	T999-L1003 WeakPolarHBondContact O-CG 3.43Å; T999-L1003 PolarHBondContact O-N 3.15Å; E1000-L1003 PolarHBondContact O-N 2.62Å; L1001-L1003 VanDerWaalsContact C-N 3.29Å; L1001-L1003 PolarHBondContact O-N 2.9Å; L1003-V1005 VanDerWaalsContact C-N 3.31Å; L1003-V1005 PolarHBondContact O-N 2.7Å; L1003-L1006 PolarHBondContact O-N 3.14Å; L1003-L1007 VanDerWaalsContact O-CB 3.31Å; L1003-L1007 WeakPolarHBondContact O-CB 3.21Å; L1003-L1007 WeakPolarHBondContact O-CG 3.35Å; L1003-L1007 PolarHBondContact O-N 2.85Å; L1003-F1092 HydrophobicContact CB-CE1 4.3Å
1004	L	53.4	Low	47.3	Very low	9 Å²	9	47.2 Å²	47.2	5%	0.047	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-35.5	177.3	-71.9	171	0	0	0	113	Y991 Y996 E1000 L1001 K1008 F1092 V1095	Y991-L1004 HydrophobicContact CD1-CD1 3.93Å; Y991-L1004 HydrophobicContact CE1-CD1 4.26Å; Y996-L1004 HydrophobicContact CD1-CD1 4.02Å; Y996-L1004 HydrophobicContact CD2-CD1 4.34Å; Y996-L1004 HydrophobicContact CE1-CD1 3.94Å; Y996-L1004 HydrophobicContact CE2-CD1 4.27Å; Y996-L1004 HydrophobicContact CG-CD1 4.22Å; E1000-L1004 WeakPolarHBondContact O-CG 3.38Å; E1000-L1004 PolarHBondContact O-N 2.76Å; L1001-L1004 PolarHBondContact O-N 2.99Å; L1004-K1008 WeakPolarHBondContact O-CB 3.41Å; L1004-K1008 PolarHBondContact O-N 3.24Å; L1004-F1092 HydrophobicContact CD1-CE1 4.38Å; L1004-F1092 HydrophobicContact CD1-CZ 3.87Å; L1004-F1092 HydrophobicContact CD2-CD1 4.37Å; L1004-F1092 HydrophobicContact CD2-CE1 3.76Å; L1004-F1092 HydrophobicContact CD2-CZ 4.1Å; L1004-F1092 HydrophobicContact CG-CE1 3.68Å; L1004-F1092 HydrophobicContact CG-CZ 3.63Å; L1004-V1095 HydrophobicContact CD2-CB 4.32Å; L1004-V1095 HydrophobicContact CD2-CG1 3.87Å; L1004-V1095 HydrophobicContact CD2-CG2 4.35Å
1005	V	48.8	Very low	46.6	Very low	68 Å²	68	47.7 Å²	47.7	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-74.8	-37.3	175.5	171.3	0	0	0	0	111.3	L1001 R1002 L1003 K1008 S1009	L1001-V1005 HydrophobicContact CD1-CG2 3.83Å; L1001-V1005 HydrophobicContact CG-CG2 4.12Å; L1001-V1005 VanDerWaalsContact O-CB 3.29Å; L1001-V1005 WeakPolarHBondContact O-CB 3.23Å; L1001-V1005 VanDerWaalsContact O-CG2 3.25Å; L1001-V1005 WeakPolarHBondContact O-CG2 3.44Å; L1001-V1005 PolarHBondContact O-N 2.86Å; R1002-V1005 PolarHBondContact O-N 3.16Å; L1003-V1005 VanDerWaalsContact C-N 3.31Å; L1003-V1005 PolarHBondContact O-N 2.7Å; V1005-K1008 PolarHBondContact O-N 2.97Å; V1005-S1009 WeakPolarHBondContact O-CB 3.23Å; V1005-S1009 PolarHBondContact O-N 3.13Å; V1005-S1009 PolarHBondContact O-OG 2.76Å
1006	L	45.3	Very low	45.8	Very low	73 Å²	73	48.6 Å²	48.6	38%	0.382	27%	0.265	S	S	.	.	H	α-helix	trans	-67	-49.5	177.8	-165	90.6	0	0	0	110.2	R1002 L1003 K1008 S1009 A1010	R1002-L1006 WeakPolarHBondContact O-CB 3.24Å; R1002-L1006 PolarHBondContact O-N 3.33Å; L1003-L1006 PolarHBondContact O-N 3.14Å; L1006-K1008 PolarHBondContact O-N 3.26Å; L1006-S1009 WeakPolarHBondContact CA-OG 3.42Å; L1006-S1009 CarbonylContact O-C 3.43Å; L1006-S1009 PolarHBondContact O-N 2.84Å; L1006-S1009 PolarHBondContact O-OG 3.41Å; L1006-A1010 WeakPolarHBondContact O-CB 2.98Å; L1006-A1010 PolarHBondContact O-N 2.63Å
1007	L	51	Low	44.6	Very low	48 Å²	48	50.7 Å²	50.7	25%	0.251	28%	0.276	S	S	.	.	H	α-helix	trans	-54.2	-50.2	171	-78.9	162.7	0	0	0	110.8	L1003 S1009 A1010 C1011	L1003-L1007 VanDerWaalsContact O-CB 3.31Å; L1003-L1007 WeakPolarHBondContact O-CB 3.21Å; L1003-L1007 WeakPolarHBondContact O-CG 3.35Å; L1003-L1007 PolarHBondContact O-N 2.85Å; L1007-S1009 VanDerWaalsContact C-N 3.35Å; L1007-S1009 PolarHBondContact O-N 2.97Å; L1007-A1010 PolarHBondContact O-N 2.81Å; L1007-C1011 WeakPolarHBondContact O-CB 3.36Å; L1007-C1011 PolarHBondContact O-N 2.96Å; L1007-C1011 PolarHBondContact O-SG 3.1Å; L1007-C1011 VanDerWaalsContact O-SG 3.32Å
1008	K	48.4	Very low	43.9	Very low	33 Å²	33	48.2 Å²	48.2	14%	0.143	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-42.1	176.9	-175.4	174	-177.1	-68.4	0	112.1	L1004 V1005 L1006 E1012	L1004-K1008 WeakPolarHBondContact O-CB 3.41Å; L1004-K1008 PolarHBondContact O-N 3.24Å; V1005-K1008 PolarHBondContact O-N 2.97Å; L1006-K1008 PolarHBondContact O-N 3.26Å; K1008-E1012 HydrophobicContact CG-CG 4.46Å; K1008-E1012 IonicContact NZ-OE1 3.53Å; K1008-E1012 PolarHBondContact NZ-OE1 3.16Å; K1008-E1012 IonicContact NZ-OE2 2.67Å; K1008-E1012 PolarHBondContact NZ-OE2 3.08Å; K1008-E1012 VanDerWaalsContact O-CB 3.25Å; K1008-E1012 WeakPolarHBondContact O-CB 3.29Å; K1008-E1012 VanDerWaalsContact O-CG 3.3Å; K1008-E1012 WeakPolarHBondContact O-CG 3.49Å; K1008-E1012 PolarHBondContact O-N 2.97Å
1009	S	40	Very low	43.6	Very low	48 Å²	48	50.9 Å²	50.9	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-72	-33.5	177.4	56.8	0	0	0	0	113.3	V1005 L1006 L1007 E1012 V1013	V1005-S1009 WeakPolarHBondContact O-CB 3.23Å; V1005-S1009 PolarHBondContact O-N 3.13Å; V1005-S1009 PolarHBondContact O-OG 2.76Å; L1006-S1009 WeakPolarHBondContact CA-OG 3.42Å; L1006-S1009 CarbonylContact O-C 3.43Å; L1006-S1009 PolarHBondContact O-N 2.84Å; L1006-S1009 PolarHBondContact O-OG 3.41Å; L1007-S1009 VanDerWaalsContact C-N 3.35Å; L1007-S1009 PolarHBondContact O-N 2.97Å; S1009-E1012 PolarHBondContact O-N 2.97Å; S1009-V1013 VanDerWaalsContact O-CB 3.24Å; S1009-V1013 WeakPolarHBondContact O-CB 3.21Å; S1009-V1013 WeakPolarHBondContact O-CG2 3.19Å; S1009-V1013 PolarHBondContact O-N 3.4Å
1010	A	42.6	Very low	43.3	Very low	36 Å²	36	49 Å²	49	30%	0.298	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-52.6	173.6	0	0	0	0	0	109.3	L1006 L1007 E1012 V1013 V1014	L1006-A1010 WeakPolarHBondContact O-CB 2.98Å; L1006-A1010 PolarHBondContact O-N 2.63Å; L1007-A1010 PolarHBondContact O-N 2.81Å; A1010-E1012 VanDerWaalsContact C-N 3.32Å; A1010-E1012 PolarHBondContact O-N 2.85Å; A1010-V1013 PolarHBondContact O-N 3.24Å; A1010-V1014 VanDerWaalsContact O-CB 3.29Å; A1010-V1014 WeakPolarHBondContact O-CB 3.22Å; A1010-V1014 VanDerWaalsContact O-CG2 3.24Å; A1010-V1014 WeakPolarHBondContact O-CG2 3.3Å; A1010-V1014 PolarHBondContact O-N 2.88Å
1011	C	44.6	Very low	42.4	Very low	14 Å²	14	50.3 Å²	50.3	10%	0.095	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-37.5	175.6	-65	0	0	0	0	112.5	L1007 S1015 V1065	L1007-C1011 WeakPolarHBondContact O-CB 3.36Å; L1007-C1011 PolarHBondContact O-N 2.96Å; L1007-C1011 PolarHBondContact O-SG 3.1Å; L1007-C1011 VanDerWaalsContact O-SG 3.32Å; C1011-S1015 WeakPolarHBondContact O-CB 3.3Å; C1011-S1015 PolarHBondContact O-N 3.39Å; C1011-S1015 PolarHBondContact O-OG 2.84Å; C1011-V1065 HydrophobicContact CB-CG1 3.95Å; C1011-V1065 HydrophobicContact CB-CG2 4.43Å
1012	E	41.5	Very low	41.5	Very low	75 Å²	75	52.1 Å²	52.1	35%	0.35	28%	0.281	S	S	.	.	H	α-helix	trans	-71.9	-37.4	175.3	-78.4	179.1	145.5	0	0	113.3	K1008 S1009 A1010 S1016	K1008-E1012 HydrophobicContact CG-CG 4.46Å; K1008-E1012 IonicContact NZ-OE1 3.53Å; K1008-E1012 PolarHBondContact NZ-OE1 3.16Å; K1008-E1012 IonicContact NZ-OE2 2.67Å; K1008-E1012 PolarHBondContact NZ-OE2 3.08Å; K1008-E1012 VanDerWaalsContact O-CB 3.25Å; K1008-E1012 WeakPolarHBondContact O-CB 3.29Å; K1008-E1012 VanDerWaalsContact O-CG 3.3Å; K1008-E1012 WeakPolarHBondContact O-CG 3.49Å; K1008-E1012 PolarHBondContact O-N 2.97Å; S1009-E1012 PolarHBondContact O-N 2.97Å; A1010-E1012 VanDerWaalsContact C-N 3.32Å; A1010-E1012 PolarHBondContact O-N 2.85Å; E1012-S1016 WeakPolarHBondContact O-CB 3.48Å; E1012-S1016 PolarHBondContact O-N 3.11Å; E1012-S1016 PolarHBondContact O-OG 2.93Å
1013	V	35.7	Very low	41.1	Very low	72 Å²	72	47.1 Å²	47.1	44%	0.436	27%	0.267	S	S	.	.	H	α-helix	trans	-72.1	-47.9	176.5	167.9	0	0	0	0	110.7	S1009 A1010 S1016 I1017	S1009-V1013 VanDerWaalsContact O-CB 3.24Å; S1009-V1013 WeakPolarHBondContact O-CB 3.21Å; S1009-V1013 WeakPolarHBondContact O-CG2 3.19Å; S1009-V1013 PolarHBondContact O-N 3.4Å; A1010-V1013 PolarHBondContact O-N 3.24Å; V1013-S1016 PolarHBondContact O-N 3.07Å; V1013-S1016 VanDerWaalsContact O-N 3.14Å; V1013-S1016 PolarHBondContact O-OG 2.92Å; V1013-I1017 HydrophobicContact CG1-CD1 4.18Å; V1013-I1017 PolarHBondContact O-N 3.01Å
1014	V	38.8	Very low	40.5	Very low	31 Å²	31	46.4 Å²	46.4	19%	0.188	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-48.5	176.8	174.9	0	0	0	0	110.6	A1010 S1016 F1018 L1027	A1010-V1014 VanDerWaalsContact O-CB 3.29Å; A1010-V1014 WeakPolarHBondContact O-CB 3.22Å; A1010-V1014 VanDerWaalsContact O-CG2 3.24Å; A1010-V1014 WeakPolarHBondContact O-CG2 3.3Å; A1010-V1014 PolarHBondContact O-N 2.88Å; V1014-S1016 PolarHBondContact O-N 3.12Å; V1014-F1018 CarbonylContact O-C 3.6Å; V1014-F1018 VanDerWaalsContact O-C 3.29Å; V1014-F1018 WeakPolarHBondContact O-CA 3.34Å; V1014-F1018 PolarHBondContact O-N 3.48Å; V1014-L1027 HydrophobicContact CG2-CD1 3.82Å
1015	S	36.3	Very low	39.8	Very low	20 Å²	20	49.7 Å²	49.7	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-75.6	-3	176.5	70.2	0	0	0	0	115.3	C1011 R1062	C1011-S1015 WeakPolarHBondContact O-CB 3.3Å; C1011-S1015 PolarHBondContact O-N 3.39Å; C1011-S1015 PolarHBondContact O-OG 2.84Å; S1015-R1062 WeakPolarHBondContact O-CG 3.08Å
1016	S	33.6	Very low	39.4	Very low	41 Å²	41	47.1 Å²	47.1	29%	0.287	27%	0.271	S	S	.	.	H	α-helix	trans	-108.4	-23.3	174.4	64.3	0	0	0	0	115.1	E1012 V1013 V1014 R1062	E1012-S1016 WeakPolarHBondContact O-CB 3.48Å; E1012-S1016 PolarHBondContact O-N 3.11Å; E1012-S1016 PolarHBondContact O-OG 2.93Å; V1013-S1016 PolarHBondContact O-N 3.07Å; V1013-S1016 VanDerWaalsContact O-N 3.14Å; V1013-S1016 PolarHBondContact O-OG 2.92Å; V1014-S1016 PolarHBondContact O-N 3.12Å; S1016-R1062 PolarHBondContact O-NH2 3.4Å
1017	I	32.9	Very low	39.3	Very low	52 Å²	52	45 Å²	45	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-121.6	-29.3	-176.1	-48.8	-179.7	0	0	0	112.3	V1013 V1146	V1013-I1017 HydrophobicContact CG1-CD1 4.18Å; V1013-I1017 PolarHBondContact O-N 3.01Å; I1017-V1146 HydrophobicContact CG2-CG2 3.74Å
1018	F	35.1	Very low	39	Very low	13 Å²	13	43.8 Å²	43.8	6%	0.057	26%	0.255	C	S	.	.			trans	-133	71.4	-168.2	-54.3	-84.6	0	0	0	113.8	V1014 G1020 W1021 Y1022 A1142 N1145	V1014-F1018 CarbonylContact O-C 3.6Å; V1014-F1018 VanDerWaalsContact O-C 3.29Å; V1014-F1018 WeakPolarHBondContact O-CA 3.34Å; V1014-F1018 PolarHBondContact O-N 3.48Å; F1018-G1020 PolarHBondContact O-N 3.06Å; F1018-W1021 HydrophobicContact CD1-CB 4.49Å; F1018-W1021 WeakPolarHBondContact CD1-O 3.34Å; F1018-Y1022 HydrophobicContact CB-CD2 3.93Å; F1018-Y1022 HydrophobicContact CB-CE2 4.13Å; F1018-Y1022 HydrophobicContact CD1-CD2 4.09Å; F1018-Y1022 AromaticContact CD1-CE2 3.74Å; F1018-Y1022 HydrophobicContact CD1-CE2 3.74Å; F1018-Y1022 HydrophobicContact CD2-CD2 4.05Å; F1018-Y1022 AromaticContact CD2-CE2 3.37Å; F1018-Y1022 HydrophobicContact CD2-CE2 3.37Å; F1018-Y1022 AromaticContact CE1-CE2 3.9Å; F1018-Y1022 HydrophobicContact CE1-CE2 3.9Å; F1018-Y1022 AromaticContact CE2-CE2 3.55Å; F1018-Y1022 HydrophobicContact CE2-CE2 3.55Å; F1018-Y1022 AromaticContact CE2-CZ 3.99Å; F1018-Y1022 AromaticContact CG-CD2 3.77Å; F1018-Y1022 HydrophobicContact CG-CD2 3.77Å; F1018-Y1022 AromaticContact CG-CE2 3.47Å; F1018-Y1022 HydrophobicContact CG-CE2 3.47Å; F1018-Y1022 VanDerWaalsContact CG-CE2 3.47Å; F1018-Y1022 AromaticContact CZ-CE2 3.81Å; F1018-Y1022 HydrophobicContact CZ-CE2 3.81Å; F1018-Y1022 AromaticContact CZ-CZ 3.87Å; F1018-Y1022 WeakPolarHBondContact CZ-OH 3.42Å; F1018-A1142 HydrophobicContact CZ-CB 4.15Å; F1018-N1145 HydrophobicContact CD1-CB 4.15Å; F1018-N1145 HydrophobicContact CE1-CB 3.79Å; F1018-N1145 WeakPolarHBondContact CE1-ND2 3.49Å
1019	P	39.1	Very low	38.9	Very low	103 Å²	103	45 Å²	45	67%	0.669	26%	0.261	S	S	*	.	S	Bend	trans	-71.3	71.4	169.6	32.7	-35.4	0	0	0	111.1
1020	G	39.8	Very low	38.9	Very low	15 Å²	15	47 Å²	47	16%	0.155	27%	0.266	C	S	.	.	S	Bend	trans	97.1	25	174.4	0	0	0	0	0	116.5	F1018 R1058	F1018-G1020 PolarHBondContact O-N 3.06Å; G1020-R1058 VanDerWaalsContact CA-CD 3.49Å; G1020-R1058 PolarHBondContact O-NE 3.16Å; G1020-R1058 PolarHBondContact O-NH1 3.42Å; G1020-R1058 PolarHBondContact O-NH2 2.86Å
1021	W	36.2	Very low	39.1	Very low	70 Å²	70	48.2 Å²	48.2	27%	0.265	27%	0.267	S	S	.	.			trans	-124.1	60.5	179	-75.2	50.2	0	0	0	111.2	F1018 N1145 V1148 M1330	F1018-W1021 HydrophobicContact CD1-CB 4.49Å; F1018-W1021 WeakPolarHBondContact CD1-O 3.34Å; W1021-N1145 HydrophobicContact CE3-CB 4.14Å; W1021-N1145 WeakPolarHBondContact CZ3-OD1 3.44Å; W1021-V1148 HydrophobicContact CH2-CB 4.01Å; W1021-V1148 HydrophobicContact CH2-CG1 3.67Å; W1021-V1148 HydrophobicContact CH2-CG2 4.12Å; W1021-V1148 HydrophobicContact CZ2-CG1 4.23Å; W1021-V1148 HydrophobicContact CZ3-CB 4.48Å; W1021-V1148 HydrophobicContact CZ3-CG2 4.46Å; W1021-M1330 HydrophobicContact CB-CE 4.4Å; W1021-M1330 HydrophobicContact CD2-CE 2.35Å; W1021-M1330 HydrophobicContact CD2-CG 3.95Å; W1021-M1330 HydrophobicContact CD2-SD 2.48Å; W1021-M1330 HydrophobicContact CE3-CB 4.16Å; W1021-M1330 HydrophobicContact CE3-CE 2.35Å; W1021-M1330 HydrophobicContact CE3-CG 3.18Å; W1021-M1330 HydrophobicContact CE3-SD 2.46Å; W1021-M1330 HydrophobicContact CG-CE 3.41Å; W1021-M1330 VanDerWaalsContact CG-CE 3.41Å; W1021-M1330 HydrophobicContact CG-SD 3.7Å; W1021-M1330 HydrophobicContact CH2-CB 3.25Å; W1021-M1330 HydrophobicContact CH2-CE 2.34Å; W1021-M1330 HydrophobicContact CH2-CG 3.22Å; W1021-M1330 HydrophobicContact CH2-SD 2.46Å; W1021-M1330 WeakPolarHBondContact CH2-SD 3.33Å; W1021-M1330 HydrophobicContact CZ2-CB 4.38Å; W1021-M1330 HydrophobicContact CZ2-CE 2.35Å; W1021-M1330 HydrophobicContact CZ2-CG 3.97Å; W1021-M1330 HydrophobicContact CZ2-SD 2.47Å; W1021-M1330 WeakPolarHBondContact CZ2-SD 3.42Å; W1021-M1330 HydrophobicContact CZ3-CB 3.13Å; W1021-M1330 HydrophobicContact CZ3-CE 2.32Å; W1021-M1330 HydrophobicContact CZ3-CG 2.76Å; W1021-M1330 HydrophobicContact CZ3-SD 2.48Å; W1021-M1330 WeakPolarHBondContact CZ3-SD 3.5Å
1022	Y	33.5	Very low	39	Very low	47 Å²	47	54.8 Å²	54.8	18%	0.184	29%	0.29	C	S	.	.			trans	-146.5	147.6	162.2	-92.7	-61.6	0	0	0	109.7	F1018 T1026 R1058	F1018-Y1022 HydrophobicContact CB-CD2 3.93Å; F1018-Y1022 HydrophobicContact CB-CE2 4.13Å; F1018-Y1022 HydrophobicContact CD1-CD2 4.09Å; F1018-Y1022 AromaticContact CD1-CE2 3.74Å; F1018-Y1022 HydrophobicContact CD1-CE2 3.74Å; F1018-Y1022 HydrophobicContact CD2-CD2 4.05Å; F1018-Y1022 AromaticContact CD2-CE2 3.37Å; F1018-Y1022 HydrophobicContact CD2-CE2 3.37Å; F1018-Y1022 AromaticContact CE1-CE2 3.9Å; F1018-Y1022 HydrophobicContact CE1-CE2 3.9Å; F1018-Y1022 AromaticContact CE2-CE2 3.55Å; F1018-Y1022 HydrophobicContact CE2-CE2 3.55Å; F1018-Y1022 AromaticContact CE2-CZ 3.99Å; F1018-Y1022 AromaticContact CG-CD2 3.77Å; F1018-Y1022 HydrophobicContact CG-CD2 3.77Å; F1018-Y1022 AromaticContact CG-CE2 3.47Å; F1018-Y1022 HydrophobicContact CG-CE2 3.47Å; F1018-Y1022 VanDerWaalsContact CG-CE2 3.47Å; F1018-Y1022 AromaticContact CZ-CE2 3.81Å; F1018-Y1022 HydrophobicContact CZ-CE2 3.81Å; F1018-Y1022 AromaticContact CZ-CZ 3.87Å; F1018-Y1022 WeakPolarHBondContact CZ-OH 3.42Å; Y1022-T1026 HydrophobicContact CD1-CG2 3.94Å; Y1022-T1026 HydrophobicContact CE1-CG2 3.98Å; Y1022-R1058 PolarHBondContact O-NH2 3Å
1023	D	36.8	Very low	39	Very low	70 Å²	70	59.2 Å²	59.2	37%	0.374	30%	0.303	S	S	.	.			trans	-74.6	152.1	153.8	138.7	74.3	0	0	0	109.4	S1025 T1026	D1023-S1025 VanDerWaalsContact CG-N 3.3Å; D1023-S1025 WeakPolarHBondContact OD1-CB 3.03Å; D1023-S1025 PolarHBondContact OD1-N 3.1Å; D1023-S1025 PolarHBondContact OD1-OG 2.85Å; D1023-S1025 WeakPolarHBondContact OD2-CA 3.21Å; D1023-S1025 VanDerWaalsContact OD2-CB 3.29Å; D1023-S1025 WeakPolarHBondContact OD2-CB 3.39Å; D1023-S1025 PolarHBondContact OD2-N 2.9Å; D1023-S1025 VanDerWaalsContact OD2-N 3.15Å; D1023-T1026 WeakPolarHBondContact OD2-CB 3.49Å; D1023-T1026 PolarHBondContact OD2-N 3.14Å; D1023-T1026 PolarHBondContact OD2-OG1 3.24Å
1024	L	36.9	Very low	39.2	Very low	37 Å²	37	62.2 Å²	62.2	19%	0.194	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-45.3	-178.1	-163.9	62.3	0	0	0	113.8	T1026 L1027 V1028 L1054 S1055	L1024-T1026 PolarHBondContact O-N 2.89Å; L1024-L1027 WeakPolarHBondContact O-CA 3.43Å; L1024-L1027 WeakPolarHBondContact O-CB 3.24Å; L1024-L1027 PolarHBondContact O-N 2.83Å; L1024-V1028 WeakPolarHBondContact O-CG2 3.38Å; L1024-V1028 PolarHBondContact O-N 2.92Å; L1024-L1054 VanDerWaalsContact CD1-C 3.44Å; L1024-L1054 HydrophobicContact CD1-CB 3.56Å; L1024-L1054 HydrophobicContact CD1-CD1 3.74Å; L1024-L1054 HydrophobicContact CD1-CD2 3.67Å; L1024-L1054 HydrophobicContact CD1-CG 3.79Å; L1024-L1054 WeakPolarHBondContact CD1-O 3.32Å; L1024-L1054 HydrophobicContact CD2-CB 3.89Å; L1024-L1054 HydrophobicContact CG-CB 4.08Å; L1024-L1054 HydrophobicContact CG-CD1 4.4Å; L1024-S1055 VanDerWaalsContact CD2-N 3.35Å
1025	S	38.9	Very low	39.3	Very low	78 Å²	78	63.2 Å²	63.2	55%	0.545	32%	0.316	S	S	.	.	H	α-helix	trans	-58.9	-37.2	-176.8	-35.5	0	0	0	0	110.3	D1023 V1028 E1029	D1023-S1025 VanDerWaalsContact CG-N 3.3Å; D1023-S1025 WeakPolarHBondContact OD1-CB 3.03Å; D1023-S1025 PolarHBondContact OD1-N 3.1Å; D1023-S1025 PolarHBondContact OD1-OG 2.85Å; D1023-S1025 WeakPolarHBondContact OD2-CA 3.21Å; D1023-S1025 VanDerWaalsContact OD2-CB 3.29Å; D1023-S1025 WeakPolarHBondContact OD2-CB 3.39Å; D1023-S1025 PolarHBondContact OD2-N 2.9Å; D1023-S1025 VanDerWaalsContact OD2-N 3.15Å; S1025-V1028 PolarHBondContact O-N 3.23Å; S1025-E1029 WeakPolarHBondContact O-CB 3.26Å; S1025-E1029 PolarHBondContact O-N 3.25Å
1026	T	40.4	Very low	39.2	Very low	13 Å²	13	65.1 Å²	65.1	8%	0.08	33%	0.328	C	S	.	.	H	α-helix	trans	-63.2	-43.2	174	-52.6	0	0	0	0	112.1	Y1022 D1023 L1024 M1030	Y1022-T1026 HydrophobicContact CD1-CG2 3.94Å; Y1022-T1026 HydrophobicContact CE1-CG2 3.98Å; D1023-T1026 WeakPolarHBondContact OD2-CB 3.49Å; D1023-T1026 PolarHBondContact OD2-N 3.14Å; D1023-T1026 PolarHBondContact OD2-OG1 3.24Å; L1024-T1026 PolarHBondContact O-N 2.89Å; T1026-M1030 WeakPolarHBondContact O-CG 3.35Å; T1026-M1030 PolarHBondContact O-N 2.84Å
1027	L	44.3	Very low	39.2	Very low	28 Å²	28	67 Å²	67	15%	0.147	35%	0.346	C	S	.	.	H	α-helix	trans	-67.5	-41.8	176.1	-161.7	84.4	0	0	0	111.2	V1014 L1024 M1030 I1031	V1014-L1027 HydrophobicContact CG2-CD1 3.82Å; L1024-L1027 WeakPolarHBondContact O-CA 3.43Å; L1024-L1027 WeakPolarHBondContact O-CB 3.24Å; L1024-L1027 PolarHBondContact O-N 2.83Å; L1027-M1030 PolarHBondContact O-N 3.34Å; L1027-I1031 HydrophobicContact CG-CD1 4.41Å; L1027-I1031 VanDerWaalsContact O-CG1 3.31Å; L1027-I1031 WeakPolarHBondContact O-CG1 3.28Å; L1027-I1031 PolarHBondContact O-N 3.03Å
1028	V	44.5	Very low	39.6	Very low	24 Å²	24	69.9 Å²	69.9	15%	0.145	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-42.1	176.4	174.2	0	0	0	0	111	L1024 S1025 I1031 R1032 V1050 L1054	L1024-V1028 WeakPolarHBondContact O-CG2 3.38Å; L1024-V1028 PolarHBondContact O-N 2.92Å; S1025-V1028 PolarHBondContact O-N 3.23Å; V1028-I1031 CarbonylContact O-C 3.24Å; V1028-I1031 WeakPolarHBondContact O-CB 3.1Å; V1028-I1031 PolarHBondContact O-N 3.21Å; V1028-R1032 WeakPolarHBondContact O-CB 3.48Å; V1028-R1032 PolarHBondContact O-N 3.18Å; V1028-V1050 HydrophobicContact CG1-CG1 4.35Å; V1028-V1050 HydrophobicContact CG2-CG1 3.82Å; V1028-L1054 HydrophobicContact CG2-CD1 4.19Å
1029	E	45.6	Very low	39.6	Very low	58 Å²	58	72.5 Å²	72.5	27%	0.271	37%	0.371	S	S	.	.	H	α-helix	trans	-72	-33.5	179.2	-170.6	61	-168.2	0	0	112.6	S1025 I1031 R1032 R1033	S1025-E1029 WeakPolarHBondContact O-CB 3.26Å; S1025-E1029 PolarHBondContact O-N 3.25Å; E1029-I1031 VanDerWaalsContact C-N 3.3Å; E1029-I1031 PolarHBondContact O-N 3.32Å; E1029-R1032 PolarHBondContact O-N 3.2Å; E1029-R1032 IonicContact OE1-CZ 2.79Å; E1029-R1032 IonicContact OE1-NE 2.77Å; E1029-R1032 IonicContact OE1-NH2 2.76Å; E1029-R1032 PolarHBondContact OE1-NH2 2.93Å; E1029-R1032 IonicContact OE2-CZ 3.93Å; E1029-R1032 IonicContact OE2-NE 2.68Å; E1029-R1032 PolarHBondContact OE2-NE 2.9Å; E1029-R1032 IonicContact OE2-NH2 3.75Å; E1029-R1032 PolarHBondContact OE2-NH2 3.19Å; E1029-R1033 HydrophobicContact CG-CG 4.49Å; E1029-R1033 WeakPolarHBondContact O-CB 3.45Å; E1029-R1033 PolarHBondContact O-N 2.89Å; E1029-R1033 IonicContact OE1-NE 2.8Å
1030	M	40.2	Very low	39.6	Very low	89 Å²	89	71.2 Å²	71.2	44%	0.438	36%	0.361	S	S	.	.	H	α-helix	trans	-62.6	-36.7	168.3	-76.5	-174.9	68.2	0	0	112.3	T1026 L1027 H1034	T1026-M1030 WeakPolarHBondContact O-CG 3.35Å; T1026-M1030 PolarHBondContact O-N 2.84Å; L1027-M1030 PolarHBondContact O-N 3.34Å; M1030-H1034 PolarHBondContact O-CD2 3.36Å
1031	I	46.3	Very low	39.4	Very low	63 Å²	63	80.5 Å²	80.5	32%	0.323	39%	0.392	S	S	.	.	H	α-helix	trans	-70.2	-43.4	173.6	-70.5	165.8	0	0	0	110.1	L1027 V1028 E1029 H1034 L1035	L1027-I1031 HydrophobicContact CG-CD1 4.41Å; L1027-I1031 VanDerWaalsContact O-CG1 3.31Å; L1027-I1031 WeakPolarHBondContact O-CG1 3.28Å; L1027-I1031 PolarHBondContact O-N 3.03Å; V1028-I1031 CarbonylContact O-C 3.24Å; V1028-I1031 WeakPolarHBondContact O-CB 3.1Å; V1028-I1031 PolarHBondContact O-N 3.21Å; E1029-I1031 VanDerWaalsContact C-N 3.3Å; E1029-I1031 PolarHBondContact O-N 3.32Å; I1031-H1034 CarbonylContact O-C 3.52Å; I1031-H1034 PolarHBondContact O-N 3.37Å; I1031-L1035 HydrophobicContact CG2-CD1 3.78Å; I1031-L1035 WeakPolarHBondContact O-CD1 3.25Å; I1031-L1035 PolarHBondContact O-N 2.91Å
1032	R	43.2	Very low	39.3	Very low	152 Å²	152	84.4 Å²	84.4	57%	0.574	41%	0.413	S	S	*	.	H	α-helix	trans	-64.5	-45.5	-179	-159.3	177.6	71.7	117.8	4.5	112.4	V1028 E1029 H1034 L1035	V1028-R1032 WeakPolarHBondContact O-CB 3.48Å; V1028-R1032 PolarHBondContact O-N 3.18Å; E1029-R1032 PolarHBondContact O-N 3.2Å; E1029-R1032 IonicContact OE1-CZ 2.79Å; E1029-R1032 IonicContact OE1-NE 2.77Å; E1029-R1032 IonicContact OE1-NH2 2.76Å; E1029-R1032 PolarHBondContact OE1-NH2 2.93Å; E1029-R1032 IonicContact OE2-CZ 3.93Å; E1029-R1032 IonicContact OE2-NE 2.68Å; E1029-R1032 PolarHBondContact OE2-NE 2.9Å; E1029-R1032 IonicContact OE2-NH2 3.75Å; E1029-R1032 PolarHBondContact OE2-NH2 3.19Å; R1032-H1034 PolarHBondContact O-N 3.19Å; R1032-H1034 VanDerWaalsContact O-N 3.16Å; R1032-L1035 PolarHBondContact O-N 3.5Å
1033	R	40.9	Very low	39	Very low	168 Å²	168	85.1 Å²	85.1	63%	0.634	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.6	175.7	-79.3	-179	166.6	171.4	-3.8	114.5	E1029	E1029-R1033 HydrophobicContact CG-CG 4.49Å; E1029-R1033 WeakPolarHBondContact O-CB 3.45Å; E1029-R1033 PolarHBondContact O-N 2.89Å; E1029-R1033 IonicContact OE1-NE 2.8Å
1034	H	38.8	Very low	38.9	Very low	135 Å²	135	85.9 Å²	85.9	63%	0.625	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	5.8	-179.4	-64.1	-28.6	0	0	0	113.9	M1030 I1031 R1032	M1030-H1034 PolarHBondContact O-CD2 3.36Å; I1031-H1034 CarbonylContact O-C 3.52Å; I1031-H1034 PolarHBondContact O-N 3.37Å; R1032-H1034 PolarHBondContact O-N 3.19Å; R1032-H1034 VanDerWaalsContact O-N 3.16Å
1035	L	41.5	Very low	39.1	Very low	52 Å²	52	87 Å²	87	27%	0.272	46%	0.456	S	S	.	.	S	Bend	trans	-81.2	133.1	169.8	-120.2	71.3	0	0	0	110.6	I1031 R1032 L1039	I1031-L1035 HydrophobicContact CG2-CD1 3.78Å; I1031-L1035 WeakPolarHBondContact O-CD1 3.25Å; I1031-L1035 PolarHBondContact O-N 2.91Å; R1032-L1035 PolarHBondContact O-N 3.5Å; L1035-L1039 HydrophobicContact CD2-CB 3.89Å; L1035-L1039 HydrophobicContact CD2-CD1 4.14Å; L1035-L1039 HydrophobicContact CG-CB 4.37Å; L1035-L1039 HydrophobicContact CG-CD1 4Å
1036	P	34.8	Very low	38.9	Very low	60 Å²	60	87.1 Å²	87.1	39%	0.39	45%	0.453	S	S	.	.			trans	-64	139	172.1	-23.5	34.6	0	0	0	112.5	F1038 L1039	P1036-F1038 HydrophobicContact CB-CD1 3.7Å; P1036-F1038 HydrophobicContact CB-CE1 3.68Å; P1036-F1038 HydrophobicContact CG-CE1 4.19Å; P1036-F1038 PolarHBondContact O-N 2.91Å; P1036-L1039 PolarHBondContact O-N 3.43Å
1037	A	34.4	Very low	38.7	Very low	79 Å²	79	90.1 Å²	90.1	65%	0.653	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	7.4	-173.7	0	0	0	0	0	117	T1040	A1037-T1040 WeakPolarHBondContact CA-OG1 3.26Å; A1037-T1040 PolarHBondContact O-OG1 3.02Å; A1037-T1040 VanDerWaalsContact O-OG1 3.07Å
1038	F	40.7	Very low	38.6	Very low	114 Å²	114	92.1 Å²	92.1	50%	0.5	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-24.3	167.5	80.7	-93.5	0	0	0	112.2	T999 P1036 T1040	T999-F1038 HydrophobicContact CG2-CE1 4.33Å; T999-F1038 HydrophobicContact CG2-CZ 3.99Å; P1036-F1038 HydrophobicContact CB-CD1 3.7Å; P1036-F1038 HydrophobicContact CB-CE1 3.68Å; P1036-F1038 HydrophobicContact CG-CE1 4.19Å; P1036-F1038 PolarHBondContact O-N 2.91Å; F1038-T1040 VanDerWaalsContact C-N 3.31Å
1039	L	35.2	Very low	38.3	Very low	67 Å²	67	97.4 Å²	97.4	35%	0.351	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-78.9	-15.4	175.1	-69.3	174.4	0	0	0	112.7	L1035 P1036 R1041	L1035-L1039 HydrophobicContact CD2-CB 3.89Å; L1035-L1039 HydrophobicContact CD2-CD1 4.14Å; L1035-L1039 HydrophobicContact CG-CB 4.37Å; L1035-L1039 HydrophobicContact CG-CD1 4Å; P1036-L1039 PolarHBondContact O-N 3.43Å; L1039-R1041 VanDerWaalsContact C-N 3.33Å
1040	T	39.5	Very low	37.9	Very low	76 Å²	76	96 Å²	96	47%	0.466	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-84.3	-1.8	176.8	50.2	0	0	0	0	113.6	A1037 F1038	A1037-T1040 WeakPolarHBondContact CA-OG1 3.26Å; A1037-T1040 PolarHBondContact O-OG1 3.02Å; A1037-T1040 VanDerWaalsContact O-OG1 3.07Å; F1038-T1040 VanDerWaalsContact C-N 3.31Å
1041	R	34.1	Very low	37.7	Very low	210 Å²	210	95.2 Å²	95.2	79%	0.792	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-79.3	-11.3	-178.1	-72.9	-171.1	172.9	-165.4	-4.7	115.3	L1039	L1039-R1041 VanDerWaalsContact C-N 3.33Å
1042	H	34.1	Very low	37.4	Very low	152 Å²	152	95.7 Å²	95.7	70%	0.704	52%	0.518	S	S	*	.	S	Bend	trans	-111.7	61.8	171.2	-62.6	-64.9	0	0	0	109.8	S1044	H1042-S1044 VanDerWaalsContact C-N 3.33Å; H1042-S1044 PolarHBondContact O-N 3.34Å
1043	G	27.3	Very low	37	Very low	62 Å²	62	91.4 Å²	91.4	64%	0.639	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	41.7	-156.7	0	0	0	0	0	118
1044	S	35.5	Very low	36.8	Very low	86 Å²	86	84.7 Å²	84.7	60%	0.601	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.1	-57.1	173.7	61.3	0	0	0	0	113.6	H1042 V1046 T1047 S1048	H1042-S1044 VanDerWaalsContact C-N 3.33Å; H1042-S1044 PolarHBondContact O-N 3.34Å; S1044-V1046 PolarHBondContact O-N 2.94Å; S1044-T1047 PolarHBondContact O-N 3.06Å; S1044-S1048 PolarHBondContact O-N 3.48Å; S1044-S1048 VanDerWaalsContact O-N 3.13Å; S1044-S1048 PolarHBondContact O-OG 3.35Å
1045	S	40	Very low	36.6	Very low	61 Å²	61	82.1 Å²	82.1	43%	0.427	48%	0.48	S	S	.	.	H	α-helix	trans	-73	-26.2	-168.7	68.2	0	0	0	0	115.1	S1048 K1049	S1045-S1048 PolarHBondContact O-OG 3.25Å; S1045-K1049 WeakPolarHBondContact O-CB 3.49Å; S1045-K1049 WeakPolarHBondContact O-CD 3.36Å; S1045-K1049 WeakPolarHBondContact O-CG 3.38Å; S1045-K1049 PolarHBondContact O-N 2.92Å
1046	V	35.7	Very low	36.4	Very low	81 Å²	81	83.5 Å²	83.5	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-73.7	-45.2	174.4	-179	0	0	0	0	109.9	S1044 V1050	S1044-V1046 PolarHBondContact O-N 2.94Å; V1046-V1050 HydrophobicContact CG1-CG2 4.22Å; V1046-V1050 VanDerWaalsContact O-CB 3.23Å; V1046-V1050 WeakPolarHBondContact O-CB 3.05Å; V1046-V1050 WeakPolarHBondContact O-CG2 3.47Å; V1046-V1050 PolarHBondContact O-N 2.87Å
1047	T	36.1	Very low	36.4	Very low	75 Å²	75	85.2 Å²	85.2	46%	0.46	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-45.6	-177.2	-40.9	0	0	0	0	111.9	S1044 V1050 T1051	S1044-T1047 PolarHBondContact O-N 3.06Å; T1047-V1050 PolarHBondContact O-N 3.46Å; T1047-T1051 WeakPolarHBondContact O-CB 3.35Å; T1047-T1051 PolarHBondContact O-N 3.04Å; T1047-T1051 PolarHBondContact O-OG1 3.19Å
1048	S	41.4	Very low	36.5	Very low	70 Å²	70	88.4 Å²	88.4	49%	0.49	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-44.8	178.7	58.2	0	0	0	0	112.2	S1044 S1045 V1050 T1051 A1052	S1044-S1048 PolarHBondContact O-N 3.48Å; S1044-S1048 VanDerWaalsContact O-N 3.13Å; S1044-S1048 PolarHBondContact O-OG 3.35Å; S1045-S1048 PolarHBondContact O-OG 3.25Å; S1048-V1050 PolarHBondContact O-N 2.82Å; S1048-T1051 PolarHBondContact O-N 3.29Å; S1048-A1052 WeakPolarHBondContact O-CB 3.44Å; S1048-A1052 PolarHBondContact O-N 3.22Å
1049	K	39.2	Very low	36.2	Very low	136 Å²	136	91.5 Å²	91.5	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-61.9	-43.4	174.8	-72.4	179	179.4	-175.4	0	112.1	S1045 T1051 A1052 L1053	S1045-K1049 WeakPolarHBondContact O-CB 3.49Å; S1045-K1049 WeakPolarHBondContact O-CD 3.36Å; S1045-K1049 WeakPolarHBondContact O-CG 3.38Å; S1045-K1049 PolarHBondContact O-N 2.92Å; K1049-T1051 VanDerWaalsContact C-N 3.29Å; K1049-T1051 PolarHBondContact O-N 3.03Å; K1049-A1052 PolarHBondContact O-N 2.91Å; K1049-L1053 HydrophobicContact CB-CD1 4.45Å; K1049-L1053 VanDerWaalsContact O-CB 3.23Å; K1049-L1053 WeakPolarHBondContact O-CB 3.28Å; K1049-L1053 WeakPolarHBondContact O-CG 3.39Å; K1049-L1053 PolarHBondContact O-N 3Å
1050	V	37.1	Very low	36.1	Very low	27 Å²	27	91.8 Å²	91.8	16%	0.164	50%	0.5	C	S	.	.	H	α-helix	trans	-68.7	-25.4	177.5	168.6	0	0	0	0	112.5	V1028 V1046 T1047 S1048 L1054 F1096	V1028-V1050 HydrophobicContact CG1-CG1 4.35Å; V1028-V1050 HydrophobicContact CG2-CG1 3.82Å; V1046-V1050 HydrophobicContact CG1-CG2 4.22Å; V1046-V1050 VanDerWaalsContact O-CB 3.23Å; V1046-V1050 WeakPolarHBondContact O-CB 3.05Å; V1046-V1050 WeakPolarHBondContact O-CG2 3.47Å; V1046-V1050 PolarHBondContact O-N 2.87Å; T1047-V1050 PolarHBondContact O-N 3.46Å; S1048-V1050 PolarHBondContact O-N 2.82Å; V1050-L1054 HydrophobicContact CG1-CD1 4.21Å; V1050-L1054 WeakPolarHBondContact O-CB 3.38Å; V1050-L1054 WeakPolarHBondContact O-CD1 3.37Å; V1050-F1096 HydrophobicContact CG2-CZ 4.15Å
1051	T	36.1	Very low	35.9	Very low	74 Å²	74	89.9 Å²	89.9	45%	0.454	50%	0.496	S	S	.	.	H	α-helix	trans	-78.6	-43.4	172.9	-52.7	0	0	0	0	111.3	T1047 S1048 K1049	T1047-T1051 WeakPolarHBondContact O-CB 3.35Å; T1047-T1051 PolarHBondContact O-N 3.04Å; T1047-T1051 PolarHBondContact O-OG1 3.19Å; S1048-T1051 PolarHBondContact O-N 3.29Å; K1049-T1051 VanDerWaalsContact C-N 3.29Å; K1049-T1051 PolarHBondContact O-N 3.03Å
1052	A	39.4	Very low	35.9	Very low	72 Å²	72	87.1 Å²	87.1	60%	0.595	49%	0.485	S	S	*	.	H	α-helix	trans	-73.7	-35.1	-176.8	0	0	0	0	0	114.4	S1048 K1049 L1054 S1055	S1048-A1052 WeakPolarHBondContact O-CB 3.44Å; S1048-A1052 PolarHBondContact O-N 3.22Å; K1049-A1052 PolarHBondContact O-N 2.91Å; A1052-L1054 PolarHBondContact O-N 2.98Å; A1052-L1054 VanDerWaalsContact O-N 3.16Å; A1052-S1055 PolarHBondContact O-OG 2.98Å
1053	L	35.2	Very low	36	Very low	63 Å²	63	84.2 Å²	84.2	33%	0.33	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-1.9	-175.6	-86.5	165.2	0	0	0	115.4	K1049 C1100	K1049-L1053 HydrophobicContact CB-CD1 4.45Å; K1049-L1053 VanDerWaalsContact O-CB 3.23Å; K1049-L1053 WeakPolarHBondContact O-CB 3.28Å; K1049-L1053 WeakPolarHBondContact O-CG 3.39Å; K1049-L1053 PolarHBondContact O-N 3Å; L1053-C1100 HydrophobicContact CD1-CB 4.35Å; L1053-C1100 HydrophobicContact CD2-CB 4.08Å
1054	L	36.3	Very low	36.6	Very low	27 Å²	27	83.2 Å²	83.2	14%	0.141	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.8	-12.7	-147.6	-128.8	-157.7	0	0	0	110.9	L1024 V1028 V1050 A1052 N1056 Y1103	L1024-L1054 VanDerWaalsContact CD1-C 3.44Å; L1024-L1054 HydrophobicContact CD1-CB 3.56Å; L1024-L1054 HydrophobicContact CD1-CD1 3.74Å; L1024-L1054 HydrophobicContact CD1-CD2 3.67Å; L1024-L1054 HydrophobicContact CD1-CG 3.79Å; L1024-L1054 WeakPolarHBondContact CD1-O 3.32Å; L1024-L1054 HydrophobicContact CD2-CB 3.89Å; L1024-L1054 HydrophobicContact CG-CB 4.08Å; L1024-L1054 HydrophobicContact CG-CD1 4.4Å; V1028-L1054 HydrophobicContact CG2-CD1 4.19Å; V1050-L1054 HydrophobicContact CG1-CD1 4.21Å; V1050-L1054 WeakPolarHBondContact O-CB 3.38Å; V1050-L1054 WeakPolarHBondContact O-CD1 3.37Å; A1052-L1054 PolarHBondContact O-N 2.98Å; A1052-L1054 VanDerWaalsContact O-N 3.16Å; L1054-N1056 PolarHBondContact O-N 2.89Å; L1054-Y1103 HydrophobicContact CD2-CD1 3.96Å; L1054-Y1103 HydrophobicContact CD2-CD2 3.46Å; L1054-Y1103 VanDerWaalsContact CD2-CD2 3.46Å; L1054-Y1103 HydrophobicContact CD2-CE1 4.26Å; L1054-Y1103 HydrophobicContact CD2-CE2 3.81Å; L1054-Y1103 HydrophobicContact CD2-CG 3.57Å; L1054-Y1103 HydrophobicContact CG-CD2 4.37Å
1055	S	35.3	Very low	36.8	Very low	81 Å²	81	79.6 Å²	79.6	57%	0.566	43%	0.434	S	S	*	.	S	Bend	trans	-63	-3.5	172.7	52.8	0	0	0	0	115.3	L1024 A1052	L1024-S1055 VanDerWaalsContact CD2-N 3.35Å; A1052-S1055 PolarHBondContact O-OG 2.98Å
1056	N	36.4	Very low	36.9	Very low	81 Å²	81	78.1 Å²	78.1	43%	0.433	42%	0.424	S	S	.	.	S	Bend	trans	-138.9	78.3	-145.5	-121.7	-22.1	0	0	0	113.8	L1054 Y1103 K1104 P1105	L1054-N1056 PolarHBondContact O-N 2.89Å; N1056-Y1103 CarbonylContact O-C 3.51Å; N1056-K1104 CarbonylContact O-C 3.49Å; N1056-P1105 HydrophobicContact CB-CG 4.07Å; N1056-P1105 WeakPolarHBondContact O-CD 3.23Å
1057	N	34.9	Very low	37.7	Very low	96 Å²	96	77.9 Å²	77.9	51%	0.513	42%	0.422	S	S	.	.			trans	98.8	156.4	162.2	-130.4	-36.7	0	0	0	119.9	P1105	N1057-P1105 HydrophobicContact CB-CB 3.94Å
1058	R	36.1	Very low	38.5	Very low	146 Å²	146	78.4 Å²	78.4	55%	0.551	42%	0.418	S	S	*	.			trans	-144.8	101.1	-157.4	-69	164.6	158.9	-177.2	-3.6	113	G1020 Y1022	G1020-R1058 VanDerWaalsContact CA-CD 3.49Å; G1020-R1058 PolarHBondContact O-NE 3.16Å; G1020-R1058 PolarHBondContact O-NH1 3.42Å; G1020-R1058 PolarHBondContact O-NH2 2.86Å; Y1022-R1058 PolarHBondContact O-NH2 3Å
1059	K	36.2	Very low	39.2	Very low	179 Å²	179	75.8 Å²	75.8	78%	0.778	40%	0.399	S	S	*	.			trans	-178.8	121	157.6	-103.3	149.9	-172	172	0	110.8
1060	F	32.4	Very low	39.9	Very low	73 Å²	73	70.9 Å²	70.9	32%	0.32	38%	0.379	S	S	.	.			trans	-147.9	142.2	171.2	-133	-96.2	0	0	0	115.5	V1064 V1065 I1102	F1060-V1064 HydrophobicContact CE1-CB 3.65Å; F1060-V1064 HydrophobicContact CE1-CG1 3.75Å; F1060-V1064 HydrophobicContact CZ-CB 4.11Å; F1060-V1064 HydrophobicContact CZ-CG1 3.71Å; F1060-V1065 HydrophobicContact CD1-CG2 3.43Å; F1060-V1065 VanDerWaalsContact CD1-CG2 3.43Å; F1060-V1065 HydrophobicContact CE1-CG2 3.51Å; F1060-I1102 HydrophobicContact CD2-CB 4.4Å; F1060-I1102 HydrophobicContact CD2-CG1 4.2Å; F1060-I1102 HydrophobicContact CD2-CG2 3.67Å; F1060-I1102 HydrophobicContact CE1-CD1 3.89Å; F1060-I1102 HydrophobicContact CE1-CG1 4.24Å; F1060-I1102 HydrophobicContact CE2-CB 4.15Å; F1060-I1102 HydrophobicContact CE2-CD1 4.12Å; F1060-I1102 HydrophobicContact CE2-CG1 3.54Å; F1060-I1102 HydrophobicContact CE2-CG2 3.91Å; F1060-I1102 HydrophobicContact CG-CG2 4.08Å; F1060-I1102 HydrophobicContact CZ-CD1 3.66Å; F1060-I1102 HydrophobicContact CZ-CG1 3.55Å; F1060-I1102 HydrophobicContact CZ-CG2 4.46Å
1061	G	35	Very low	41.2	Very low	36 Å²	36	74.5 Å²	74.5	37%	0.371	39%	0.394	S	S	.	.			trans	-98.5	136.5	-177.4	0	0	0	0	0	113.8	T1063 V1064	G1061-T1063 PolarHBondContact O-N 2.84Å; G1061-V1064 PolarHBondContact O-N 2.83Å
1062	R	34.7	Very low	42.5	Very low	152 Å²	152	71.1 Å²	71.1	57%	0.574	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-8.3	-173.3	-62.4	179.3	-177.2	-177.4	-4.9	117.1	S1015 S1016	S1015-R1062 WeakPolarHBondContact O-CG 3.08Å; S1016-R1062 PolarHBondContact O-NH2 3.4Å
1063	T	36	Very low	43.5	Very low	91 Å²	91	67.7 Å²	67.7	56%	0.558	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-33.8	-179.9	43.8	0	0	0	0	114.3	G1061 V1065 S1066 T1067	G1061-T1063 PolarHBondContact O-N 2.84Å; T1063-V1065 PolarHBondContact O-N 3.12Å; T1063-S1066 PolarHBondContact O-N 2.94Å; T1063-T1067 PolarHBondContact O-N 3.17Å; T1063-T1067 PolarHBondContact O-OG1 2.73Å
1064	V	39.3	Very low	44.9	Very low	40 Å²	40	69.1 Å²	69.1	24%	0.242	35%	0.35	C	S	.	.	H	α-helix	trans	-72.8	-33.4	-167.3	176.7	0	0	0	0	112.5	F1060 G1061 S1066 T1067 K1068	F1060-V1064 HydrophobicContact CE1-CB 3.65Å; F1060-V1064 HydrophobicContact CE1-CG1 3.75Å; F1060-V1064 HydrophobicContact CZ-CB 4.11Å; F1060-V1064 HydrophobicContact CZ-CG1 3.71Å; G1061-V1064 PolarHBondContact O-N 2.83Å; V1064-S1066 VanDerWaalsContact C-N 3.31Å; V1064-S1066 PolarHBondContact O-N 2.69Å; V1064-T1067 PolarHBondContact O-N 3.31Å; V1064-T1067 PolarHBondContact O-OG1 2.68Å; V1064-T1067 VanDerWaalsContact O-OG1 3.05Å; V1064-K1068 HydrophobicContact CG1-CD 4.23Å; V1064-K1068 HydrophobicContact CG1-CG 4.37Å; V1064-K1068 PolarHBondContact O-N 2.79Å
1065	V	40.6	Very low	46.2	Very low	10 Å²	10	73.5 Å²	73.5	6%	0.061	37%	0.374	C	S	.	.	H	α-helix	trans	-60.9	-42.6	175.2	-172.4	0	0	0	0	110.6	C1011 F1060 T1063 T1067 I1069 I1102	C1011-V1065 HydrophobicContact CB-CG1 3.95Å; C1011-V1065 HydrophobicContact CB-CG2 4.43Å; F1060-V1065 HydrophobicContact CD1-CG2 3.43Å; F1060-V1065 VanDerWaalsContact CD1-CG2 3.43Å; F1060-V1065 HydrophobicContact CE1-CG2 3.51Å; T1063-V1065 PolarHBondContact O-N 3.12Å; V1065-T1067 VanDerWaalsContact C-N 3.34Å; V1065-T1067 PolarHBondContact O-N 2.74Å; V1065-I1069 HydrophobicContact CG1-CD1 3.64Å; V1065-I1069 HydrophobicContact CG1-CG1 4.28Å; V1065-I1069 WeakPolarHBondContact O-CB 3.45Å; V1065-I1069 WeakPolarHBondContact O-CG1 3.43Å; V1065-I1069 PolarHBondContact O-N 2.91Å; V1065-I1102 HydrophobicContact CG2-CD1 4.48Å
1066	S	41.8	Very low	47.5	Very low	31 Å²	31	72.1 Å²	72.1	22%	0.217	36%	0.356	C	S	.	.	H	α-helix	trans	-72.2	-25.9	-178.3	-171.8	0	0	0	0	113.3	T1063 V1064 N1070	T1063-S1066 PolarHBondContact O-N 2.94Å; V1064-S1066 VanDerWaalsContact C-N 3.31Å; V1064-S1066 PolarHBondContact O-N 2.69Å; S1066-N1070 WeakPolarHBondContact O-CB 3.31Å; S1066-N1070 VanDerWaalsContact O-CG 3.28Å; S1066-N1070 PolarHBondContact O-OD1 3.48Å
1067	T	52	Low	48.1	Very low	75 Å²	75	72.8 Å²	72.8	46%	0.46	36%	0.357	S	S	.	.	H	α-helix	trans	-81.5	-46	172.2	43.2	0	0	0	0	111.4	T1063 V1064 V1065 I1069 N1070 Q1071	T1063-T1067 PolarHBondContact O-N 3.17Å; T1063-T1067 PolarHBondContact O-OG1 2.73Å; V1064-T1067 PolarHBondContact O-N 3.31Å; V1064-T1067 PolarHBondContact O-OG1 2.68Å; V1064-T1067 VanDerWaalsContact O-OG1 3.05Å; V1065-T1067 VanDerWaalsContact C-N 3.34Å; V1065-T1067 PolarHBondContact O-N 2.74Å; T1067-I1069 PolarHBondContact O-N 2.79Å; T1067-N1070 WeakPolarHBondContact O-CB 3.1Å; T1067-N1070 PolarHBondContact O-N 3.46Å; T1067-N1070 VanDerWaalsContact O-N 3.17Å; T1067-Q1071 WeakPolarHBondContact O-CB 3.23Å; T1067-Q1071 VanDerWaalsContact O-CG 3.31Å; T1067-Q1071 WeakPolarHBondContact O-CG 3.23Å; T1067-Q1071 PolarHBondContact O-N 2.75Å; T1067-Q1071 PolarHBondContact O-OE1 3.46Å
1068	K	52.8	Low	48.7	Very low	87 Å²	87	70.7 Å²	70.7	38%	0.378	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-43	179.6	-81.4	-173.1	161.2	-166	0	113	V1064 N1070 Q1071 I1072 I1098	V1064-K1068 HydrophobicContact CG1-CD 4.23Å; V1064-K1068 HydrophobicContact CG1-CG 4.37Å; V1064-K1068 PolarHBondContact O-N 2.79Å; K1068-N1070 VanDerWaalsContact C-N 3.31Å; K1068-N1070 PolarHBondContact O-N 3.46Å; K1068-Q1071 PolarHBondContact O-N 3.21Å; K1068-I1072 WeakPolarHBondContact O-CG1 3.26Å; K1068-I1072 PolarHBondContact O-N 3.4Å; K1068-I1098 HydrophobicContact CB-CD1 4.23Å; K1068-I1098 HydrophobicContact CB-CG2 4.07Å; K1068-I1098 HydrophobicContact CD-CD1 4.07Å; K1068-I1098 HydrophobicContact CD-CG2 3.94Å; K1068-I1098 HydrophobicContact CG-CD1 4.39Å
1069	I	55.5	Low	49.1	Very low	15 Å²	15	72.5 Å²	72.5	8%	0.077	38%	0.378	C	S	.	.	H	α-helix	trans	-66.2	-33.8	176.1	-62.9	177.3	0	0	0	111.5	Y991 V1065 T1067 V1073 V1095	Y991-I1069 HydrophobicContact CE1-CG2 4.48Å; Y991-I1069 VanDerWaalsContact OH-CG2 3.31Å; Y991-I1069 WeakPolarHBondContact OH-CG2 3.13Å; V1065-I1069 HydrophobicContact CG1-CD1 3.64Å; V1065-I1069 HydrophobicContact CG1-CG1 4.28Å; V1065-I1069 WeakPolarHBondContact O-CB 3.45Å; V1065-I1069 WeakPolarHBondContact O-CG1 3.43Å; V1065-I1069 PolarHBondContact O-N 2.91Å; T1067-I1069 PolarHBondContact O-N 2.79Å; I1069-V1073 WeakPolarHBondContact O-CB 3.32Å; I1069-V1073 WeakPolarHBondContact O-CG2 3.45Å; I1069-V1073 PolarHBondContact O-N 2.79Å; I1069-V1095 HydrophobicContact CD1-CG1 4.31Å; I1069-V1095 HydrophobicContact CG1-CG1 4.33Å; I1069-V1095 HydrophobicContact CG2-CG2 4.17Å
1070	N	55.8	Low	49.6	Very low	33 Å²	33	67.4 Å²	67.4	18%	0.176	37%	0.365	C	S	.	.	H	α-helix	trans	-66.3	-45.7	171	-83.1	19.4	0	0	0	110.9	H987 M990 S1066 T1067 K1068 I1072 V1073 E1074	H987-N1070 PolarHBondContact CE1-OD1 3.48Å; H987-N1070 PolarHBondContact ND1-OD1 3.02Å; M990-N1070 WeakPolarHBondContact CE-OD1 3.4Å; S1066-N1070 WeakPolarHBondContact O-CB 3.31Å; S1066-N1070 VanDerWaalsContact O-CG 3.28Å; S1066-N1070 PolarHBondContact O-OD1 3.48Å; T1067-N1070 WeakPolarHBondContact O-CB 3.1Å; T1067-N1070 PolarHBondContact O-N 3.46Å; T1067-N1070 VanDerWaalsContact O-N 3.17Å; K1068-N1070 VanDerWaalsContact C-N 3.31Å; K1068-N1070 PolarHBondContact O-N 3.46Å; N1070-I1072 PolarHBondContact O-N 2.77Å; N1070-V1073 CarbonylContact O-C 3.56Å; N1070-V1073 WeakPolarHBondContact O-CA 3.24Å; N1070-V1073 WeakPolarHBondContact O-CB 3.25Å; N1070-V1073 PolarHBondContact O-N 3.34Å; N1070-V1073 VanDerWaalsContact O-N 3.08Å; N1070-E1074 WeakPolarHBondContact O-CB 3.4Å; N1070-E1074 VanDerWaalsContact O-CG 3.29Å; N1070-E1074 WeakPolarHBondContact O-CG 3.47Å; N1070-E1074 PolarHBondContact O-N 2.8Å
1071	Q	62.7	Low	50.5	Low	103 Å²	103	68.6 Å²	68.6	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-43.7	-178.9	-75.1	172.7	-60.5	0	0	112.3	T1067 K1068 V1073 E1074 N1075	T1067-Q1071 WeakPolarHBondContact O-CB 3.23Å; T1067-Q1071 VanDerWaalsContact O-CG 3.31Å; T1067-Q1071 WeakPolarHBondContact O-CG 3.23Å; T1067-Q1071 PolarHBondContact O-N 2.75Å; T1067-Q1071 PolarHBondContact O-OE1 3.46Å; K1068-Q1071 PolarHBondContact O-N 3.21Å; Q1071-V1073 VanDerWaalsContact C-N 3.32Å; Q1071-V1073 PolarHBondContact O-N 2.71Å; Q1071-E1074 CarbonylContact O-C 3.6Å; Q1071-E1074 WeakPolarHBondContact O-CA 3.25Å; Q1071-E1074 PolarHBondContact O-N 3Å; Q1071-E1074 VanDerWaalsContact O-N 3.07Å; Q1071-N1075 PolarHBondContact O-N 3.47Å; Q1071-N1075 PolarHBondContact O-OD1 3.11Å
1072	I	64.2	Low	51.2	Low	2 Å²	2	71 Å²	71	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-56.3	-50	171.1	-62.2	158.2	0	0	0	109.8	K1068 N1070 E1074 N1075 Y1076 V1091 E1094 V1095 I1098	K1068-I1072 WeakPolarHBondContact O-CG1 3.26Å; K1068-I1072 PolarHBondContact O-N 3.4Å; N1070-I1072 PolarHBondContact O-N 2.77Å; I1072-E1074 PolarHBondContact O-N 2.89Å; I1072-E1074 VanDerWaalsContact O-N 3.13Å; I1072-N1075 PolarHBondContact O-N 3.03Å; I1072-Y1076 HydrophobicContact CG2-CD2 4.31Å; I1072-Y1076 HydrophobicContact CG2-CE2 4.27Å; I1072-Y1076 WeakPolarHBondContact O-CD2 3.35Å; I1072-Y1076 PolarHBondContact O-N 3.05Å; I1072-V1091 HydrophobicContact CG2-CB 4.24Å; I1072-V1091 HydrophobicContact CG2-CG1 3.81Å; I1072-V1091 HydrophobicContact CG2-CG2 4.12Å; I1072-E1094 HydrophobicContact CD1-CB 4.18Å; I1072-E1094 VanDerWaalsContact CD1-O 3.3Å; I1072-E1094 WeakPolarHBondContact CD1-O 2.96Å; I1072-E1094 HydrophobicContact CG1-CB 4.15Å; I1072-E1094 HydrophobicContact CG2-CB 3.56Å; I1072-V1095 HydrophobicContact CB-CG2 4.42Å; I1072-V1095 HydrophobicContact CD1-CB 4.37Å; I1072-V1095 HydrophobicContact CD1-CG2 3.69Å; I1072-V1095 HydrophobicContact CG2-CG2 4.21Å; I1072-I1098 HydrophobicContact CD1-CB 3.93Å; I1072-I1098 HydrophobicContact CD1-CD1 3.66Å; I1072-I1098 HydrophobicContact CD1-CG1 3.86Å; I1072-I1098 HydrophobicContact CG1-CD1 3.89Å; I1072-I1098 HydrophobicContact CG1-CG1 4.49Å
1073	V	60.9	Low	52.4	Low	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.2	-18.1	-179.4	175.1	0	0	0	0	112.4	M990 Y991 Q994 I1069 N1070 Q1071 Q1077 V1091	M990-V1073 HydrophobicContact CE-CB 4.25Å; M990-V1073 HydrophobicContact CE-CG1 3.9Å; M990-V1073 HydrophobicContact CG-CG1 4.4Å; M990-V1073 HydrophobicContact SD-CG1 4.46Å; Y991-V1073 HydrophobicContact CE1-CG2 3.91Å; Q994-V1073 HydrophobicContact CG-CG1 4.17Å; Q994-V1073 PolarHBondContact NE2-O 3.02Å; I1069-V1073 WeakPolarHBondContact O-CB 3.32Å; I1069-V1073 WeakPolarHBondContact O-CG2 3.45Å; I1069-V1073 PolarHBondContact O-N 2.79Å; N1070-V1073 CarbonylContact O-C 3.56Å; N1070-V1073 WeakPolarHBondContact O-CA 3.24Å; N1070-V1073 WeakPolarHBondContact O-CB 3.25Å; N1070-V1073 PolarHBondContact O-N 3.34Å; N1070-V1073 VanDerWaalsContact O-N 3.08Å; Q1071-V1073 VanDerWaalsContact C-N 3.32Å; Q1071-V1073 PolarHBondContact O-N 2.71Å; V1073-Q1077 WeakPolarHBondContact O-CG 3.3Å; V1073-Q1077 PolarHBondContact O-NE2 2.72Å; V1073-V1091 HydrophobicContact CG2-CG1 3.99Å
1074	E	63.3	Low	53.9	Low	94 Å²	94	63.2 Å²	63.2	44%	0.439	35%	0.348	S	S	.	.	H	α-helix	trans	-92.3	-33	174.8	-72.8	159.7	-173.8	0	0	112.6	N1070 Q1071 I1072 Y1076 Q1077	N1070-E1074 WeakPolarHBondContact O-CB 3.4Å; N1070-E1074 VanDerWaalsContact O-CG 3.29Å; N1070-E1074 WeakPolarHBondContact O-CG 3.47Å; N1070-E1074 PolarHBondContact O-N 2.8Å; Q1071-E1074 CarbonylContact O-C 3.6Å; Q1071-E1074 WeakPolarHBondContact O-CA 3.25Å; Q1071-E1074 PolarHBondContact O-N 3Å; Q1071-E1074 VanDerWaalsContact O-N 3.07Å; I1072-E1074 PolarHBondContact O-N 2.89Å; I1072-E1074 VanDerWaalsContact O-N 3.13Å; E1074-Y1076 VanDerWaalsContact C-N 3.3Å; E1074-Y1076 PolarHBondContact O-N 2.74Å; E1074-Q1077 WeakPolarHBondContact O-CB 3.1Å; E1074-Q1077 PolarHBondContact O-N 3.35Å
1075	N	64.9	Low	54.8	Low	119 Å²	119	64.9 Å²	64.9	64%	0.636	37%	0.366	S	S	*	.	H	α-helix	trans	-61.5	-38.4	174.7	-69.9	-8.4	0	0	0	111.8	Q1071 I1072 Q1077	Q1071-N1075 PolarHBondContact O-N 3.47Å; Q1071-N1075 PolarHBondContact O-OD1 3.11Å; I1072-N1075 PolarHBondContact O-N 3.03Å; N1075-Q1077 VanDerWaalsContact C-N 3.28Å; N1075-Q1077 PolarHBondContact O-N 3.36Å
1076	Y	62.3	Low	55.9	Low	52 Å²	52	67.5 Å²	67.5	20%	0.204	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	9.4	173.9	-64.7	-94.5	0	0	0	113.5	I1072 E1074 G1078 L1083 A1087 Q1090 V1091 E1094	I1072-Y1076 HydrophobicContact CG2-CD2 4.31Å; I1072-Y1076 HydrophobicContact CG2-CE2 4.27Å; I1072-Y1076 WeakPolarHBondContact O-CD2 3.35Å; I1072-Y1076 PolarHBondContact O-N 3.05Å; E1074-Y1076 VanDerWaalsContact C-N 3.3Å; E1074-Y1076 PolarHBondContact O-N 2.74Å; Y1076-G1078 VanDerWaalsContact C-N 3.3Å; Y1076-G1078 PolarHBondContact O-N 2.97Å; Y1076-L1083 HydrophobicContact CG-CD2 4.45Å; Y1076-L1083 WeakPolarHBondContact O-CD2 3.42Å; Y1076-A1087 HydrophobicContact CD1-CB 4.05Å; Y1076-Q1090 HydrophobicContact CE1-CB 3.77Å; Y1076-Q1090 HydrophobicContact CE1-CG 3.94Å; Y1076-Q1090 VanDerWaalsContact OH-CG 3.28Å; Y1076-Q1090 WeakPolarHBondContact OH-CG 3.04Å; Y1076-Q1090 PolarHBondContact OH-NE2 3.23Å; Y1076-V1091 HydrophobicContact CD1-CG2 4.36Å; Y1076-V1091 HydrophobicContact CD2-CG2 3.31Å; Y1076-V1091 HydrophobicContact CE2-CG2 3.95Å; Y1076-V1091 HydrophobicContact CG-CG2 3.56Å; Y1076-E1094 WeakPolarHBondContact CE2-OE1 3.03Å; Y1076-E1094 VanDerWaalsContact CZ-OE1 3.28Å; Y1076-E1094 PolarHBondContact OH-OE1 3.15Å
1077	Q	47.9	Very low	56.9	Low	95 Å²	95	66.7 Å²	66.7	44%	0.444	38%	0.384	S	S	.	.			trans	-87.8	64.8	167.2	-76.8	170.8	74.9	0	0	111.2	V1073 E1074 N1075	V1073-Q1077 WeakPolarHBondContact O-CG 3.3Å; V1073-Q1077 PolarHBondContact O-NE2 2.72Å; E1074-Q1077 WeakPolarHBondContact O-CB 3.1Å; E1074-Q1077 PolarHBondContact O-N 3.35Å; N1075-Q1077 VanDerWaalsContact C-N 3.28Å; N1075-Q1077 PolarHBondContact O-N 3.36Å
1078	G	49.3	Very low	57.4	Low	51 Å²	51	65.1 Å²	65.1	53%	0.526	37%	0.371	S	S	.	.	S	Bend	trans	-60.7	175.6	150.6	0	0	0	0	0	110.7	Y1076 S1080	Y1076-G1078 VanDerWaalsContact C-N 3.3Å; Y1076-G1078 PolarHBondContact O-N 2.97Å; G1078-S1080 PolarHBondContact O-N 2.86Å
1079	N	44	Very low	57.7	Low	184 Å²	184	66.5 Å²	66.5	98%	0.984	38%	0.382	S	S	*	.	S	Bend	trans	-57.4	-5	-172.2	-68.8	-20.4	0	0	0	116.5
1080	S	46.2	Very low	58.2	Low	72 Å²	72	70.7 Å²	70.7	50%	0.503	40%	0.401	S	S	.	.			trans	-75.3	137	172.9	177.5	0	0	0	0	112.7	G1078 R1082	G1078-S1080 PolarHBondContact O-N 2.86Å; S1080-R1082 WeakPolarHBondContact CB-O 3.35Å; S1080-R1082 PolarHBondContact O-N 3.07Å; S1080-R1082 PolarHBondContact OG-N 3.08Å; S1080-R1082 PolarHBondContact OG-O 3.43Å
1081	T	51.5	Low	58.5	Low	98 Å²	98	69.1 Å²	69.1	60%	0.601	39%	0.393	S	S	*	.	S	Bend	trans	-77.5	8.6	169.9	60.4	0	0	0	0	114.1	R993	R993-T1081 VanDerWaalsContact O-O 3.08Å
1082	R	49.7	Very low	58.2	Low	87 Å²	87	66 Å²	66	33%	0.328	38%	0.378	S	S	.	.	S	Bend	trans	-141.9	138.8	-179.7	-90.2	-176.3	162.4	170.2	-2	111.7	N940 S1080	N940-R1082 VanDerWaalsContact N-CZ 3.3Å; N940-R1082 PolarHBondContact O-NH1 3.33Å; N940-R1082 PolarHBondContact O-NH2 3.1Å; S1080-R1082 WeakPolarHBondContact CB-O 3.35Å; S1080-R1082 PolarHBondContact O-N 3.07Å; S1080-R1082 PolarHBondContact OG-N 3.08Å; S1080-R1082 PolarHBondContact OG-O 3.43Å
1083	L	59.8	Low	58	Low	8 Å²	8	68.4 Å²	68.4	4%	0.042	40%	0.398	C	S	.	.			trans	-71.9	137.1	156.8	-60.1	171.3	0	0	0	110.4	Q994 Y996 Y1076 A1087 K1088 V1091	Q994-L1083 HydrophobicContact CB-CD1 4.04Å; Q994-L1083 HydrophobicContact CB-CG 4.36Å; Q994-L1083 HydrophobicContact CG-CD1 4.38Å; Y996-L1083 HydrophobicContact CE1-CD1 4.42Å; Y996-L1083 HydrophobicContact CE2-CD1 3.95Å; Y996-L1083 WeakPolarHBondContact OH-CD1 3.29Å; Y1076-L1083 HydrophobicContact CG-CD2 4.45Å; Y1076-L1083 WeakPolarHBondContact O-CD2 3.42Å; L1083-A1087 HydrophobicContact CB-CB 4.16Å; L1083-A1087 HydrophobicContact CD2-CB 4.04Å; L1083-K1088 HydrophobicContact CB-CG 3.63Å; L1083-K1088 HydrophobicContact CD1-CG 4.16Å; L1083-V1091 HydrophobicContact CD1-CB 4.49Å; L1083-V1091 HydrophobicContact CD1-CG2 4.05Å; L1083-V1091 HydrophobicContact CD2-CG2 4.33Å
1084	S	67.9	Low	58.1	Low	71 Å²	71	71.1 Å²	71.1	50%	0.497	41%	0.411	S	S	.	.			trans	-66.9	170.6	166.7	65.9	0	0	0	0	111	A1086 A1087 K1088	S1084-A1086 VanDerWaalsContact C-N 3.32Å; S1084-A1086 PolarHBondContact O-N 3.17Å; S1084-A1087 PolarHBondContact O-N 2.73Å; S1084-A1087 WeakPolarHBondContact OG-CB 3.22Å; S1084-A1087 PolarHBondContact OG-N 3.3Å; S1084-K1088 WeakPolarHBondContact O-CG 3.44Å; S1084-K1088 PolarHBondContact O-N 2.89Å
1085	A	58.1	Low	57.8	Low	76 Å²	76	66.9 Å²	66.9	63%	0.628	39%	0.391	S	S	*	.	H	α-helix	trans	-59.8	-45.2	174.4	0	0	0	0	0	111.2	K1088 N1089	A1085-K1088 PolarHBondContact O-N 3.31Å; A1085-N1089 PolarHBondContact O-N 3.3Å; A1085-N1089 PolarHBondContact O-OD1 2.78Å
1086	A	63.9	Low	57.2	Low	64 Å²	64	65.5 Å²	65.5	53%	0.529	38%	0.379	S	S	.	.	H	α-helix	trans	-55.5	-53.8	171.2	0	0	0	0	0	111.5	S1084 K1088 N1089 Q1090	S1084-A1086 VanDerWaalsContact C-N 3.32Å; S1084-A1086 PolarHBondContact O-N 3.17Å; A1086-K1088 VanDerWaalsContact C-N 3.3Å; A1086-K1088 PolarHBondContact O-N 2.98Å; A1086-N1089 CarbonylContact O-C 3.54Å; A1086-N1089 WeakPolarHBondContact O-CA 2.96Å; A1086-N1089 WeakPolarHBondContact O-CB 3.47Å; A1086-N1089 PolarHBondContact O-N 3.43Å; A1086-Q1090 WeakPolarHBondContact O-CB 3.45Å; A1086-Q1090 PolarHBondContact O-N 3.23Å
1087	A	62.5	Low	56.8	Low	14 Å²	14	67.1 Å²	67.1	12%	0.116	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-26.3	-178.6	0	0	0	0	0	113.8	Y1076 L1083 S1084 V1091	Y1076-A1087 HydrophobicContact CD1-CB 4.05Å; L1083-A1087 HydrophobicContact CB-CB 4.16Å; L1083-A1087 HydrophobicContact CD2-CB 4.04Å; S1084-A1087 PolarHBondContact O-N 2.73Å; S1084-A1087 WeakPolarHBondContact OG-CB 3.22Å; S1084-A1087 PolarHBondContact OG-N 3.3Å; A1087-V1091 WeakPolarHBondContact O-CB 3.46Å; A1087-V1091 VanDerWaalsContact O-CG2 3.27Å; A1087-V1091 WeakPolarHBondContact O-CG2 3.46Å; A1087-V1091 PolarHBondContact O-N 3Å
1088	K	61.6	Low	57	Low	43 Å²	43	64.2 Å²	64.2	19%	0.187	38%	0.379	C	S	.	.	H	α-helix	trans	-70	-45.4	167.9	-71.2	-176.3	-151.1	170.6	0	111.3	G995 Y996 L1083 S1084 A1085 A1086 Q1090 V1091 F1092	G995-K1088 PolarHBondContact O-NZ 3.4Å; Y996-K1088 HydrophobicContact CD1-CD 4.33Å; Y996-K1088 HydrophobicContact CD1-CG 4.46Å; Y996-K1088 HydrophobicContact CE1-CB 4.38Å; Y996-K1088 HydrophobicContact CE1-CD 4.5Å; Y996-K1088 HydrophobicContact CE1-CG 4.14Å; L1083-K1088 HydrophobicContact CB-CG 3.63Å; L1083-K1088 HydrophobicContact CD1-CG 4.16Å; S1084-K1088 WeakPolarHBondContact O-CG 3.44Å; S1084-K1088 PolarHBondContact O-N 2.89Å; A1085-K1088 PolarHBondContact O-N 3.31Å; A1086-K1088 VanDerWaalsContact C-N 3.3Å; A1086-K1088 PolarHBondContact O-N 2.98Å; K1088-Q1090 PolarHBondContact O-N 3.07Å; K1088-V1091 PolarHBondContact O-N 3.4Å; K1088-F1092 WeakPolarHBondContact O-CB 3.46Å; K1088-F1092 VanDerWaalsContact O-CD2 3.3Å; K1088-F1092 WeakPolarHBondContact O-CD2 3.13Å; K1088-F1092 PolarHBondContact O-N 3.07Å
1089	N	60.2	Low	56.8	Low	115 Å²	115	62.4 Å²	62.4	62%	0.615	36%	0.359	S	S	*	.	H	α-helix	trans	-61.7	-33.5	175.6	-68.8	-3.1	0	0	0	110.8	A1085 A1086 F1092 A1093	A1085-N1089 PolarHBondContact O-N 3.3Å; A1085-N1089 PolarHBondContact O-OD1 2.78Å; A1086-N1089 CarbonylContact O-C 3.54Å; A1086-N1089 WeakPolarHBondContact O-CA 2.96Å; A1086-N1089 WeakPolarHBondContact O-CB 3.47Å; A1086-N1089 PolarHBondContact O-N 3.43Å; N1089-F1092 PolarHBondContact O-N 2.86Å; N1089-A1093 VanDerWaalsContact O-CB 3.25Å; N1089-A1093 WeakPolarHBondContact O-CB 3.48Å; N1089-A1093 PolarHBondContact O-N 2.9Å
1090	Q	64.5	Low	56.6	Low	103 Å²	103	54.3 Å²	54.3	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-75.9	-37.4	176.7	-136.3	175	-16.2	0	0	112.5	Y1076 A1086 K1088 A1093 E1094	Y1076-Q1090 HydrophobicContact CE1-CB 3.77Å; Y1076-Q1090 HydrophobicContact CE1-CG 3.94Å; Y1076-Q1090 VanDerWaalsContact OH-CG 3.28Å; Y1076-Q1090 WeakPolarHBondContact OH-CG 3.04Å; Y1076-Q1090 PolarHBondContact OH-NE2 3.23Å; A1086-Q1090 WeakPolarHBondContact O-CB 3.45Å; A1086-Q1090 PolarHBondContact O-N 3.23Å; K1088-Q1090 PolarHBondContact O-N 3.07Å; Q1090-A1093 CarbonylContact O-C 3.57Å; Q1090-A1093 PolarHBondContact O-N 3.19Å; Q1090-E1094 WeakPolarHBondContact O-CB 3.41Å; Q1090-E1094 PolarHBondContact O-N 2.65Å
1091	V	62.6	Low	56.4	Low	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-69.6	-32.2	168.2	172.6	0	0	0	0	111.6	Y996 I1072 V1073 Y1076 L1083 A1087 K1088 V1095	Y996-V1091 WeakPolarHBondContact OH-CB 3.32Å; Y996-V1091 WeakPolarHBondContact OH-CG1 3.34Å; I1072-V1091 HydrophobicContact CG2-CB 4.24Å; I1072-V1091 HydrophobicContact CG2-CG1 3.81Å; I1072-V1091 HydrophobicContact CG2-CG2 4.12Å; V1073-V1091 HydrophobicContact CG2-CG1 3.99Å; Y1076-V1091 HydrophobicContact CD1-CG2 4.36Å; Y1076-V1091 HydrophobicContact CD2-CG2 3.31Å; Y1076-V1091 HydrophobicContact CE2-CG2 3.95Å; Y1076-V1091 HydrophobicContact CG-CG2 3.56Å; L1083-V1091 HydrophobicContact CD1-CB 4.49Å; L1083-V1091 HydrophobicContact CD1-CG2 4.05Å; L1083-V1091 HydrophobicContact CD2-CG2 4.33Å; A1087-V1091 WeakPolarHBondContact O-CB 3.46Å; A1087-V1091 VanDerWaalsContact O-CG2 3.27Å; A1087-V1091 WeakPolarHBondContact O-CG2 3.46Å; A1087-V1091 PolarHBondContact O-N 3Å; K1088-V1091 PolarHBondContact O-N 3.4Å; V1091-V1095 HydrophobicContact CG1-CG2 4.04Å; V1091-V1095 VanDerWaalsContact O-CB 3.26Å; V1091-V1095 WeakPolarHBondContact O-CB 3.5Å; V1091-V1095 VanDerWaalsContact O-CG2 3.22Å; V1091-V1095 WeakPolarHBondContact O-CG2 3.26Å; V1091-V1095 PolarHBondContact O-N 2.98Å
1092	F	57.6	Low	55.9	Low	39 Å²	39	51 Å²	51	17%	0.171	29%	0.289	C	S	.	.	H	α-helix	trans	-67.3	-44.9	169.2	-91.6	-70.7	0	0	0	111	Y996 E1000 L1003 L1004 K1088 N1089 E1094 V1095 F1096	Y996-F1092 AromaticContact CD1-CE2 3.72Å; Y996-F1092 HydrophobicContact CD1-CE2 3.72Å; Y996-F1092 HydrophobicContact CD1-CZ 4.3Å; Y996-F1092 HydrophobicContact CE1-CD2 4.19Å; Y996-F1092 AromaticContact CE1-CE2 3.59Å; Y996-F1092 HydrophobicContact CE1-CE2 3.59Å; Y996-F1092 HydrophobicContact CE1-CZ 4.3Å; E1000-F1092 HydrophobicContact CB-CE2 3.68Å; E1000-F1092 HydrophobicContact CB-CZ 3.56Å; E1000-F1092 HydrophobicContact CG-CE2 3.53Å; E1000-F1092 HydrophobicContact CG-CZ 3.82Å; L1003-F1092 HydrophobicContact CB-CE1 4.3Å; L1004-F1092 HydrophobicContact CD1-CE1 4.38Å; L1004-F1092 HydrophobicContact CD1-CZ 3.87Å; L1004-F1092 HydrophobicContact CD2-CD1 4.37Å; L1004-F1092 HydrophobicContact CD2-CE1 3.76Å; L1004-F1092 HydrophobicContact CD2-CZ 4.1Å; L1004-F1092 HydrophobicContact CG-CE1 3.68Å; L1004-F1092 HydrophobicContact CG-CZ 3.63Å; K1088-F1092 WeakPolarHBondContact O-CB 3.46Å; K1088-F1092 VanDerWaalsContact O-CD2 3.3Å; K1088-F1092 WeakPolarHBondContact O-CD2 3.13Å; K1088-F1092 PolarHBondContact O-N 3.07Å; N1089-F1092 PolarHBondContact O-N 2.86Å; F1092-E1094 VanDerWaalsContact C-N 3.33Å; F1092-E1094 PolarHBondContact O-N 3.5Å; F1092-V1095 PolarHBondContact O-N 3.32Å; F1092-F1096 WeakPolarHBondContact O-CA 3.3Å; F1092-F1096 WeakPolarHBondContact O-CB 3.36Å; F1092-F1096 PolarHBondContact O-N 3.45Å
1093	A	59.1	Low	55.3	Low	51 Å²	51	49.2 Å²	49.2	42%	0.421	28%	0.283	S	S	.	.	H	α-helix	trans	-59.8	-41.3	174.2	0	0	0	0	0	111	N1089 Q1090 D1097	N1089-A1093 VanDerWaalsContact O-CB 3.25Å; N1089-A1093 WeakPolarHBondContact O-CB 3.48Å; N1089-A1093 PolarHBondContact O-N 2.9Å; Q1090-A1093 CarbonylContact O-C 3.57Å; Q1090-A1093 PolarHBondContact O-N 3.19Å; A1093-D1097 WeakPolarHBondContact O-CA 3.18Å; A1093-D1097 WeakPolarHBondContact O-CB 3.34Å; A1093-D1097 PolarHBondContact O-N 3.23Å
1094	E	62.5	Low	54	Low	58 Å²	58	54.9 Å²	54.9	27%	0.271	31%	0.307	S	S	.	.	H	α-helix	trans	-77.8	-31.9	176.8	-93.7	-172.9	-131.9	0	0	114.2	I1072 Y1076 Q1090 F1092 F1096 I1098	I1072-E1094 HydrophobicContact CD1-CB 4.18Å; I1072-E1094 VanDerWaalsContact CD1-O 3.3Å; I1072-E1094 WeakPolarHBondContact CD1-O 2.96Å; I1072-E1094 HydrophobicContact CG1-CB 4.15Å; I1072-E1094 HydrophobicContact CG2-CB 3.56Å; Y1076-E1094 WeakPolarHBondContact CE2-OE1 3.03Å; Y1076-E1094 VanDerWaalsContact CZ-OE1 3.28Å; Y1076-E1094 PolarHBondContact OH-OE1 3.15Å; Q1090-E1094 WeakPolarHBondContact O-CB 3.41Å; Q1090-E1094 PolarHBondContact O-N 2.65Å; F1092-E1094 VanDerWaalsContact C-N 3.33Å; F1092-E1094 PolarHBondContact O-N 3.5Å; E1094-F1096 VanDerWaalsContact C-N 3.35Å; E1094-I1098 WeakPolarHBondContact O-CA 3.5Å; E1094-I1098 WeakPolarHBondContact O-CB 3.46Å; E1094-I1098 VanDerWaalsContact O-CG1 3.32Å; E1094-I1098 WeakPolarHBondContact O-CG1 3.25Å; E1094-I1098 PolarHBondContact O-N 3.16Å
1095	V	56.8	Low	52.2	Low	5 Å²	5	53.4 Å²	53.4	3%	0.03	30%	0.296	C	S	.	.	H	α-helix	trans	-73.7	-33.3	173.1	171	0	0	0	0	110.4	L1004 I1069 I1072 V1091 F1092 A1099	L1004-V1095 HydrophobicContact CD2-CB 4.32Å; L1004-V1095 HydrophobicContact CD2-CG1 3.87Å; L1004-V1095 HydrophobicContact CD2-CG2 4.35Å; I1069-V1095 HydrophobicContact CD1-CG1 4.31Å; I1069-V1095 HydrophobicContact CG1-CG1 4.33Å; I1069-V1095 HydrophobicContact CG2-CG2 4.17Å; I1072-V1095 HydrophobicContact CB-CG2 4.42Å; I1072-V1095 HydrophobicContact CD1-CB 4.37Å; I1072-V1095 HydrophobicContact CD1-CG2 3.69Å; I1072-V1095 HydrophobicContact CG2-CG2 4.21Å; V1091-V1095 HydrophobicContact CG1-CG2 4.04Å; V1091-V1095 VanDerWaalsContact O-CB 3.26Å; V1091-V1095 WeakPolarHBondContact O-CB 3.5Å; V1091-V1095 VanDerWaalsContact O-CG2 3.22Å; V1091-V1095 WeakPolarHBondContact O-CG2 3.26Å; V1091-V1095 PolarHBondContact O-N 2.98Å; F1092-V1095 PolarHBondContact O-N 3.32Å; V1095-A1099 WeakPolarHBondContact O-CB 3.46Å; V1095-A1099 PolarHBondContact O-N 3.2Å
1096	F	53.5	Low	50.8	Low	89 Å²	89	57.2 Å²	57.2	39%	0.39	31%	0.306	S	S	.	.	H	α-helix	trans	-73.1	-46	172.1	-163.1	-93.9	0	0	0	110.5	V1050 F1092 E1094 I1098 A1099 C1100	V1050-F1096 HydrophobicContact CG2-CZ 4.15Å; F1092-F1096 WeakPolarHBondContact O-CA 3.3Å; F1092-F1096 WeakPolarHBondContact O-CB 3.36Å; F1092-F1096 PolarHBondContact O-N 3.45Å; E1094-F1096 VanDerWaalsContact C-N 3.35Å; F1096-I1098 PolarHBondContact O-N 3.33Å; F1096-A1099 CarbonylContact O-C 3.57Å; F1096-A1099 WeakPolarHBondContact O-CA 3.44Å; F1096-A1099 VanDerWaalsContact O-CB 3.29Å; F1096-A1099 WeakPolarHBondContact O-CB 3.41Å; F1096-A1099 PolarHBondContact O-N 2.93Å; F1096-C1100 VanDerWaalsContact CE1-SG 3.59Å; F1096-C1100 WeakPolarHBondContact O-CB 3.39Å; F1096-C1100 PolarHBondContact O-N 3.3Å; F1096-C1100 PolarHBondContact O-SG 2.75Å
1097	D	54.4	Low	49.1	Very low	87 Å²	87	61.5 Å²	61.5	47%	0.465	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-36.4	174.2	-96.7	16.9	0	0	0	111.6	A1093 A1099 C1100 N1101	A1093-D1097 WeakPolarHBondContact O-CA 3.18Å; A1093-D1097 WeakPolarHBondContact O-CB 3.34Å; A1093-D1097 PolarHBondContact O-N 3.23Å; D1097-A1099 VanDerWaalsContact C-N 3.31Å; D1097-C1100 PolarHBondContact O-N 2.67Å; D1097-N1101 WeakPolarHBondContact O-CA 3.35Å; D1097-N1101 WeakPolarHBondContact O-CB 3.46Å; D1097-N1101 PolarHBondContact O-N 2.79Å; D1097-N1101 PolarHBondContact O-ND2 3.3Å
1098	I	51.8	Low	47.4	Very low	34 Å²	34	68.9 Å²	68.9	17%	0.174	34%	0.344	C	S	.	.	H	α-helix	trans	-69.9	-31.6	170.9	-72.5	-158	0	0	0	110.2	K1068 I1072 E1094 F1096 I1102	K1068-I1098 HydrophobicContact CB-CD1 4.23Å; K1068-I1098 HydrophobicContact CB-CG2 4.07Å; K1068-I1098 HydrophobicContact CD-CD1 4.07Å; K1068-I1098 HydrophobicContact CD-CG2 3.94Å; K1068-I1098 HydrophobicContact CG-CD1 4.39Å; I1072-I1098 HydrophobicContact CD1-CB 3.93Å; I1072-I1098 HydrophobicContact CD1-CD1 3.66Å; I1072-I1098 HydrophobicContact CD1-CG1 3.86Å; I1072-I1098 HydrophobicContact CG1-CD1 3.89Å; I1072-I1098 HydrophobicContact CG1-CG1 4.49Å; E1094-I1098 WeakPolarHBondContact O-CA 3.5Å; E1094-I1098 WeakPolarHBondContact O-CB 3.46Å; E1094-I1098 VanDerWaalsContact O-CG1 3.32Å; E1094-I1098 WeakPolarHBondContact O-CG1 3.25Å; E1094-I1098 PolarHBondContact O-N 3.16Å; F1096-I1098 PolarHBondContact O-N 3.33Å; I1098-I1102 HydrophobicContact CG2-CD1 3.73Å; I1098-I1102 HydrophobicContact CG2-CG1 4.22Å; I1098-I1102 WeakPolarHBondContact O-CB 3.39Å; I1098-I1102 VanDerWaalsContact O-CD1 3.26Å; I1098-I1102 WeakPolarHBondContact O-CD1 3.39Å; I1098-I1102 WeakPolarHBondContact O-CG1 3.29Å; I1098-I1102 PolarHBondContact O-N 3.41Å
1099	A	44.4	Very low	45.8	Very low	13 Å²	13	70.5 Å²	70.5	11%	0.107	35%	0.353	C	S	.	.	H	α-helix	trans	-63.9	-44.9	167.6	0	0	0	0	0	111.7	V1095 F1096 D1097 I1102 Y1103	V1095-A1099 WeakPolarHBondContact O-CB 3.46Å; V1095-A1099 PolarHBondContact O-N 3.2Å; F1096-A1099 CarbonylContact O-C 3.57Å; F1096-A1099 WeakPolarHBondContact O-CA 3.44Å; F1096-A1099 VanDerWaalsContact O-CB 3.29Å; F1096-A1099 WeakPolarHBondContact O-CB 3.41Å; F1096-A1099 PolarHBondContact O-N 2.93Å; D1097-A1099 VanDerWaalsContact C-N 3.31Å; A1099-I1102 VanDerWaalsContact O-CB 3.3Å; A1099-I1102 WeakPolarHBondContact O-CB 3.37Å; A1099-I1102 PolarHBondContact O-N 2.93Å; A1099-Y1103 WeakPolarHBondContact O-CD2 3.33Å; A1099-Y1103 PolarHBondContact O-N 3.13Å
1100	C	40.2	Very low	44.2	Very low	13 Å²	13	73.5 Å²	73.5	9%	0.088	36%	0.363	C	S	.	.	H	α-helix	trans	-70.5	-38.9	-179.2	-64.9	0	0	0	0	113.2	L1053 F1096 D1097 I1102 Y1103 K1104	L1053-C1100 HydrophobicContact CD1-CB 4.35Å; L1053-C1100 HydrophobicContact CD2-CB 4.08Å; F1096-C1100 VanDerWaalsContact CE1-SG 3.59Å; F1096-C1100 WeakPolarHBondContact O-CB 3.39Å; F1096-C1100 PolarHBondContact O-N 3.3Å; F1096-C1100 PolarHBondContact O-SG 2.75Å; D1097-C1100 PolarHBondContact O-N 2.67Å; C1100-I1102 VanDerWaalsContact C-N 3.29Å; C1100-Y1103 CarbonylContact O-C 3.58Å; C1100-Y1103 WeakPolarHBondContact O-CA 3.4Å; C1100-Y1103 PolarHBondContact O-N 3.06Å; C1100-K1104 PolarHBondContact O-N 2.6Å
1101	N	42.7	Very low	42.3	Very low	73 Å²	73	72 Å²	72	39%	0.39	38%	0.375	S	S	.	.	H	α-helix	trans	-77.3	-13.3	172.2	-65.7	-62.8	0	0	0	112.1	D1097 Y1103 K1104	D1097-N1101 WeakPolarHBondContact O-CA 3.35Å; D1097-N1101 WeakPolarHBondContact O-CB 3.46Å; D1097-N1101 PolarHBondContact O-N 2.79Å; D1097-N1101 PolarHBondContact O-ND2 3.3Å; N1101-Y1103 VanDerWaalsContact C-N 3.3Å; N1101-K1104 VanDerWaalsContact OD1-CD 3.24Å; N1101-K1104 WeakPolarHBondContact OD1-CD 3.43Å; N1101-K1104 WeakPolarHBondContact OD1-CE 3Å; N1101-K1104 PolarHBondContact OD1-NZ 3.17Å
1102	I	40.7	Very low	40.6	Very low	28 Å²	28	80.1 Å²	80.1	14%	0.144	42%	0.417	C	S	.	.	H	α-helix	trans	-74.6	-24.1	162.2	-80.9	170.3	0	0	0	110.9	F1060 V1065 I1098 A1099 C1100	F1060-I1102 HydrophobicContact CD2-CB 4.4Å; F1060-I1102 HydrophobicContact CD2-CG1 4.2Å; F1060-I1102 HydrophobicContact CD2-CG2 3.67Å; F1060-I1102 HydrophobicContact CE1-CD1 3.89Å; F1060-I1102 HydrophobicContact CE1-CG1 4.24Å; F1060-I1102 HydrophobicContact CE2-CB 4.15Å; F1060-I1102 HydrophobicContact CE2-CD1 4.12Å; F1060-I1102 HydrophobicContact CE2-CG1 3.54Å; F1060-I1102 HydrophobicContact CE2-CG2 3.91Å; F1060-I1102 HydrophobicContact CG-CG2 4.08Å; F1060-I1102 HydrophobicContact CZ-CD1 3.66Å; F1060-I1102 HydrophobicContact CZ-CG1 3.55Å; F1060-I1102 HydrophobicContact CZ-CG2 4.46Å; V1065-I1102 HydrophobicContact CG2-CD1 4.48Å; I1098-I1102 HydrophobicContact CG2-CD1 3.73Å; I1098-I1102 HydrophobicContact CG2-CG1 4.22Å; I1098-I1102 WeakPolarHBondContact O-CB 3.39Å; I1098-I1102 VanDerWaalsContact O-CD1 3.26Å; I1098-I1102 WeakPolarHBondContact O-CD1 3.39Å; I1098-I1102 WeakPolarHBondContact O-CG1 3.29Å; I1098-I1102 PolarHBondContact O-N 3.41Å; A1099-I1102 VanDerWaalsContact O-CB 3.3Å; A1099-I1102 WeakPolarHBondContact O-CB 3.37Å; A1099-I1102 PolarHBondContact O-N 2.93Å; C1100-I1102 VanDerWaalsContact C-N 3.29Å
1103	Y	35.7	Very low	39	Very low	50 Å²	50	82.6 Å²	82.6	20%	0.196	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	32.8	173.3	-57.5	-60.5	0	0	0	112.8	L1054 N1056 A1099 C1100 N1101	L1054-Y1103 HydrophobicContact CD2-CD1 3.96Å; L1054-Y1103 HydrophobicContact CD2-CD2 3.46Å; L1054-Y1103 VanDerWaalsContact CD2-CD2 3.46Å; L1054-Y1103 HydrophobicContact CD2-CE1 4.26Å; L1054-Y1103 HydrophobicContact CD2-CE2 3.81Å; L1054-Y1103 HydrophobicContact CD2-CG 3.57Å; L1054-Y1103 HydrophobicContact CG-CD2 4.37Å; N1056-Y1103 CarbonylContact O-C 3.51Å; A1099-Y1103 WeakPolarHBondContact O-CD2 3.33Å; A1099-Y1103 PolarHBondContact O-N 3.13Å; C1100-Y1103 CarbonylContact O-C 3.58Å; C1100-Y1103 WeakPolarHBondContact O-CA 3.4Å; C1100-Y1103 PolarHBondContact O-N 3.06Å; N1101-Y1103 VanDerWaalsContact C-N 3.3Å
1104	K	33.4	Very low	37.4	Very low	127 Å²	127	83 Å²	83	55%	0.552	44%	0.435	S	S	*	.			trans	-99.4	139.6	169.1	-87.3	-172.8	-178.4	165.3	0	111.9	N1056 C1100 N1101	N1056-K1104 CarbonylContact O-C 3.49Å; C1100-K1104 PolarHBondContact O-N 2.6Å; N1101-K1104 VanDerWaalsContact OD1-CD 3.24Å; N1101-K1104 WeakPolarHBondContact OD1-CD 3.43Å; N1101-K1104 WeakPolarHBondContact OD1-CE 3Å; N1101-K1104 PolarHBondContact OD1-NZ 3.17Å
1105	P	29	Very low	35.7	Very low	39 Å²	39	87.2 Å²	87.2	25%	0.253	46%	0.459	S	S	.	.			trans	-81.8	144.6	171	34.2	-31.2	0	0	0	110.1	N1056 N1057	N1056-P1105 HydrophobicContact CB-CG 4.07Å; N1056-P1105 WeakPolarHBondContact O-CD 3.23Å; N1057-P1105 HydrophobicContact CB-CB 3.94Å
1106	N	29.9	Very low	34.2	Very low	157 Å²	157	91.2 Å²	91.2	84%	0.84	48%	0.48	S	S	*	.			trans	-120.6	141.4	151.7	-92.9	25.5	0	0	0	107.6
1107	E	27.4	Very low	32.9	Very low	154 Å²	154	91 Å²	91	72%	0.72	48%	0.479	S	S	*	.			trans	-94.1	-173.5	-164.2	-60.9	157.6	158.4	0	0	113.1	R167	R167-E1107 PolarHBondContact NH1-O 3.07Å
1108	K	27.4	Very low	31.4	Very low	169 Å²	169	94.9 Å²	94.9	74%	0.735	50%	0.495	S	S	*	.			trans	72.2	58.5	161.5	-51.3	180	-178.6	-174.9	0	118.6	R167	R167-K1108 PolarHBondContact NH1-O 3.26Å; R167-K1108 PolarHBondContact NH2-O 2.92Å
1109	E	28.7	Very low	30.1	Very low	77 Å²	77	98.2 Å²	98.2	36%	0.36	51%	0.512	S	S	.	.			trans	-174.1	116.5	148.8	-108.2	171.8	-127.6	0	0	106	Q163 R167	Q163-E1109 WeakPolarHBondContact CB-OE2 3.12Å; R167-E1109 WeakPolarHBondContact CD-OE2 3.11Å; R167-E1109 IonicContact CZ-OE1 3.86Å; R167-E1109 IonicContact CZ-OE2 3.56Å; R167-E1109 IonicContact NE-OE1 3.07Å; R167-E1109 PolarHBondContact NE-OE1 3.07Å; R167-E1109 IonicContact NE-OE2 3.13Å; R167-E1109 PolarHBondContact NE-OE2 3.42Å; R167-E1109 IonicContact NH2-OE1 2.98Å; R167-E1109 PolarHBondContact NH2-OE1 3.09Å; R167-E1109 IonicContact NH2-OE2 3.63Å
1110	E	26.5	Very low	29.1	Very low	178 Å²	178	103.9 Å²	103.9	83%	0.832	54%	0.539	S	S	*	.			cis	64.6	125.4	34.5	-50.9	-178.9	-173.2	0	0	113.2
1111	G	25.1	Very low	28.4	Very low	72 Å²	72	112 Å²	112	74%	0.742	57%	0.568	S	S	*	*			trans	138.6	-24.5	175.4	0	0	0	0	0	116.8
1112	L	25.3	Very low	27.6	Very low	169 Å²	169	112.2 Å²	112.2	89%	0.885	57%	0.574	S	S	*	*	S	Bend	trans	-137	92	173.8	-83.5	171.8	0	0	0	110.5
1113	S	25.4	Very low	26.9	Very low	91 Å²	91	116.8 Å²	116.8	64%	0.636	61%	0.608	S	S	*	*			trans	-78.7	120.2	-179.2	45.3	0	0	0	0	112	N1115	S1113-N1115 VanDerWaalsContact C-N 3.32Å
1114	L	25.5	Very low	26.7	Very low	60 Å²	60	118.9 Å²	118.9	31%	0.314	63%	0.63	S	S	.	*			trans	-101.6	15.3	147.2	-127.3	173	0	0	0	110.7	N1116 F1117 L1333	L1114-N1116 PolarHBondContact O-N 2.79Å; L1114-F1117 HydrophobicContact CD2-CD2 4.07Å; L1114-L1333 HydrophobicContact CD1-CD2 3.38Å
1115	N	26.8	Very low	26.5	Very low	146 Å²	146	120.1 Å²	120.1	78%	0.781	64%	0.638	S	S	*	*			trans	-74	59	-179.7	-59.5	20.1	0	0	0	111.3	S1113	S1113-N1115 VanDerWaalsContact C-N 3.32Å
1116	N	24.9	Very low	26.5	Very low	90 Å²	90	121.9 Å²	121.9	48%	0.481	66%	0.656	S	S	.	*	S	Bend	trans	-139.1	29.7	168.1	-115.1	-53.7	0	0	0	109.8	L1114 R1360	L1114-N1116 PolarHBondContact O-N 2.79Å; N1116-R1360 PolarHBondContact OD1-NE 3.09Å; N1116-R1360 PolarHBondContact OD1-NH2 3.3Å
1117	F	26.3	Very low	26.5	Very low	83 Å²	83	123.4 Å²	123.4	36%	0.364	66%	0.658	S	S	.	*			trans	-141.2	95.2	172.4	-81	-66	0	0	0	110	L1114 L1119 L1361	L1114-F1117 HydrophobicContact CD2-CD2 4.07Å; F1117-L1119 PolarHBondContact O-N 2.98Å; F1117-L1361 WeakPolarHBondContact CE1-O 3.48Å; F1117-L1361 HydrophobicContact CZ-CB 3.94Å; F1117-L1361 VanDerWaalsContact CZ-N 3.35Å; F1117-L1361 WeakPolarHBondContact CZ-O 3.44Å
1118	E	22.8	Very low	26.6	Very low	170 Å²	170	122 Å²	122	79%	0.794	66%	0.66	S	S	*	*			trans	-68.6	111.6	155.6	-65.1	-173	119.6	0	0	108.3	I1120	E1118-I1120 HydrophobicContact CB-CG1 4.22Å
1119	L	24.7	Very low	26.6	Very low	104 Å²	104	119.6 Å²	119.6	55%	0.545	66%	0.66	S	S	.	*			trans	-97.7	76.3	158.2	-88.5	166.3	0	0	0	107	F1117 W1121 K1329	F1117-L1119 PolarHBondContact O-N 2.98Å; L1119-W1121 PolarHBondContact O-N 3.04Å; L1119-K1329 HydrophobicContact CD1-CD 3.92Å
1120	I	22.9	Very low	26.4	Very low	132 Å²	132	121.4 Å²	121.4	68%	0.677	68%	0.681	S	S	*	*			trans	-58	104.5	165.7	-62.2	169	0	0	0	106.4	E1118	E1118-I1120 HydrophobicContact CB-CG1 4.22Å
1121	W	26.2	Very low	26.7	Very low	182 Å²	182	121.6 Å²	121.6	69%	0.689	68%	0.682	S	S	*	*			trans	-84.5	122.3	165.7	-149.8	-75.7	0	0	0	106.5	L1119 S1123	L1119-W1121 PolarHBondContact O-N 3.04Å; W1121-S1123 PolarHBondContact O-N 3.14Å
1122	P	24.8	Very low	26.9	Very low	78 Å²	78	127 Å²	127	51%	0.506	69%	0.685	S	S	.	*			trans	-60.2	98.1	-177.2	-27.1	36.6	0	0	0	111.7	S1124	P1122-S1124 PolarHBondContact O-N 3.45Å
1123	S	26.9	Very low	27.2	Very low	125 Å²	125	123.5 Å²	123.5	87%	0.874	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	55	-173.2	58.2	0	0	0	0	111.6	W1121	W1121-S1123 PolarHBondContact O-N 3.14Å
1124	S	31.2	Very low	27.8	Very low	93 Å²	93	122.4 Å²	122.4	65%	0.65	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.4	-39	179.6	54.4	0	0	0	0	113.7	P1122	P1122-S1124 PolarHBondContact O-N 3.45Å
1125	Q	28.9	Very low	28.3	Very low	153 Å²	153	125.5 Å²	125.5	72%	0.715	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-11.6	-166.8	-71.5	-177.8	-16.8	0	0	116.4	Q1127 T1128	Q1125-Q1127 PolarHBondContact O-N 2.62Å; Q1125-T1128 PolarHBondContact O-OG1 3.38Å
1126	A	29.3	Very low	28.8	Very low	77 Å²	77	123.2 Å²	123.2	64%	0.636	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	14.1	-171.1	0	0	0	0	0	116.1
1127	Q	30	Very low	29.5	Very low	188 Å²	188	121.2 Å²	121.2	88%	0.879	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-7.4	-176.6	-70.8	-170.9	-10.8	0	0	114.6	Q1125	Q1125-Q1127 PolarHBondContact O-N 2.62Å
1128	T	28.2	Very low	29.9	Very low	125 Å²	125	119.2 Å²	119.2	77%	0.767	64%	0.642	S	S	*	*	S	Bend	trans	-118.9	-1.8	-161.3	47.5	0	0	0	0	116.9	Q1125	Q1125-T1128 PolarHBondContact O-OG1 3.38Å
1129	T	27.7	Very low	30.6	Very low	119 Å²	119	116.1 Å²	116.1	73%	0.73	62%	0.624	S	S	*	*			trans	-120.3	109.5	-179.8	56.1	0	0	0	0	113.1	E1131	T1129-E1131 PolarHBondContact O-N 3.12Å
1130	S	25.1	Very low	31.4	Very low	115 Å²	115	119.1 Å²	119.1	80%	0.804	63%	0.628	S	S	*	*			trans	-93.9	89.9	-174.5	-179.3	0	0	0	0	113.2
1131	E	31.6	Very low	32.3	Very low	181 Å²	181	117.1 Å²	117.1	85%	0.846	61%	0.612	S	S	*	*			trans	-101.8	123.1	161.1	-74.1	-147.9	123	0	0	111.3	T1129 L1133	T1129-E1131 PolarHBondContact O-N 3.12Å; E1131-L1133 PolarHBondContact O-N 3.36Å
1132	K	31	Very low	32.8	Very low	185 Å²	185	109.9 Å²	109.9	80%	0.804	59%	0.591	S	S	*	*			trans	-73.5	119.4	-177.4	-70.4	170.2	-178.5	165.3	0	110.5	T1134	K1132-T1134 VanDerWaalsContact O-CG2 3.24Å; K1132-T1134 WeakPolarHBondContact O-CG2 3.33Å; K1132-T1134 PolarHBondContact O-N 3.06Å
1133	L	31.7	Very low	33.5	Very low	96 Å²	96	107 Å²	107	50%	0.503	57%	0.571	S	S	.	*			trans	-53.4	97.3	171.4	-111.1	161.6	0	0	0	111.5	E1131 T1137 V1138	E1131-L1133 PolarHBondContact O-N 3.36Å; L1133-T1137 HydrophobicContact CD2-CG2 4.27Å; L1133-V1138 HydrophobicContact CD2-CG2 4.26Å
1134	T	37.9	Very low	34.1	Very low	69 Å²	69	101.3 Å²	101.3	42%	0.423	53%	0.531	S	S	.	.			trans	-76.9	156.7	-175.6	78.3	0	0	0	0	111.7	K1132 N1136 T1137 V1138	K1132-T1134 VanDerWaalsContact O-CG2 3.24Å; K1132-T1134 WeakPolarHBondContact O-CG2 3.33Å; K1132-T1134 PolarHBondContact O-N 3.06Å; T1134-N1136 PolarHBondContact O-N 3.45Å; T1134-N1136 PolarHBondContact OG1-N 3.07Å; T1134-T1137 PolarHBondContact O-N 3.43Å; T1134-T1137 VanDerWaalsContact O-N 3.12Å; T1134-T1137 PolarHBondContact OG1-N 3.28Å; T1134-T1137 VanDerWaalsContact OG1-N 3.1Å; T1134-T1137 PolarHBondContact OG1-OG1 3.16Å; T1134-V1138 PolarHBondContact O-N 3.04Å
1135	E	35.6	Very low	34.4	Very low	125 Å²	125	97.8 Å²	97.8	58%	0.584	51%	0.505	S	S	*	.	H	α-helix	trans	-59.3	-33.8	172.2	-162.4	-172	147.6	0	0	111.7	T1137 V1138 R1139	E1135-T1137 PolarHBondContact O-N 2.84Å; E1135-V1138 PolarHBondContact O-N 3.11Å; E1135-R1139 HydrophobicContact CG-CG 4.47Å; E1135-R1139 WeakPolarHBondContact O-CB 3.38Å; E1135-R1139 VanDerWaalsContact O-CG 3.23Å; E1135-R1139 WeakPolarHBondContact O-CG 3.23Å; E1135-R1139 PolarHBondContact O-N 3.18Å; E1135-R1139 IonicContact OE1-CZ 2.64Å; E1135-R1139 IonicContact OE1-NE 3.44Å; E1135-R1139 PolarHBondContact OE1-NE 2.81Å; E1135-R1139 IonicContact OE1-NH2 3.83Å; E1135-R1139 PolarHBondContact OE1-NH2 3.18Å
1136	N	36.9	Very low	34.9	Very low	97 Å²	97	91.5 Å²	91.5	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-62.6	-39.1	175	-90	-25.3	0	0	0	112.7	T1134 R1139 R1140	T1134-N1136 PolarHBondContact O-N 3.45Å; T1134-N1136 PolarHBondContact OG1-N 3.07Å; N1136-R1139 PolarHBondContact O-N 3.29Å; N1136-R1140 VanDerWaalsContact O-CG 3.32Å; N1136-R1140 WeakPolarHBondContact O-CG 3.43Å; N1136-R1140 PolarHBondContact O-N 2.94Å
1137	T	39.2	Very low	35.4	Very low	49 Å²	49	88.1 Å²	88.1	30%	0.301	45%	0.448	S	S	.	.	H	α-helix	trans	-62.8	-46.5	177.8	-42	0	0	0	0	110.5	L1133 T1134 E1135 R1140 W1141	L1133-T1137 HydrophobicContact CD2-CG2 4.27Å; T1134-T1137 PolarHBondContact O-N 3.43Å; T1134-T1137 VanDerWaalsContact O-N 3.12Å; T1134-T1137 PolarHBondContact OG1-N 3.28Å; T1134-T1137 VanDerWaalsContact OG1-N 3.1Å; T1134-T1137 PolarHBondContact OG1-OG1 3.16Å; E1135-T1137 PolarHBondContact O-N 2.84Å; T1137-R1140 PolarHBondContact O-N 2.62Å; T1137-W1141 PolarHBondContact O-N 2.79Å; T1137-W1141 VanDerWaalsContact O-N 3.11Å
1138	V	36.2	Very low	35.8	Very low	40 Å²	40	79.7 Å²	79.7	24%	0.242	41%	0.409	C	S	.	.	H	α-helix	trans	-65.1	-41.8	177.4	-177.8	0	0	0	0	111.7	L1133 T1134 E1135 W1141 A1142	L1133-V1138 HydrophobicContact CD2-CG2 4.26Å; T1134-V1138 PolarHBondContact O-N 3.04Å; E1135-V1138 PolarHBondContact O-N 3.11Å; V1138-W1141 PolarHBondContact O-N 2.94Å; V1138-A1142 PolarHBondContact O-N 3.23Å
1139	R	37.6	Very low	36.2	Very low	106 Å²	106	76 Å²	76	40%	0.4	40%	0.396	S	S	.	.	H	α-helix	trans	-60.6	-43.1	175	-74.8	168.1	173.2	-134.3	6.6	112.1	E1135 N1136 A1142 L1143 N1220	E1135-R1139 HydrophobicContact CG-CG 4.47Å; E1135-R1139 WeakPolarHBondContact O-CB 3.38Å; E1135-R1139 VanDerWaalsContact O-CG 3.23Å; E1135-R1139 WeakPolarHBondContact O-CG 3.23Å; E1135-R1139 PolarHBondContact O-N 3.18Å; E1135-R1139 IonicContact OE1-CZ 2.64Å; E1135-R1139 IonicContact OE1-NE 3.44Å; E1135-R1139 PolarHBondContact OE1-NE 2.81Å; E1135-R1139 IonicContact OE1-NH2 3.83Å; E1135-R1139 PolarHBondContact OE1-NH2 3.18Å; N1136-R1139 PolarHBondContact O-N 3.29Å; R1139-A1142 PolarHBondContact O-N 3.02Å; R1139-L1143 WeakPolarHBondContact O-CB 3.38Å; R1139-L1143 PolarHBondContact O-N 3.47Å; R1139-N1220 PolarHBondContact NH1-OD1 3.05Å
1140	R	40.9	Very low	36.6	Very low	167 Å²	167	73 Å²	73	63%	0.63	38%	0.379	S	S	*	.	H	α-helix	trans	-63.1	-45.1	176.9	-73.7	177.1	-169.1	177.9	6.5	112	N1136 T1137 L1143 S1144	N1136-R1140 VanDerWaalsContact O-CG 3.32Å; N1136-R1140 WeakPolarHBondContact O-CG 3.43Å; N1136-R1140 PolarHBondContact O-N 2.94Å; T1137-R1140 PolarHBondContact O-N 2.62Å; R1140-L1143 WeakPolarHBondContact O-CB 3.22Å; R1140-L1143 PolarHBondContact O-N 3.05Å; R1140-S1144 PolarHBondContact O-N 3.46Å; R1140-S1144 VanDerWaalsContact O-N 3.11Å
1141	W	41.8	Very low	37.1	Very low	90 Å²	90	69.3 Å²	69.3	34%	0.341	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-45.6	176.4	-73.6	7.4	0	0	0	111.9	T1137 V1138 L1143 S1144 N1145 A1326	T1137-W1141 PolarHBondContact O-N 2.79Å; T1137-W1141 VanDerWaalsContact O-N 3.11Å; V1138-W1141 PolarHBondContact O-N 2.94Å; W1141-L1143 PolarHBondContact O-N 3.34Å; W1141-S1144 PolarHBondContact O-N 3.3Å; W1141-N1145 PolarHBondContact O-N 3.48Å; W1141-N1145 PolarHBondContact O-ND2 3.47Å; W1141-N1145 PolarHBondContact O-OD1 2.93Å; W1141-A1326 HydrophobicContact CZ2-CB 4.18Å
1142	A	37.2	Very low	37.2	Very low	30 Å²	30	62.6 Å²	62.6	25%	0.248	33%	0.326	C	S	.	.	H	α-helix	trans	-59	-35.5	175.5	0	0	0	0	0	112.7	F1018 V1138 R1139 V1146	F1018-A1142 HydrophobicContact CZ-CB 4.15Å; V1138-A1142 PolarHBondContact O-N 3.23Å; R1139-A1142 PolarHBondContact O-N 3.02Å; A1142-V1146 WeakPolarHBondContact O-CG2 3.15Å; A1142-V1146 PolarHBondContact O-N 3.09Å
1143	L	39.7	Very low	37.2	Very low	18 Å²	18	57.3 Å²	57.3	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-56.4	178.3	-169.8	68.1	0	0	0	111.9	R1139 R1140 W1141 N1145 V1146 I1147 F1217 C1222 F1225	R1139-L1143 WeakPolarHBondContact O-CB 3.38Å; R1139-L1143 PolarHBondContact O-N 3.47Å; R1140-L1143 WeakPolarHBondContact O-CB 3.22Å; R1140-L1143 PolarHBondContact O-N 3.05Å; W1141-L1143 PolarHBondContact O-N 3.34Å; L1143-N1145 PolarHBondContact O-N 3.16Å; L1143-V1146 PolarHBondContact O-N 3.32Å; L1143-I1147 HydrophobicContact CD1-CD1 3.74Å; L1143-I1147 HydrophobicContact CG-CD1 3.79Å; L1143-I1147 WeakPolarHBondContact O-CD1 3.47Å; L1143-I1147 PolarHBondContact O-N 3.03Å; L1143-F1217 HydrophobicContact CD1-CD1 4.45Å; L1143-F1217 HydrophobicContact CD1-CE1 3.43Å; L1143-F1217 VanDerWaalsContact CD1-CE1 3.43Å; L1143-F1217 HydrophobicContact CD1-CZ 3.59Å; L1143-C1222 HydrophobicContact CD2-CB 4.4Å; L1143-F1225 HydrophobicContact CD2-CB 3.97Å; L1143-F1225 HydrophobicContact CD2-CD2 3.66Å; L1143-F1225 HydrophobicContact CD2-CE2 4.49Å; L1143-F1225 HydrophobicContact CD2-CG 3.96Å; L1143-F1225 HydrophobicContact CG-CD2 4.11Å; L1143-F1225 HydrophobicContact CG-CE2 4.48Å
1144	S	38.5	Very low	37.1	Very low	4 Å²	4	55.9 Å²	55.9	3%	0.028	31%	0.305	C	S	.	.	H	α-helix	trans	-53.5	-40.3	178.5	-64.8	0	0	0	0	112.2	R1140 W1141 I1147 V1148 A1251	R1140-S1144 PolarHBondContact O-N 3.46Å; R1140-S1144 VanDerWaalsContact O-N 3.11Å; W1141-S1144 PolarHBondContact O-N 3.3Å; S1144-I1147 PolarHBondContact O-N 3.04Å; S1144-V1148 WeakPolarHBondContact O-CG2 3.37Å; S1144-V1148 PolarHBondContact O-N 2.82Å; S1144-A1251 WeakPolarHBondContact OG-CB 3.4Å
1145	N	37.9	Very low	36.7	Very low	19 Å²	19	59.1 Å²	59.1	10%	0.102	32%	0.32	C	S	.	.	H	α-helix	trans	-71.5	-37.1	-174.7	-58.3	6.3	0	0	0	111.6	F1018 W1021 W1141 L1143 G1149 M1330	F1018-N1145 HydrophobicContact CD1-CB 4.15Å; F1018-N1145 HydrophobicContact CE1-CB 3.79Å; F1018-N1145 WeakPolarHBondContact CE1-ND2 3.49Å; W1021-N1145 HydrophobicContact CE3-CB 4.14Å; W1021-N1145 WeakPolarHBondContact CZ3-OD1 3.44Å; W1141-N1145 PolarHBondContact O-N 3.48Å; W1141-N1145 PolarHBondContact O-ND2 3.47Å; W1141-N1145 PolarHBondContact O-OD1 2.93Å; L1143-N1145 PolarHBondContact O-N 3.16Å; N1145-G1149 PolarHBondContact O-N 3.28Å; N1145-M1330 HydrophobicContact CB-CE 4.39Å
1146	V	39.1	Very low	36.2	Very low	21 Å²	21	57.8 Å²	57.8	13%	0.127	32%	0.317	C	S	.	.	H	α-helix	trans	-66.6	-37.5	172.6	166.9	0	0	0	0	111.4	I1017 A1142 L1143 S1150 F1213 F1217	I1017-V1146 HydrophobicContact CG2-CG2 3.74Å; A1142-V1146 WeakPolarHBondContact O-CG2 3.15Å; A1142-V1146 PolarHBondContact O-N 3.09Å; L1143-V1146 PolarHBondContact O-N 3.32Å; V1146-S1150 WeakPolarHBondContact O-CB 3.28Å; V1146-S1150 PolarHBondContact O-N 2.83Å; V1146-S1150 PolarHBondContact O-OG 2.92Å; V1146-F1213 HydrophobicContact CG1-CD2 3.97Å; V1146-F1213 HydrophobicContact CG1-CE2 3.83Å; V1146-F1217 HydrophobicContact CG1-CE2 4.4Å; V1146-F1217 HydrophobicContact CG1-CZ 4.32Å
1147	I	39.3	Very low	35.6	Very low	7 Å²	7	56.9 Å²	56.9	4%	0.036	32%	0.316	C	S	.	.	H	α-helix	trans	-70.6	-52.9	178	-85.7	110	0	0	0	111.7	L1143 S1144 G1149 S1150 L1151 F1213 F1225 C1255	L1143-I1147 HydrophobicContact CD1-CD1 3.74Å; L1143-I1147 HydrophobicContact CG-CD1 3.79Å; L1143-I1147 WeakPolarHBondContact O-CD1 3.47Å; L1143-I1147 PolarHBondContact O-N 3.03Å; S1144-I1147 PolarHBondContact O-N 3.04Å; I1147-G1149 VanDerWaalsContact C-N 3.27Å; I1147-G1149 PolarHBondContact O-N 2.96Å; I1147-S1150 WeakPolarHBondContact O-CA 3.29Å; I1147-S1150 WeakPolarHBondContact O-CB 3.41Å; I1147-S1150 PolarHBondContact O-N 3Å; I1147-L1151 HydrophobicContact CG2-CD1 3.47Å; I1147-L1151 VanDerWaalsContact CG2-CD1 3.47Å; I1147-L1151 WeakPolarHBondContact O-CD1 3.28Å; I1147-L1151 WeakPolarHBondContact O-CG 3.45Å; I1147-L1151 PolarHBondContact O-N 3.38Å; I1147-F1213 HydrophobicContact CD1-CZ 4.38Å; I1147-F1213 HydrophobicContact CG1-CE2 4.41Å; I1147-F1213 HydrophobicContact CG1-CZ 4.35Å; I1147-F1225 HydrophobicContact CB-CE2 4.39Å; I1147-F1225 HydrophobicContact CB-CZ 4.13Å; I1147-F1225 HydrophobicContact CD1-CD2 4.31Å; I1147-F1225 HydrophobicContact CD1-CE1 4.02Å; I1147-F1225 HydrophobicContact CD1-CE2 3.54Å; I1147-F1225 HydrophobicContact CD1-CZ 3.39Å; I1147-F1225 HydrophobicContact CG1-CE1 4.18Å; I1147-F1225 HydrophobicContact CG1-CE2 3.97Å; I1147-F1225 HydrophobicContact CG1-CZ 3.45Å; I1147-F1225 VanDerWaalsContact CG1-CZ 3.45Å; I1147-F1225 HydrophobicContact CG2-CE2 4.26Å; I1147-F1225 HydrophobicContact CG2-CZ 3.87Å; I1147-C1255 HydrophobicContact CG2-CB 4.31Å
1148	V	38	Very low	35	Very low	11 Å²	11	58.7 Å²	58.7	7%	0.067	32%	0.323	C	S	.	.	H	α-helix	trans	-59	-40.6	175.6	174.5	0	0	0	0	111.2	W1021 S1144 S1150 L1151 A1152 V1254 M1330	W1021-V1148 HydrophobicContact CH2-CB 4.01Å; W1021-V1148 HydrophobicContact CH2-CG1 3.67Å; W1021-V1148 HydrophobicContact CH2-CG2 4.12Å; W1021-V1148 HydrophobicContact CZ2-CG1 4.23Å; W1021-V1148 HydrophobicContact CZ3-CB 4.48Å; W1021-V1148 HydrophobicContact CZ3-CG2 4.46Å; S1144-V1148 WeakPolarHBondContact O-CG2 3.37Å; S1144-V1148 PolarHBondContact O-N 2.82Å; V1148-S1150 PolarHBondContact O-N 2.69Å; V1148-L1151 PolarHBondContact O-N 3.17Å; V1148-A1152 PolarHBondContact O-N 2.98Å; V1148-A1152 VanDerWaalsContact O-N 3.08Å; V1148-V1254 HydrophobicContact CG2-CG1 3.72Å; V1148-M1330 HydrophobicContact CB-CE 4.22Å; V1148-M1330 HydrophobicContact CG1-CE 4.12Å
1149	G	36.8	Very low	34.5	Very low	47 Å²	47	64.6 Å²	64.6	49%	0.485	35%	0.348	S	S	.	.	H	α-helix	trans	-64.5	-19.6	173.6	0	0	0	0	0	114.9	N1145 I1147 S1153	N1145-G1149 PolarHBondContact O-N 3.28Å; I1147-G1149 VanDerWaalsContact C-N 3.27Å; I1147-G1149 PolarHBondContact O-N 2.96Å; G1149-S1153 WeakPolarHBondContact O-CB 3.45Å
1150	S	37.4	Very low	33.8	Very low	55 Å²	55	66.2 Å²	66.2	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-88.5	-32.2	172.6	-57.9	0	0	0	0	112.3	V1146 I1147 V1148 S1153	V1146-S1150 WeakPolarHBondContact O-CB 3.28Å; V1146-S1150 PolarHBondContact O-N 2.83Å; V1146-S1150 PolarHBondContact O-OG 2.92Å; I1147-S1150 WeakPolarHBondContact O-CA 3.29Å; I1147-S1150 WeakPolarHBondContact O-CB 3.41Å; I1147-S1150 PolarHBondContact O-N 3Å; V1148-S1150 PolarHBondContact O-N 2.69Å; S1150-S1153 WeakPolarHBondContact O-CB 3.3Å; S1150-S1153 PolarHBondContact O-N 3.43Å
1151	L	35.9	Very low	33	Very low	39 Å²	39	69.3 Å²	69.3	20%	0.204	38%	0.376	C	S	.	.	H	α-helix	trans	-82	-16.2	-177.6	-68.9	155.2	0	0	0	113.7	I1147 V1148 A1258 K1338	I1147-L1151 HydrophobicContact CG2-CD1 3.47Å; I1147-L1151 VanDerWaalsContact CG2-CD1 3.47Å; I1147-L1151 WeakPolarHBondContact O-CD1 3.28Å; I1147-L1151 WeakPolarHBondContact O-CG 3.45Å; I1147-L1151 PolarHBondContact O-N 3.38Å; V1148-L1151 PolarHBondContact O-N 3.17Å; L1151-A1258 HydrophobicContact CB-CB 4.05Å; L1151-A1258 HydrophobicContact CD1-CB 3.37Å; L1151-A1258 HydrophobicContact CD2-CB 3.72Å; L1151-A1258 HydrophobicContact CG-CB 3.89Å; L1151-K1338 PolarHBondContact O-NZ 3.45Å
1152	A	32.7	Very low	32.1	Very low	39 Å²	39	71.8 Å²	71.8	32%	0.322	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	28.7	166	0	0	0	0	0	112.2	V1148	V1148-A1152 PolarHBondContact O-N 2.98Å; V1148-A1152 VanDerWaalsContact O-N 3.08Å
1153	S	31.9	Very low	31.5	Very low	74 Å²	74	76.2 Å²	76.2	52%	0.517	41%	0.412	S	S	.	.			trans	-139.8	54.9	-171.8	177.7	0	0	0	0	113.4	G1149 S1150 N1155	G1149-S1153 WeakPolarHBondContact O-CB 3.45Å; S1150-S1153 WeakPolarHBondContact O-CB 3.3Å; S1150-S1153 PolarHBondContact O-N 3.43Å; S1153-N1155 PolarHBondContact O-N 3.46Å
1154	D	29	Very low	30.7	Very low	67 Å²	67	83.4 Å²	83.4	36%	0.358	45%	0.446	S	S	.	.			trans	-65.5	124.4	161.5	-65	-42.9	0	0	0	110.2	R1345	D1154-R1345 IonicContact OD2-NH2 3.94Å; D1154-R1345 PolarHBondContact OD2-NH2 2.8Å
1155	N	29.4	Very low	30	Very low	136 Å²	136	91.2 Å²	91.2	73%	0.727	48%	0.479	S	S	*	.	S	Bend	trans	65	124.4	167.5	-49.1	-53.4	0	0	0	117.9	S1153	S1153-N1155 PolarHBondContact O-N 3.46Å
1156	D	25.7	Very low	29.4	Very low	98 Å²	98	96.1 Å²	96.1	52%	0.524	51%	0.514	S	S	.	.			cis	-156.4	131.6	-2.1	157.4	34.1	0	0	0	108	L1158	D1156-L1158 PolarHBondContact OD1-N 3.49Å
1157	P	23	Very low	28.6	Very low	77 Å²	77	100 Å²	100	50%	0.5	54%	0.539	S	S	.	.	S	Bend	trans	-122.5	23.8	172.1	40.9	-30.2	0	0	0	115.8	C1210	P1157-C1210 HydrophobicContact CG-CB 4.09Å
1158	L	26.1	Very low	27.9	Very low	87 Å²	87	107 Å²	107	46%	0.455	58%	0.575	S	S	.	*			trans	-129	11.6	-168.9	-91.9	177.5	0	0	0	120.4	D1156 L1160 N1208	D1156-L1158 PolarHBondContact OD1-N 3.49Å; L1158-L1160 VanDerWaalsContact C-N 3.27Å; L1158-L1160 PolarHBondContact O-N 3.5Å; L1158-N1208 HydrophobicContact CD1-CB 4.03Å
1159	Q	26.5	Very low	27.2	Very low	164 Å²	164	109.1 Å²	109.1	77%	0.766	59%	0.594	S	S	*	*			trans	-77.3	70.4	162	-75.9	-109.4	13	0	0	112.7
1160	L	23.4	Very low	26.6	Very low	141 Å²	141	116 Å²	116	74%	0.738	61%	0.61	S	S	*	*			trans	-112.2	34.2	173.2	-118	174.9	0	0	0	113.5	L1158	L1158-L1160 VanDerWaalsContact C-N 3.27Å; L1158-L1160 PolarHBondContact O-N 3.5Å
1161	R	24.1	Very low	25.9	Very low	232 Å²	232	121 Å²	121	88%	0.875	63%	0.628	S	S	*	*			trans	-80.2	136.5	167.4	-77	-175.4	172.5	172	0.8	110.6
1162	Y	21.8	Very low	25.3	Very low	142 Å²	142	126 Å²	126	56%	0.557	65%	0.65	S	S	*	*			trans	-74.2	143.1	174.6	-71	-114.6	0	0	0	109.9
1163	P	24.7	Very low	24.9	Very low	122 Å²	122	130.4 Å²	130.4	79%	0.792	66%	0.664	S	S	*	*				-108.7	161.6	126.2	31.8	-33.2	0	0	0	111.3
1164	E	24.2	Very low	24.6	Very low	169 Å²	169	135.2 Å²	135.2	79%	0.79	68%	0.676	S	S	*	*			trans	-80.1	145.3	-179.1	-66.7	179.5	117.1	0	0	111.9
1165	K	23.8	Very low	24.4	Very low	169 Å²	169	136.8 Å²	136.8	74%	0.735	69%	0.688	S	S	*	*			trans	-23.1	130.8	145.7	-67.9	176.4	154.6	-155.6	0	113.3
1166	C	23.6	Very low	24.2	Very low	122 Å²	122	137.2 Å²	137.2	82%	0.824	69%	0.688	S	S	*	*				-158.2	165.5	92.3	-104.7	0	0	0	0	111.7
1167	P	24.1	Very low	24.2	Very low	103 Å²	103	135.3 Å²	135.3	67%	0.669	68%	0.683	S	S	*	*			trans	-116.7	172.7	-163.5	43.2	-33.1	0	0	0	114.2
1168	I	23.7	Very low	24.5	Very low	154 Å²	154	135.1 Å²	135.1	79%	0.79	68%	0.678	S	S	*	*			trans	64.8	119.4	162	-61.4	153.7	0	0	0	115.6
1169	A	23.3	Very low	24.7	Very low	55 Å²	55	137.9 Å²	137.9	46%	0.455	69%	0.691	S	S	.	*			trans	-109.2	136.7	143.9	0	0	0	0	0	107.7	I235	I235-A1169 HydrophobicContact CD1-CB 3.69Å; I235-A1169 HydrophobicContact CG1-CB 3.93Å
1170	K	23.8	Very low	24.8	Very low	190 Å²	190	131.2 Å²	131.2	83%	0.826	66%	0.664	S	S	*	*			trans	-120.9	150	141.8	-87.8	-163.3	172	-165.9	0	107
1171	Q	24	Very low	25.3	Very low	162 Å²	162	128.7 Å²	128.7	76%	0.757	65%	0.649	S	S	*	*			trans	-32	156.7	157.9	-76.9	146	-40.8	0	0	114.4
1172	Q	23.5	Very low	25.7	Very low	144 Å²	144	121.7 Å²	121.7	67%	0.673	63%	0.626	S	S	*	*			cis	-165.9	167.1	23.7	-131.6	158.7	-42.3	0	0	112.7
1173	H	24.1	Very low	26.2	Very low	131 Å²	131	118.7 Å²	118.7	61%	0.606	62%	0.622	S	S	*	*			trans	59.9	123.1	156.8	-69.6	-54.2	0	0	0	118.4
1174	F	24.3	Very low	26.4	Very low	175 Å²	175	120.4 Å²	120.4	77%	0.768	63%	0.625	S	S	*	*				118.8	152.9	50.4	-103.5	-143.5	0	0	0	107.4
1175	T	25.2	Very low	26.8	Very low	100 Å²	100	115.6 Å²	115.6	61%	0.613	62%	0.62	S	S	*	*			cis	-163.1	179.5	-4.3	2.7	0	0	0	0	111
1176	I	25.3	Very low	27.1	Very low	144 Å²	144	114.2 Å²	114.2	74%	0.738	63%	0.627	S	S	*	*			trans	72.1	142.9	149.5	-76.9	158.3	0	0	0	118.2
1177	S	26.4	Very low	27.3	Very low	59 Å²	59	113.5 Å²	113.5	41%	0.413	62%	0.618	S	S	.	*			cis	-158	130.2	-10	42.5	0	0	0	0	110.6	R320	R320-S1177 PolarHBondContact NH1-O 2.93Å; R320-S1177 VanDerWaalsContact NH1-O 3.11Å; R320-S1177 PolarHBondContact NH2-O 2.93Å
1178	D	28.1	Very low	27.4	Very low	73 Å²	73	119.4 Å²	119.4	39%	0.39	63%	0.627	S	S	.	*				109.6	144.6	67.8	-59.2	-27.1	0	0	0	114.7	R320 R323	R320-D1178 PolarHBondContact NH1-O 3.01Å; R323-D1178 IonicContact CZ-OD1 3.14Å; R323-D1178 IonicContact NH1-OD1 3.97Å; R323-D1178 PolarHBondContact NH1-OD1 3.05Å; R323-D1178 IonicContact NH2-OD1 3.38Å; R323-D1178 PolarHBondContact NH2-OD1 3.22Å
1179	I	31.4	Very low	27.5	Very low	145 Å²	145	117.3 Å²	117.3	74%	0.744	63%	0.626	S	S	*	*			trans	83.7	152	166.5	-57.3	149.1	0	0	0	119.2
1180	A	29.3	Very low	27.7	Very low	24 Å²	24	119.4 Å²	119.4	20%	0.198	64%	0.643	C	S	.	*				157.4	143.5	-68.1	0	0	0	0	0	115.6	K312	K312-A1180 VanDerWaalsContact CB-C 3.5Å; K312-A1180 WeakPolarHBondContact CB-O 3.42Å; K312-A1180 CarbonylContact O-C 3.58Å; K312-A1180 PolarHBondContact O-N 2.73Å
1181	E	31.8	Very low	27.8	Very low	88 Å²	88	113.8 Å²	113.8	41%	0.411	64%	0.639	S	S	.	*			trans	117.6	133.2	153	-108.6	85.4	-85.2	0	0	125.3	T310 R311 K312	T310-E1181 VanDerWaalsContact CB-N 3.28Å; T310-E1181 VanDerWaalsContact CB-OE1 3.23Å; T310-E1181 WeakPolarHBondContact CB-OE1 3.39Å; T310-E1181 WeakPolarHBondContact CG2-OE1 3.29Å; R311-E1181 CarbonylContact C-O 3.56Å; R311-E1181 WeakPolarHBondContact CA-O 3.37Å; R311-E1181 PolarHBondContact N-O 2.84Å; K312-E1181 VanDerWaalsContact CA-O 3.28Å; K312-E1181 WeakPolarHBondContact CA-O 3.31Å; K312-E1181 HydrophobicContact CB-CB 4.1Å; K312-E1181 WeakPolarHBondContact CB-O 3.07Å; K312-E1181 HydrophobicContact CD-CB 3.87Å; K312-E1181 HydrophobicContact CG-CB 4.42Å; K312-E1181 VanDerWaalsContact CG-O 3.3Å; K312-E1181 WeakPolarHBondContact CG-O 3.03Å; K312-E1181 VanDerWaalsContact N-C 3.33Å; K312-E1181 VanDerWaalsContact N-N 3.11Å; K312-E1181 PolarHBondContact N-O 3.37Å
1182	E	32.7	Very low	27.9	Very low	85 Å²	85	111 Å²	111	40%	0.397	64%	0.644	S	S	.	*			trans	95.5	102.6	151.9	-73.8	150	-122.2	0	0	127.1	R311 K312	R311-E1182 WeakPolarHBondContact CD-O 3.29Å; R311-E1182 PolarHBondContact NH1-O 2.82Å; K312-E1182 WeakPolarHBondContact CE-OE1 3.22Å; K312-E1182 WeakPolarHBondContact CE-OE2 3.24Å; K312-E1182 IonicContact NZ-OE1 3.21Å; K312-E1182 PolarHBondContact NZ-OE1 2.68Å; K312-E1182 IonicContact NZ-OE2 2.92Å; K312-E1182 PolarHBondContact NZ-OE2 3.37Å
1183	T	32.8	Very low	27.9	Very low	78 Å²	78	109.5 Å²	109.5	48%	0.479	65%	0.649	S	S	.	*				91.7	108.5	116.3	58.9	0	0	0	0	127.1	R311	R311-T1183 PolarHBondContact NH1-O 3.14Å
1184	D	29.6	Very low	28.1	Very low	159 Å²	159	107.8 Å²	107.8	85%	0.85	65%	0.652	S	S	*	*				90.5	145.4	110.6	-59.1	-3.7	0	0	0	127.9
1185	G	33	Very low	28	Very low	67 Å²	67	105.7 Å²	105.7	69%	0.691	65%	0.654	S	S	*	*			trans	96.1	147.1	157.2	0	0	0	0	0	118.4
1186	T	28.5	Very low	28	Very low	141 Å²	141	106.5 Å²	106.5	87%	0.865	66%	0.659	S	S	*	*			cis	179.6	163.1	-20.1	14.6	0	0	0	0	107.1
1187	V	27.7	Very low	27.9	Very low	107 Å²	107	105.4 Å²	105.4	65%	0.648	66%	0.658	S	S	*	*			cis	-164.5	156.6	-29.7	80.4	0	0	0	0	110.3
1188	R	27.3	Very low	27.8	Very low	226 Å²	226	105.9 Å²	105.9	85%	0.853	67%	0.666	S	S	*	*			trans	62	175.3	166.9	-68.4	165.9	-164.4	163.7	3.7	117.6
1189	S	26.4	Very low	27.6	Very low	110 Å²	110	106.3 Å²	106.3	77%	0.769	67%	0.665	S	S	*	*				-161.1	169.8	-50.1	58.9	0	0	0	0	106.3
1190	A	25.9	Very low	27.2	Very low	99 Å²	99	100.8 Å²	100.8	82%	0.818	64%	0.639	S	S	*	*			cis	-167.3	-164.2	24.3	0	0	0	0	0	109.8
1191	G	26.8	Very low	26.9	Very low	72 Å²	72	105.4 Å²	105.4	74%	0.742	66%	0.655	S	S	*	*			trans	89.9	123.2	175.6	0	0	0	0	0	113.9
1192	A	25.4	Very low	26.6	Very low	104 Å²	104	104.6 Å²	104.6	86%	0.86	66%	0.659	S	S	*	*				75	127.3	52.1	0	0	0	0	0	112.8
1193	S	24.7	Very low	26.2	Very low	112 Å²	112	106.1 Å²	106.1	78%	0.783	68%	0.676	S	S	*	*			cis	-156.9	-173.4	-3.7	72.5	0	0	0	0	112.5
1194	S	27.3	Very low	25.9	Very low	96 Å²	96	111.7 Å²	111.7	67%	0.671	69%	0.688	S	S	*	*			trans	54.1	72	159.3	-152.6	0	0	0	0	119.5	V1196	S1194-V1196 PolarHBondContact O-N 3.25Å
1195	T	23.1	Very low	25.7	Very low	130 Å²	130	111.3 Å²	111.3	80%	0.798	69%	0.686	S	S	*	*			trans	-79.8	92.3	162.3	52.6	0	0	0	0	111.3	V1197	T1195-V1197 PolarHBondContact O-N 3.29Å; T1195-V1197 VanDerWaalsContact O-N 3.13Å
1196	V	23.6	Very low	25.4	Very low	118 Å²	118	113.3 Å²	113.3	72%	0.715	68%	0.678	S	S	*	*			trans	-79.3	88.7	171.8	-178	0	0	0	0	109.6	S1194 A1198	S1194-V1196 PolarHBondContact O-N 3.25Å; V1196-A1198 HydrophobicContact CG1-CB 4.03Å; V1196-A1198 PolarHBondContact O-N 3.42Å
1197	V	23.9	Very low	25.4	Very low	120 Å²	120	111 Å²	111	73%	0.727	66%	0.664	S	S	*	*			trans	-87.8	79.4	177.6	-174.4	0	0	0	0	109.1	T1195	T1195-V1197 PolarHBondContact O-N 3.29Å; T1195-V1197 VanDerWaalsContact O-N 3.13Å
1198	A	24.7	Very low	25.3	Very low	70 Å²	70	111.6 Å²	111.6	58%	0.579	66%	0.663	S	S	*	*			trans	-101.9	143.5	-173.9	0	0	0	0	0	113.7	V1196	V1196-A1198 HydrophobicContact CG1-CB 4.03Å; V1196-A1198 PolarHBondContact O-N 3.42Å
1199	H	23.9	Very low	25.4	Very low	81 Å²	81	106 Å²	106	38%	0.375	65%	0.649	S	S	.	*			trans	28.4	112.3	-175.3	-115.6	-9.2	0	0	0	121	K347 S348 F1201	K347-H1199 VanDerWaalsContact C-ND1 3.27Å; K347-H1199 VanDerWaalsContact CA-CE1 3.42Å; K347-H1199 WeakPolarHBondContact CA-CE1 3.28Å; K347-H1199 WeakPolarHBondContact CA-NE2 3.16Å; K347-H1199 HydrophobicContact CB-CB 4.06Å; K347-H1199 VanDerWaalsContact CB-CD2 3.48Å; K347-H1199 WeakPolarHBondContact CB-CD2 3.16Å; K347-H1199 VanDerWaalsContact CG-CD2 3.44Å; K347-H1199 WeakPolarHBondContact CG-CD2 3.47Å; K347-H1199 VanDerWaalsContact O-CA 3.28Å; K347-H1199 WeakPolarHBondContact O-CA 3.39Å; K347-H1199 PolarHBondContact O-N 2.92Å; S348-H1199 PolarHBondContact N-ND1 3.43Å; H1199-F1201 AromaticContact CE1-CD2 3.07Å; H1199-F1201 WeakPolarHBondContact CE1-CD2 3.36Å; H1199-F1201 AromaticContact CE1-CE2 3.03Å; H1199-F1201 WeakPolarHBondContact CE1-CE2 3.26Å; H1199-F1201 AromaticContact ND1-CD2 3.56Å; H1199-F1201 AromaticContact ND1-CE2 3.91Å; H1199-F1201 AromaticContact NE2-CD2 3.41Å; H1199-F1201 WeakPolarHBondContact NE2-CD2 3.43Å; H1199-F1201 AromaticContact NE2-CE2 3.47Å; H1199-F1201 WeakPolarHBondContact NE2-CE2 3.5Å
1200	P	23	Very low	25.6	Very low	29 Å²	29	102 Å²	102	19%	0.188	62%	0.621	C	S	.	*			trans	-119.6	42.9	173.3	36.5	-19.6	0	0	0	112.7	S348 E349 I351 S1202	S348-P1200 WeakPolarHBondContact OG-CD 3.33Å; E349-P1200 HydrophobicContact CB-CG 4.16Å; E349-P1200 HydrophobicContact CG-CG 3.45Å; E349-P1200 VanDerWaalsContact CG-CG 3.45Å; I351-P1200 HydrophobicContact CD1-CB 3.77Å; I351-P1200 HydrophobicContact CD1-CG 4.03Å; I351-P1200 HydrophobicContact CG1-CB 3.73Å; I351-P1200 HydrophobicContact CG1-CG 4Å; P1200-S1202 PolarHBondContact O-N 3.46Å
1201	F	23.4	Very low	25.8	Very low	122 Å²	122	99.1 Å²	99.1	54%	0.535	60%	0.601	S	S	.	*			trans	-73.6	80.7	162	-76.5	-53.1	0	0	0	109.2	E350 H1199	E350-F1201 HydrophobicContact CB-CD1 3.73Å; E350-F1201 HydrophobicContact CB-CE1 3.87Å; E350-F1201 HydrophobicContact CG-CD1 4.05Å; E350-F1201 HydrophobicContact CG-CE1 3.68Å; H1199-F1201 AromaticContact CE1-CD2 3.07Å; H1199-F1201 WeakPolarHBondContact CE1-CD2 3.36Å; H1199-F1201 AromaticContact CE1-CE2 3.03Å; H1199-F1201 WeakPolarHBondContact CE1-CE2 3.26Å; H1199-F1201 AromaticContact ND1-CD2 3.56Å; H1199-F1201 AromaticContact ND1-CE2 3.91Å; H1199-F1201 AromaticContact NE2-CD2 3.41Å; H1199-F1201 WeakPolarHBondContact NE2-CD2 3.43Å; H1199-F1201 AromaticContact NE2-CE2 3.47Å; H1199-F1201 WeakPolarHBondContact NE2-CE2 3.5Å
1202	S	25.6	Very low	25.9	Very low	71 Å²	71	101 Å²	101	50%	0.497	59%	0.59	S	S	.	*			trans	-85.7	125.2	172.7	-166.9	0	0	0	0	109.3	P1200 R1204	P1200-S1202 PolarHBondContact O-N 3.46Å; S1202-R1204 PolarHBondContact O-N 3.07Å
1203	P	24.5	Very low	26.4	Very low	117 Å²	117	97.7 Å²	97.7	76%	0.76	56%	0.557	S	S	*	*			trans	-76.6	52	-171	31.8	-37.6	0	0	0	113.4
1204	R	26	Very low	26.8	Very low	194 Å²	194	102.7 Å²	102.7	73%	0.732	56%	0.558	S	S	*	*			trans	-96.3	-2.6	-174.1	-74.3	-172.9	171.4	179.6	2.1	115.1	S1202 Q1206	S1202-R1204 PolarHBondContact O-N 3.07Å; R1204-Q1206 PolarHBondContact O-N 3.09Å
1205	N	25	Very low	27.1	Very low	151 Å²	151	104.1 Å²	104.1	81%	0.807	56%	0.558	S	S	*	*			trans	-75.5	40.9	166.9	-76.4	-18.5	0	0	0	112.5	V1207	N1205-V1207 PolarHBondContact O-N 2.72Å; N1205-V1207 VanDerWaalsContact O-N 3.16Å
1206	Q	27.1	Very low	27.6	Very low	110 Å²	110	102.2 Å²	102.2	51%	0.514	54%	0.543	S	S	.	.			trans	-66	113.3	162.7	-76.7	-173.4	-11.3	0	0	108.3	R1204 N1208 F1487	R1204-Q1206 PolarHBondContact O-N 3.09Å; Q1206-N1208 PolarHBondContact O-N 2.98Å; Q1206-F1487 PolarHBondContact NE2-O 2.67Å
1207	V	27.1	Very low	28.1	Very low	93 Å²	93	98.3 Å²	98.3	56%	0.564	52%	0.516	S	S	*	.			trans	-53.4	107	174.6	177	0	0	0	0	108.1	N1205 I1209	N1205-V1207 PolarHBondContact O-N 2.72Å; N1205-V1207 VanDerWaalsContact O-N 3.16Å; V1207-I1209 HydrophobicContact CG1-CG1 4.27Å; V1207-I1209 PolarHBondContact O-N 3.16Å
1208	N	26.9	Very low	28.5	Very low	119 Å²	119	95.9 Å²	95.9	64%	0.636	50%	0.504	S	S	*	.			trans	-74.5	77.5	178.1	-114	-87.5	0	0	0	108.5	L1158 Q1206 C1210	L1158-N1208 HydrophobicContact CD1-CB 4.03Å; Q1206-N1208 PolarHBondContact O-N 2.98Å; N1208-C1210 VanDerWaalsContact O-CA 3.26Å; N1208-C1210 WeakPolarHBondContact O-CA 3.09Å; N1208-C1210 PolarHBondContact O-N 3.28Å
1209	I	29.3	Very low	29	Very low	107 Å²	107	98.4 Å²	98.4	55%	0.549	50%	0.504	S	S	.	.			trans	-45.3	107.6	174.8	-68.8	176.6	0	0	0	107.1	V1207 F1213	V1207-I1209 HydrophobicContact CG1-CG1 4.27Å; V1207-I1209 PolarHBondContact O-N 3.16Å; I1209-F1213 HydrophobicContact CG2-CB 3.58Å; I1209-F1213 HydrophobicContact CG2-CD1 3.4Å; I1209-F1213 VanDerWaalsContact CG2-CD1 3.4Å; I1209-F1213 HydrophobicContact CG2-CD2 3.83Å; I1209-F1213 HydrophobicContact CG2-CE1 3.94Å; I1209-F1213 HydrophobicContact CG2-CE2 4.3Å; I1209-F1213 HydrophobicContact CG2-CG 3.35Å; I1209-F1213 HydrophobicContact CG2-CZ 4.35Å
1210	C	30	Very low	29.4	Very low	27 Å²	27	99.5 Å²	99.5	18%	0.182	51%	0.513	C	S	.	.			trans	-58.5	150.7	-151.6	178.7	0	0	0	0	111.4	P1157 N1208 Q1212 F1213 R1214	P1157-C1210 HydrophobicContact CG-CB 4.09Å; N1208-C1210 VanDerWaalsContact O-CA 3.26Å; N1208-C1210 WeakPolarHBondContact O-CA 3.09Å; N1208-C1210 PolarHBondContact O-N 3.28Å; C1210-Q1212 CarbonylContact O-C 3.44Å; C1210-Q1212 PolarHBondContact O-N 2.86Å; C1210-F1213 WeakPolarHBondContact O-CA 3.18Å; C1210-F1213 VanDerWaalsContact O-CB 3.24Å; C1210-F1213 WeakPolarHBondContact O-CB 3.4Å; C1210-F1213 PolarHBondContact O-N 2.77Å; C1210-R1214 PolarHBondContact O-N 2.76Å
1211	G	29.7	Very low	30.3	Very low	39 Å²	39	101 Å²	101	40%	0.402	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-3.6	172.6	0	0	0	0	0	115	N1215	G1211-N1215 PolarHBondContact O-ND2 2.75Å
1212	Q	30.6	Very low	31.3	Very low	112 Å²	112	98 Å²	98	52%	0.523	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-45.4	165.4	-66.9	169.8	57.8	0	0	112	C1210 R1214 N1215 L1216	C1210-Q1212 CarbonylContact O-C 3.44Å; C1210-Q1212 PolarHBondContact O-N 2.86Å; Q1212-R1214 VanDerWaalsContact C-N 3.32Å; Q1212-R1214 PolarHBondContact O-N 3.27Å; Q1212-N1215 CarbonylContact O-C 3.58Å; Q1212-N1215 WeakPolarHBondContact O-CA 3.47Å; Q1212-N1215 PolarHBondContact O-N 3.33Å; Q1212-L1216 PolarHBondContact O-N 2.87Å
1213	F	34.1	Very low	32.3	Very low	34 Å²	34	96.7 Å²	96.7	15%	0.149	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-57.3	-44.9	173.7	-155.5	-84.1	0	0	0	110.8	V1146 I1147 I1209 C1210 N1215 L1216 F1217	V1146-F1213 HydrophobicContact CG1-CD2 3.97Å; V1146-F1213 HydrophobicContact CG1-CE2 3.83Å; I1147-F1213 HydrophobicContact CD1-CZ 4.38Å; I1147-F1213 HydrophobicContact CG1-CE2 4.41Å; I1147-F1213 HydrophobicContact CG1-CZ 4.35Å; I1209-F1213 HydrophobicContact CG2-CB 3.58Å; I1209-F1213 HydrophobicContact CG2-CD1 3.4Å; I1209-F1213 VanDerWaalsContact CG2-CD1 3.4Å; I1209-F1213 HydrophobicContact CG2-CD2 3.83Å; I1209-F1213 HydrophobicContact CG2-CE1 3.94Å; I1209-F1213 HydrophobicContact CG2-CE2 4.3Å; I1209-F1213 HydrophobicContact CG2-CG 3.35Å; I1209-F1213 HydrophobicContact CG2-CZ 4.35Å; C1210-F1213 WeakPolarHBondContact O-CA 3.18Å; C1210-F1213 VanDerWaalsContact O-CB 3.24Å; C1210-F1213 WeakPolarHBondContact O-CB 3.4Å; C1210-F1213 PolarHBondContact O-N 2.77Å; F1213-N1215 PolarHBondContact O-N 3.3Å; F1213-N1215 VanDerWaalsContact O-N 3.09Å; F1213-L1216 WeakPolarHBondContact O-CB 3.47Å; F1213-L1216 PolarHBondContact O-N 3Å; F1213-F1217 AromaticContact CD1-CD2 3.44Å; F1213-F1217 HydrophobicContact CD1-CD2 3.44Å; F1213-F1217 VanDerWaalsContact CD1-CD2 3.44Å; F1213-F1217 AromaticContact CD1-CE2 3.57Å; F1213-F1217 HydrophobicContact CD1-CE2 3.57Å; F1213-F1217 AromaticContact CD2-CE2 3.92Å; F1213-F1217 HydrophobicContact CD2-CE2 3.92Å; F1213-F1217 AromaticContact CE1-CD2 3.51Å; F1213-F1217 HydrophobicContact CE1-CD2 3.51Å; F1213-F1217 AromaticContact CE1-CE2 3.43Å; F1213-F1217 HydrophobicContact CE1-CE2 3.43Å; F1213-F1217 VanDerWaalsContact CE1-CE2 3.43Å; F1213-F1217 AromaticContact CE2-CE2 3.81Å; F1213-F1217 HydrophobicContact CE2-CE2 3.81Å; F1213-F1217 HydrophobicContact CG-CD2 4.01Å; F1213-F1217 AromaticContact CG-CE2 3.81Å; F1213-F1217 HydrophobicContact CG-CE2 3.81Å; F1213-F1217 HydrophobicContact CZ-CD2 4.14Å; F1213-F1217 AromaticContact CZ-CE2 3.56Å; F1213-F1217 HydrophobicContact CZ-CE2 3.56Å; F1213-F1217 HydrophobicContact CZ-CZ 4.4Å; F1213-F1217 WeakPolarHBondContact O-CD2 3.31Å; F1213-F1217 PolarHBondContact O-N 3.3Å
1214	R	33.4	Very low	33.7	Very low	216 Å²	216	97.2 Å²	97.2	82%	0.815	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-67.9	-3.5	175.4	-151.3	172.3	-174.2	162.1	2.7	114.7	C1210 Q1212	C1210-R1214 PolarHBondContact O-N 2.76Å; Q1212-R1214 VanDerWaalsContact C-N 3.32Å; Q1212-R1214 PolarHBondContact O-N 3.27Å
1215	N	33.7	Very low	34.8	Very low	127 Å²	127	88.6 Å²	88.6	68%	0.679	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-116.1	-0.4	169.3	-78.1	-95.2	0	0	0	112.6	G1211 Q1212 F1213	G1211-N1215 PolarHBondContact O-ND2 2.75Å; Q1212-N1215 CarbonylContact O-C 3.58Å; Q1212-N1215 WeakPolarHBondContact O-CA 3.47Å; Q1212-N1215 PolarHBondContact O-N 3.33Å; F1213-N1215 PolarHBondContact O-N 3.3Å; F1213-N1215 VanDerWaalsContact O-N 3.09Å
1216	L	33.2	Very low	36.2	Very low	90 Å²	90	83 Å²	83	47%	0.471	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-35.3	177.4	-119.2	150.9	0	0	0	110.9	Q1212 F1213	Q1212-L1216 PolarHBondContact O-N 2.87Å; F1213-L1216 WeakPolarHBondContact O-CB 3.47Å; F1213-L1216 PolarHBondContact O-N 3Å
1217	F	35.5	Very low	37.6	Very low	35 Å²	35	81.1 Å²	81.1	15%	0.154	42%	0.416	C	S	.	.	S	Bend	trans	-106.7	10.4	-174.5	-60.5	-65.9	0	0	0	115.2	L1143 V1146 F1213 H1219 N1220 F1221	L1143-F1217 HydrophobicContact CD1-CD1 4.45Å; L1143-F1217 HydrophobicContact CD1-CE1 3.43Å; L1143-F1217 VanDerWaalsContact CD1-CE1 3.43Å; L1143-F1217 HydrophobicContact CD1-CZ 3.59Å; V1146-F1217 HydrophobicContact CG1-CE2 4.4Å; V1146-F1217 HydrophobicContact CG1-CZ 4.32Å; F1213-F1217 AromaticContact CD1-CD2 3.44Å; F1213-F1217 HydrophobicContact CD1-CD2 3.44Å; F1213-F1217 VanDerWaalsContact CD1-CD2 3.44Å; F1213-F1217 AromaticContact CD1-CE2 3.57Å; F1213-F1217 HydrophobicContact CD1-CE2 3.57Å; F1213-F1217 AromaticContact CD2-CE2 3.92Å; F1213-F1217 HydrophobicContact CD2-CE2 3.92Å; F1213-F1217 AromaticContact CE1-CD2 3.51Å; F1213-F1217 HydrophobicContact CE1-CD2 3.51Å; F1213-F1217 AromaticContact CE1-CE2 3.43Å; F1213-F1217 HydrophobicContact CE1-CE2 3.43Å; F1213-F1217 VanDerWaalsContact CE1-CE2 3.43Å; F1213-F1217 AromaticContact CE2-CE2 3.81Å; F1213-F1217 HydrophobicContact CE2-CE2 3.81Å; F1213-F1217 HydrophobicContact CG-CD2 4.01Å; F1213-F1217 AromaticContact CG-CE2 3.81Å; F1213-F1217 HydrophobicContact CG-CE2 3.81Å; F1213-F1217 HydrophobicContact CZ-CD2 4.14Å; F1213-F1217 AromaticContact CZ-CE2 3.56Å; F1213-F1217 HydrophobicContact CZ-CE2 3.56Å; F1213-F1217 HydrophobicContact CZ-CZ 4.4Å; F1213-F1217 WeakPolarHBondContact O-CD2 3.31Å; F1213-F1217 PolarHBondContact O-N 3.3Å; F1217-H1219 PolarHBondContact O-N 3.49Å; F1217-N1220 PolarHBondContact O-N 2.76Å; F1217-F1221 HydrophobicContact CB-CB 4.1Å; F1217-F1221 HydrophobicContact CB-CD2 4.2Å; F1217-F1221 HydrophobicContact CB-CG 4.25Å; F1217-F1221 HydrophobicContact CD1-CD2 4Å; F1217-F1221 AromaticContact CG-CD2 3.96Å; F1217-F1221 HydrophobicContact CG-CD2 3.96Å
1218	S	32	Very low	39.1	Very low	69 Å²	69	78.1 Å²	78.1	48%	0.483	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	0.7	-174.3	68.1	0	0	0	0	115.8
1219	H	35	Very low	40.4	Very low	124 Å²	124	72.7 Å²	72.7	57%	0.574	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.6	-1.1	178	-59.8	-62.7	0	0	0	114.4	F1217	F1217-H1219 PolarHBondContact O-N 3.49Å
1220	N	33.1	Very low	41.8	Very low	103 Å²	103	69 Å²	69	55%	0.551	35%	0.349	S	S	*	.			trans	-163	63.6	-172.3	-86.7	-79.4	0	0	0	111.6	R1139 F1217	R1139-N1220 PolarHBondContact NH1-OD1 3.05Å; F1217-N1220 PolarHBondContact O-N 2.76Å
1221	F	40.7	Very low	43.4	Very low	62 Å²	62	69.5 Å²	69.5	27%	0.272	36%	0.356	S	S	.	.			trans	-88.4	152.8	166.7	-158.7	-153.5	0	0	0	109	F1217 L1226 Y1501	F1217-F1221 HydrophobicContact CB-CB 4.1Å; F1217-F1221 HydrophobicContact CB-CD2 4.2Å; F1217-F1221 HydrophobicContact CB-CG 4.25Å; F1217-F1221 HydrophobicContact CD1-CD2 4Å; F1217-F1221 AromaticContact CG-CD2 3.96Å; F1217-F1221 HydrophobicContact CG-CD2 3.96Å; F1221-L1226 HydrophobicContact CE1-CD1 3.97Å; F1221-L1226 HydrophobicContact CZ-CD1 3.85Å; F1221-Y1501 HydrophobicContact CB-CE1 3.84Å; F1221-Y1501 HydrophobicContact CB-CE2 4.45Å; F1221-Y1501 VanDerWaalsContact CB-OH 3.29Å; F1221-Y1501 WeakPolarHBondContact CB-OH 3.37Å; F1221-Y1501 HydrophobicContact CD1-CD2 4.36Å; F1221-Y1501 HydrophobicContact CD1-CE1 4.24Å; F1221-Y1501 AromaticContact CD1-CE2 3.32Å; F1221-Y1501 HydrophobicContact CD1-CE2 3.32Å; F1221-Y1501 AromaticContact CD1-CZ 3.27Å; F1221-Y1501 WeakPolarHBondContact CD1-OH 3.41Å; F1221-Y1501 AromaticContact CE1-CE2 3.76Å; F1221-Y1501 HydrophobicContact CE1-CE2 3.76Å; F1221-Y1501 HydrophobicContact CG-CE1 4.35Å; F1221-Y1501 HydrophobicContact CG-CE2 4.15Å; F1221-Y1501 AromaticContact CG-CZ 3.62Å; F1221-Y1501 WeakPolarHBondContact CG-OH 3.24Å; F1221-Y1501 WeakPolarHBondContact O-CE1 3.43Å
1222	C	43.9	Very low	44.8	Very low	58 Å²	58	67.7 Å²	67.7	39%	0.392	34%	0.337	S	S	.	.			trans	-114.1	111.9	-176.6	-176	0	0	0	0	111.5	L1143 K1224 F1225 Y1501	L1143-C1222 HydrophobicContact CD2-CB 4.4Å; C1222-K1224 VanDerWaalsContact C-N 3.26Å; C1222-K1224 PolarHBondContact O-N 3.06Å; C1222-F1225 WeakPolarHBondContact O-CB 3.45Å; C1222-F1225 PolarHBondContact O-N 3.28Å; C1222-Y1501 WeakPolarHBondContact CA-OH 3.43Å; C1222-Y1501 PolarHBondContact N-OH 2.86Å; C1222-Y1501 PolarHBondContact O-OH 2.71Å
1223	P	46.6	Very low	46	Very low	43 Å²	43	63 Å²	63	28%	0.279	32%	0.319	S	S	.	.	H	α-helix	trans	-58.9	-38.5	-175.1	-24.8	32.5	0	0	0	112.7	F1225 L1226 R1227 I1497 Y1501	P1223-F1225 PolarHBondContact O-N 2.64Å; P1223-L1226 PolarHBondContact O-N 3.08Å; P1223-R1227 PolarHBondContact O-N 3.18Å; P1223-I1497 HydrophobicContact CB-CG2 3.94Å; P1223-Y1501 HydrophobicContact CB-CE1 4.43Å; P1223-Y1501 HydrophobicContact CG-CD1 3.84Å; P1223-Y1501 HydrophobicContact CG-CE1 3.49Å; P1223-Y1501 VanDerWaalsContact CG-CE1 3.49Å; P1223-Y1501 VanDerWaalsContact N-OH 3.11Å
1224	K	54	Low	47.1	Very low	128 Å²	128	62.3 Å²	62.3	56%	0.557	32%	0.315	S	S	*	.	H	α-helix	trans	-56.2	-35.8	-178.5	-171.8	167.3	-175.1	173.2	0	112.7	C1222 L1226 R1227 D1228	C1222-K1224 VanDerWaalsContact C-N 3.26Å; C1222-K1224 PolarHBondContact O-N 3.06Å; K1224-L1226 VanDerWaalsContact C-N 3.26Å; K1224-L1226 PolarHBondContact O-N 2.81Å; K1224-R1227 PolarHBondContact O-N 2.91Å; K1224-D1228 WeakPolarHBondContact CE-OD1 3.45Å; K1224-D1228 WeakPolarHBondContact CE-OD2 3.39Å; K1224-D1228 WeakPolarHBondContact CG-OD1 3.25Å; K1224-D1228 VanDerWaalsContact CG-OD2 3.28Å; K1224-D1228 WeakPolarHBondContact CG-OD2 3.49Å; K1224-D1228 VanDerWaalsContact O-CB 3.3Å; K1224-D1228 WeakPolarHBondContact O-CB 3.33Å; K1224-D1228 PolarHBondContact O-N 2.93Å
1225	F	50.2	Low	48.3	Very low	13 Å²	13	55.5 Å²	55.5	6%	0.057	30%	0.295	C	S	.	.	H	α-helix	trans	-54.4	-43.9	174.3	174.2	-90.4	0	0	0	112.6	L1143 I1147 C1222 P1223 A1229 A1251 G1252 C1255	L1143-F1225 HydrophobicContact CD2-CB 3.97Å; L1143-F1225 HydrophobicContact CD2-CD2 3.66Å; L1143-F1225 HydrophobicContact CD2-CE2 4.49Å; L1143-F1225 HydrophobicContact CD2-CG 3.96Å; L1143-F1225 HydrophobicContact CG-CD2 4.11Å; L1143-F1225 HydrophobicContact CG-CE2 4.48Å; I1147-F1225 HydrophobicContact CB-CE2 4.39Å; I1147-F1225 HydrophobicContact CB-CZ 4.13Å; I1147-F1225 HydrophobicContact CD1-CD2 4.31Å; I1147-F1225 HydrophobicContact CD1-CE1 4.02Å; I1147-F1225 HydrophobicContact CD1-CE2 3.54Å; I1147-F1225 HydrophobicContact CD1-CZ 3.39Å; I1147-F1225 HydrophobicContact CG1-CE1 4.18Å; I1147-F1225 HydrophobicContact CG1-CE2 3.97Å; I1147-F1225 HydrophobicContact CG1-CZ 3.45Å; I1147-F1225 VanDerWaalsContact CG1-CZ 3.45Å; I1147-F1225 HydrophobicContact CG2-CE2 4.26Å; I1147-F1225 HydrophobicContact CG2-CZ 3.87Å; C1222-F1225 WeakPolarHBondContact O-CB 3.45Å; C1222-F1225 PolarHBondContact O-N 3.28Å; P1223-F1225 PolarHBondContact O-N 2.64Å; F1225-A1229 WeakPolarHBondContact O-CB 3.19Å; F1225-A1229 PolarHBondContact O-N 2.85Å; F1225-A1251 HydrophobicContact CD2-CB 3.67Å; F1225-A1251 HydrophobicContact CE2-CB 3.94Å; F1225-A1251 WeakPolarHBondContact CE2-O 3.27Å; F1225-G1252 WeakPolarHBondContact O-CA 3.48Å; F1225-C1255 HydrophobicContact CE1-CB 4.02Å; F1225-C1255 HydrophobicContact CE2-CB 4.24Å; F1225-C1255 HydrophobicContact CZ-CB 3.48Å; F1225-C1255 VanDerWaalsContact CZ-CB 3.48Å; F1225-C1255 VanDerWaalsContact CZ-SG 3.54Å
1226	L	54	Low	49.2	Very low	33 Å²	33	49.8 Å²	49.8	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-86.7	-30.1	-174	-126.2	168.4	0	0	0	110.8	F1221 P1223 K1224 L1230 I1492 I1497	F1221-L1226 HydrophobicContact CE1-CD1 3.97Å; F1221-L1226 HydrophobicContact CZ-CD1 3.85Å; P1223-L1226 PolarHBondContact O-N 3.08Å; K1224-L1226 VanDerWaalsContact C-N 3.26Å; K1224-L1226 PolarHBondContact O-N 2.81Å; L1226-L1230 HydrophobicContact CD2-CD1 4.02Å; L1226-L1230 VanDerWaalsContact O-CD1 3.3Å; L1226-L1230 WeakPolarHBondContact O-CD1 3.48Å; L1226-L1230 VanDerWaalsContact O-CG 3.27Å; L1226-L1230 WeakPolarHBondContact O-CG 3.19Å; L1226-L1230 PolarHBondContact O-N 2.92Å; L1226-I1492 HydrophobicContact CD2-CG2 4.33Å; L1226-I1497 HydrophobicContact CB-CD1 3.6Å; L1226-I1497 HydrophobicContact CB-CG1 3.75Å; L1226-I1497 HydrophobicContact CB-CG2 4.09Å; L1226-I1497 HydrophobicContact CD1-CG1 4.15Å; L1226-I1497 HydrophobicContact CD2-CD1 3.97Å; L1226-I1497 HydrophobicContact CD2-CG1 3.96Å; L1226-I1497 HydrophobicContact CG-CD1 4.28Å; L1226-I1497 HydrophobicContact CG-CG1 4.14Å
1227	R	56.3	Low	50.1	Low	71 Å²	71	49.4 Å²	49.4	27%	0.268	27%	0.265	S	S	.	.	H	α-helix	trans	-59.7	-55.1	168.7	-69.9	179.8	176.6	174.5	-2.9	111.7	P1223 K1224 A1229 L1230 A1231 E1494 I1497 N1498	P1223-R1227 PolarHBondContact O-N 3.18Å; K1224-R1227 PolarHBondContact O-N 2.91Å; R1227-A1229 VanDerWaalsContact C-N 3.31Å; R1227-A1229 PolarHBondContact O-N 3.05Å; R1227-L1230 PolarHBondContact O-N 3.37Å; R1227-L1230 VanDerWaalsContact O-N 3.17Å; R1227-A1231 PolarHBondContact O-N 3.43Å; R1227-E1494 VanDerWaalsContact CD-OE1 3.26Å; R1227-E1494 WeakPolarHBondContact CD-OE1 3.19Å; R1227-E1494 VanDerWaalsContact CG-OE1 3.22Å; R1227-E1494 WeakPolarHBondContact CG-OE1 3.44Å; R1227-E1494 IonicContact CZ-OE1 3.52Å; R1227-E1494 IonicContact NE-OE1 3.65Å; R1227-E1494 PolarHBondContact NE-OE1 2.85Å; R1227-E1494 IonicContact NH2-OE1 3.41Å; R1227-E1494 PolarHBondContact NH2-OE1 3.15Å; R1227-E1494 IonicContact NH2-OE2 2.7Å; R1227-I1497 HydrophobicContact CG-CD1 4.35Å; R1227-N1498 PolarHBondContact NH2-OD1 2.98Å
1228	D	59.7	Low	50.9	Low	30 Å²	30	49 Å²	49	16%	0.16	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-37.8	-174.6	-61.2	-1.3	0	0	0	110.1	K1224 L1230 A1231 L1232 S1250 F1253	K1224-D1228 WeakPolarHBondContact CE-OD1 3.45Å; K1224-D1228 WeakPolarHBondContact CE-OD2 3.39Å; K1224-D1228 WeakPolarHBondContact CG-OD1 3.25Å; K1224-D1228 VanDerWaalsContact CG-OD2 3.28Å; K1224-D1228 WeakPolarHBondContact CG-OD2 3.49Å; K1224-D1228 VanDerWaalsContact O-CB 3.3Å; K1224-D1228 WeakPolarHBondContact O-CB 3.33Å; K1224-D1228 PolarHBondContact O-N 2.93Å; D1228-L1230 VanDerWaalsContact C-N 3.3Å; D1228-L1230 PolarHBondContact O-N 2.84Å; D1228-A1231 WeakPolarHBondContact O-CB 3.3Å; D1228-A1231 PolarHBondContact O-N 3.1Å; D1228-L1232 PolarHBondContact O-N 3.03Å; D1228-L1232 VanDerWaalsContact O-N 3.1Å; D1228-S1250 WeakPolarHBondContact CB-OG 3.14Å; D1228-S1250 VanDerWaalsContact CG-OG 3.23Å; D1228-S1250 WeakPolarHBondContact OD2-CB 3.4Å; D1228-S1250 PolarHBondContact OD2-OG 3.46Å; D1228-F1253 HydrophobicContact CB-CD1 4.13Å; D1228-F1253 HydrophobicContact CB-CE1 4.1Å; D1228-F1253 WeakPolarHBondContact O-CD1 3.39Å; D1228-F1253 VanDerWaalsContact O-CE1 3.26Å; D1228-F1253 WeakPolarHBondContact O-CE1 3.07Å
1229	A	53.6	Low	52.1	Low	5 Å²	5	49 Å²	49	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-52.3	-51.7	172.1	0	0	0	0	0	111.2	F1225 R1227 L1232 G1233 G1252 C1255 S1256	F1225-A1229 WeakPolarHBondContact O-CB 3.19Å; F1225-A1229 PolarHBondContact O-N 2.85Å; R1227-A1229 VanDerWaalsContact C-N 3.31Å; R1227-A1229 PolarHBondContact O-N 3.05Å; A1229-L1232 PolarHBondContact O-N 2.67Å; A1229-G1233 PolarHBondContact O-N 3.25Å; A1229-G1252 VanDerWaalsContact CA-C 3.41Å; A1229-G1252 WeakPolarHBondContact CA-O 3.32Å; A1229-G1252 WeakPolarHBondContact CB-O 3.3Å; A1229-C1255 HydrophobicContact CB-CB 4.02Å; A1229-S1256 WeakPolarHBondContact CA-OG 3.46Å; A1229-S1256 WeakPolarHBondContact O-CB 3.37Å; A1229-S1256 PolarHBondContact O-OG 3.22Å
1230	L	58.6	Low	52.8	Low	29 Å²	29	45.4 Å²	45.4	15%	0.152	25%	0.247	C	C	.	.	H	α-helix	trans	-72.9	-32	-178.3	-59.2	163.1	0	0	0	111.2	L1226 R1227 D1228 L1232 G1233 R1234 I1492 I1497	L1226-L1230 HydrophobicContact CD2-CD1 4.02Å; L1226-L1230 VanDerWaalsContact O-CD1 3.3Å; L1226-L1230 WeakPolarHBondContact O-CD1 3.48Å; L1226-L1230 VanDerWaalsContact O-CG 3.27Å; L1226-L1230 WeakPolarHBondContact O-CG 3.19Å; L1226-L1230 PolarHBondContact O-N 2.92Å; R1227-L1230 PolarHBondContact O-N 3.37Å; R1227-L1230 VanDerWaalsContact O-N 3.17Å; D1228-L1230 VanDerWaalsContact C-N 3.3Å; D1228-L1230 PolarHBondContact O-N 2.84Å; L1230-L1232 VanDerWaalsContact C-N 3.31Å; L1230-L1232 PolarHBondContact O-N 2.95Å; L1230-G1233 PolarHBondContact O-N 3.14Å; L1230-G1233 VanDerWaalsContact O-N 3.12Å; L1230-R1234 VanDerWaalsContact O-CB 3.32Å; L1230-R1234 WeakPolarHBondContact O-CB 3.24Å; L1230-R1234 WeakPolarHBondContact O-CD 3.42Å; L1230-R1234 WeakPolarHBondContact O-CG 3.1Å; L1230-R1234 PolarHBondContact O-N 3.02Å; L1230-R1234 PolarHBondContact O-NE 2.96Å; L1230-I1492 HydrophobicContact CD1-CB 4.37Å; L1230-I1492 HydrophobicContact CD1-CG2 3.88Å; L1230-I1492 WeakPolarHBondContact CD1-O 3.43Å; L1230-I1492 HydrophobicContact CD2-CB 4.32Å; L1230-I1492 WeakPolarHBondContact CD2-O 3.48Å; L1230-I1497 HydrophobicContact CD1-CD1 3.63Å
1231	A	63.7	Low	53.5	Low	38 Å²	38	44.6 Å²	44.6	31%	0.314	25%	0.249	S	C	.	.	H	α-helix	trans	-53.6	-44	171.4	0	0	0	0	0	112.7	R1227 D1228 L1235 F1253	R1227-A1231 PolarHBondContact O-N 3.43Å; D1228-A1231 WeakPolarHBondContact O-CB 3.3Å; D1228-A1231 PolarHBondContact O-N 3.1Å; A1231-L1235 PolarHBondContact O-N 2.88Å; A1231-F1253 HydrophobicContact CB-CE1 4.42Å
1232	L	58.3	Low	54	Low	1 Å²	1	46.5 Å²	46.5	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-72.8	-39.5	173.5	179.7	71.3	0	0	0	112.8	D1228 A1229 L1230 R1234 L1235 I1236 V1246 F1253 V1257	D1228-L1232 PolarHBondContact O-N 3.03Å; D1228-L1232 VanDerWaalsContact O-N 3.1Å; A1229-L1232 PolarHBondContact O-N 2.67Å; L1230-L1232 VanDerWaalsContact C-N 3.31Å; L1230-L1232 PolarHBondContact O-N 2.95Å; L1232-R1234 VanDerWaalsContact C-N 3.29Å; L1232-R1234 PolarHBondContact O-N 3.31Å; L1232-L1235 WeakPolarHBondContact O-CB 3.27Å; L1232-L1235 PolarHBondContact O-N 3.31Å; L1232-I1236 HydrophobicContact CD1-CD1 4.2Å; L1232-I1236 HydrophobicContact CD2-CD1 4.49Å; L1232-I1236 HydrophobicContact CG-CD1 3.97Å; L1232-I1236 WeakPolarHBondContact O-CG1 3.45Å; L1232-I1236 PolarHBondContact O-N 2.95Å; L1232-I1236 VanDerWaalsContact O-N 3.09Å; L1232-V1246 HydrophobicContact CD1-CG1 4.24Å; L1232-V1246 HydrophobicContact CD2-CG1 3.68Å; L1232-F1253 HydrophobicContact CB-CD1 3.62Å; L1232-F1253 HydrophobicContact CB-CE1 3.95Å; L1232-F1253 HydrophobicContact CB-CG 4.09Å; L1232-F1253 HydrophobicContact CD2-CB 3.83Å; L1232-F1253 HydrophobicContact CD2-CD1 4.48Å; L1232-F1253 HydrophobicContact CD2-CG 4.14Å; L1232-V1257 HydrophobicContact CD2-CG2 3.71Å
1233	G	56	Low	54.1	Low	15 Å²	15	49.7 Å²	49.7	16%	0.155	26%	0.263	C	S	.	.	H	α-helix	trans	-56.8	-46.5	176.5	0	0	0	0	0	111.5	A1229 L1230 I1236 T1237	A1229-G1233 PolarHBondContact O-N 3.25Å; L1230-G1233 PolarHBondContact O-N 3.14Å; L1230-G1233 VanDerWaalsContact O-N 3.12Å; G1233-I1236 WeakPolarHBondContact O-CB 3.15Å; G1233-I1236 PolarHBondContact O-N 2.84Å; G1233-T1237 PolarHBondContact O-N 3.2Å; G1233-T1237 PolarHBondContact O-OG1 3.34Å
1234	R	56.9	Low	54.2	Low	19 Å²	19	48.1 Å²	48.1	7%	0.072	25%	0.252	C	S	.	.	H	α-helix	trans	-57.5	-55.6	171.4	-66.9	151.3	-159.4	172.2	-7	111.4	L1230 L1232 I1236 T1237 S1238 F1431 E1477 P1478	L1230-R1234 VanDerWaalsContact O-CB 3.32Å; L1230-R1234 WeakPolarHBondContact O-CB 3.24Å; L1230-R1234 WeakPolarHBondContact O-CD 3.42Å; L1230-R1234 WeakPolarHBondContact O-CG 3.1Å; L1230-R1234 PolarHBondContact O-N 3.02Å; L1230-R1234 PolarHBondContact O-NE 2.96Å; L1232-R1234 VanDerWaalsContact C-N 3.29Å; L1232-R1234 PolarHBondContact O-N 3.31Å; R1234-I1236 PolarHBondContact O-N 3.2Å; R1234-I1236 VanDerWaalsContact O-N 3.08Å; R1234-T1237 CarbonylContact O-C 3.48Å; R1234-T1237 VanDerWaalsContact O-CA 3.3Å; R1234-T1237 WeakPolarHBondContact O-CA 3.44Å; R1234-T1237 WeakPolarHBondContact O-CB 3.46Å; R1234-T1237 PolarHBondContact O-N 3.26Å; R1234-S1238 PolarHBondContact O-N 3.4Å; R1234-S1238 PolarHBondContact O-OG 3.27Å; R1234-F1431 VanDerWaalsContact C-CE2 3.42Å; R1234-F1431 HydrophobicContact CB-CD1 4.35Å; R1234-F1431 HydrophobicContact CB-CD2 3.6Å; R1234-F1431 HydrophobicContact CB-CE1 4.28Å; R1234-F1431 HydrophobicContact CB-CE2 3.53Å; R1234-F1431 HydrophobicContact CB-CG 3.99Å; R1234-F1431 HydrophobicContact CB-CZ 3.87Å; R1234-F1431 HydrophobicContact CG-CD1 4.44Å; R1234-F1431 HydrophobicContact CG-CE1 4.32Å; R1234-F1431 HydrophobicContact CG-CE2 4.41Å; R1234-F1431 HydrophobicContact CG-CG 4.48Å; R1234-F1431 HydrophobicContact CG-CZ 4.29Å; R1234-F1431 WeakPolarHBondContact O-CE2 3.37Å; R1234-E1477 PolarHBondContact NE-O 3.46Å; R1234-P1478 HydrophobicContact CG-CG 4.44Å; R1234-P1478 VanDerWaalsContact NE-CA 3.29Å; R1234-P1478 PolarHBondContact NH2-O 2.58Å; R1234-P1478 VanDerWaalsContact NH2-O 3.13Å
1235	L	59.3	Low	54	Low	73 Å²	73	45.8 Å²	45.8	38%	0.382	25%	0.246	S	C	.	.	H	α-helix	trans	-46.6	-45.4	179.8	-132.3	70.4	0	0	0	112	A1231 L1232 S1238 Q1239 H1244	A1231-L1235 PolarHBondContact O-N 2.88Å; L1232-L1235 WeakPolarHBondContact O-CB 3.27Å; L1232-L1235 PolarHBondContact O-N 3.31Å; L1235-S1238 WeakPolarHBondContact CA-OG 3.42Å; L1235-S1238 PolarHBondContact O-N 2.95Å; L1235-S1238 PolarHBondContact O-OG 2.96Å; L1235-Q1239 PolarHBondContact O-N 2.94Å; L1235-H1244 WeakPolarHBondContact CD2-ND1 3.33Å; L1235-H1244 WeakPolarHBondContact CG-ND1 3.02Å; L1235-H1244 PolarHBondContact O-CE1 3.5Å; L1235-H1244 PolarHBondContact O-NE2 3.27Å
1236	I	52.4	Low	54.1	Low	6 Å²	6	45.8 Å²	45.8	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-42.7	175.4	-74.2	168.7	0	0	0	112.4	L1232 G1233 R1234 P1240 L1260 F1370	L1232-I1236 HydrophobicContact CD1-CD1 4.2Å; L1232-I1236 HydrophobicContact CD2-CD1 4.49Å; L1232-I1236 HydrophobicContact CG-CD1 3.97Å; L1232-I1236 WeakPolarHBondContact O-CG1 3.45Å; L1232-I1236 PolarHBondContact O-N 2.95Å; L1232-I1236 VanDerWaalsContact O-N 3.09Å; G1233-I1236 WeakPolarHBondContact O-CB 3.15Å; G1233-I1236 PolarHBondContact O-N 2.84Å; R1234-I1236 PolarHBondContact O-N 3.2Å; R1234-I1236 VanDerWaalsContact O-N 3.08Å; I1236-P1240 WeakPolarHBondContact O-CA 3.09Å; I1236-L1260 HydrophobicContact CD1-CD1 3.53Å; I1236-L1260 HydrophobicContact CG2-CD1 4.15Å; I1236-F1370 HydrophobicContact CB-CE2 4.32Å; I1236-F1370 HydrophobicContact CB-CZ 4.46Å; I1236-F1370 HydrophobicContact CD1-CE2 3.84Å; I1236-F1370 HydrophobicContact CD1-CZ 4.03Å; I1236-F1370 HydrophobicContact CG1-CD2 4.47Å; I1236-F1370 HydrophobicContact CG1-CE2 3.91Å; I1236-F1370 HydrophobicContact CG1-CZ 4.35Å; I1236-F1370 HydrophobicContact CG2-CD1 3.89Å; I1236-F1370 HydrophobicContact CG2-CD2 3.85Å; I1236-F1370 HydrophobicContact CG2-CE1 3.52Å; I1236-F1370 HydrophobicContact CG2-CE2 3.51Å; I1236-F1370 HydrophobicContact CG2-CG 4.06Å; I1236-F1370 HydrophobicContact CG2-CZ 3.35Å
1237	T	52.7	Low	53.8	Low	82 Å²	82	45 Å²	45	50%	0.503	24%	0.243	S	C	.	.	H	α-helix	trans	-65.8	-35.1	172.8	-51.7	0	0	0	0	113.2	G1233 R1234 E1477	G1233-T1237 PolarHBondContact O-N 3.2Å; G1233-T1237 PolarHBondContact O-OG1 3.34Å; R1234-T1237 CarbonylContact O-C 3.48Å; R1234-T1237 VanDerWaalsContact O-CA 3.3Å; R1234-T1237 WeakPolarHBondContact O-CA 3.44Å; R1234-T1237 WeakPolarHBondContact O-CB 3.46Å; R1234-T1237 PolarHBondContact O-N 3.26Å; T1237-E1477 PolarHBondContact OG1-OE2 2.66Å
1238	S	52.4	Low	53.6	Low	26 Å²	26	43 Å²	43	18%	0.182	24%	0.244	C	C	.	.	H	α-helix	trans	-73.8	-41.2	-177.5	33.3	0	0	0	0	114.1	R1234 L1235 F1431	R1234-S1238 PolarHBondContact O-N 3.4Å; R1234-S1238 PolarHBondContact O-OG 3.27Å; L1235-S1238 WeakPolarHBondContact CA-OG 3.42Å; L1235-S1238 PolarHBondContact O-N 2.95Å; L1235-S1238 PolarHBondContact O-OG 2.96Å; S1238-F1431 VanDerWaalsContact OG-CE2 3.3Å; S1238-F1431 WeakPolarHBondContact OG-CE2 3.27Å
1239	Q	56.2	Low	52.9	Low	70 Å²	70	46.9 Å²	46.9	33%	0.327	27%	0.265	S	S	.	.			trans	-135.6	61.3	-169.9	-63	159.2	-69.1	0	0	109.6	L1235 S1241 E1242 H1244	L1235-Q1239 PolarHBondContact O-N 2.94Å; Q1239-S1241 PolarHBondContact O-N 2.69Å; Q1239-E1242 HydrophobicContact CB-CB 3.92Å; Q1239-E1242 HydrophobicContact CB-CG 4.05Å; Q1239-E1242 PolarHBondContact NE2-OE1 2.83Å; Q1239-E1242 PolarHBondContact NE2-OE2 3.4Å; Q1239-E1242 PolarHBondContact O-N 2.91Å; Q1239-H1244 PolarHBondContact O-NE2 3.3Å
1240	P	49.6	Very low	52.8	Low	48 Å²	48	47.6 Å²	47.6	31%	0.312	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-32.9	-175.5	23.9	-34.5	0	0	0	112.5	I1236 E1242 F1370	I1236-P1240 WeakPolarHBondContact O-CA 3.09Å; P1240-E1242 VanDerWaalsContact C-N 3.3Å; P1240-E1242 PolarHBondContact O-N 2.92Å; P1240-F1370 HydrophobicContact CB-CB 3.85Å; P1240-F1370 WeakPolarHBondContact O-CA 3.28Å; P1240-F1370 WeakPolarHBondContact O-CB 3.21Å; P1240-F1370 PolarHBondContact O-N 3.24Å
1241	S	47.3	Very low	52.4	Low	86 Å²	86	46.8 Å²	46.8	60%	0.601	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.6	176.4	32.6	0	0	0	0	114.6	Q1239 Q1369	Q1239-S1241 PolarHBondContact O-N 2.69Å; S1241-Q1369 WeakPolarHBondContact O-CG 3.28Å; S1241-Q1369 PolarHBondContact O-NE2 2.81Å
1242	E	52	Low	51.9	Low	102 Å²	102	45 Å²	45	48%	0.477	25%	0.252	S	S	.	.	S	Bend	trans	-90.6	169.2	179.8	-72.4	-172.9	-139.7	0	0	113.7	Q1239 P1240 Q1369	Q1239-E1242 HydrophobicContact CB-CB 3.92Å; Q1239-E1242 HydrophobicContact CB-CG 4.05Å; Q1239-E1242 PolarHBondContact NE2-OE1 2.83Å; Q1239-E1242 PolarHBondContact NE2-OE2 3.4Å; Q1239-E1242 PolarHBondContact O-N 2.91Å; P1240-E1242 VanDerWaalsContact C-N 3.3Å; P1240-E1242 PolarHBondContact O-N 2.92Å; E1242-Q1369 WeakPolarHBondContact O-CA 3.39Å
1243	R	45.7	Very low	51.9	Low	126 Å²	126	47.1 Å²	47.1	48%	0.475	26%	0.261	S	S	.	.			trans	-98.9	95.7	-177.5	-79.3	179.9	-175.5	172.9	2.6	110.3	F1367 Q1369	R1243-F1367 HydrophobicContact CB-CB 3.76Å; R1243-F1367 HydrophobicContact CB-CD1 3.79Å; R1243-F1367 HydrophobicContact CB-CE1 4.47Å; R1243-F1367 HydrophobicContact CB-CG 3.78Å; R1243-F1367 HydrophobicContact CG-CB 4.12Å; R1243-F1367 HydrophobicContact CG-CG 4.46Å; R1243-F1367 WeakPolarHBondContact O-CD1 3.23Å; R1243-Q1369 HydrophobicContact CG-CB 4.12Å; R1243-Q1369 HydrophobicContact CG-CG 4.4Å
1244	H	50.1	Low	51.7	Low	10 Å²	10	46.7 Å²	46.7	5%	0.046	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	126.4	-177.8	-69.6	-76.7	0	0	0	112.4	L1235 Q1239 V1246 F1367 A1368	L1235-H1244 WeakPolarHBondContact CD2-ND1 3.33Å; L1235-H1244 WeakPolarHBondContact CG-ND1 3.02Å; L1235-H1244 PolarHBondContact O-CE1 3.5Å; L1235-H1244 PolarHBondContact O-NE2 3.27Å; Q1239-H1244 PolarHBondContact O-NE2 3.3Å; H1244-V1246 WeakPolarHBondContact O-CG2 3.37Å; H1244-V1246 PolarHBondContact O-N 3.12Å; H1244-V1246 VanDerWaalsContact O-N 3.1Å; H1244-F1367 CarbonylContact O-C 3.6Å; H1244-F1367 VanDerWaalsContact O-CA 3.24Å; H1244-F1367 WeakPolarHBondContact O-CA 3.46Å; H1244-A1368 PolarHBondContact N-O 2.79Å; H1244-A1368 PolarHBondContact O-N 3.02Å
1245	N	49.4	Very low	51.3	Low	79 Å²	79	47.2 Å²	47.2	42%	0.422	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	102.2	175.2	-174.7	-0	0	0	0	110.8	L1247 V1366 F1367	N1245-L1247 VanDerWaalsContact C-N 3.32Å; N1245-L1247 PolarHBondContact O-N 2.96Å; N1245-V1366 WeakPolarHBondContact CA-O 3.22Å; N1245-V1366 PolarHBondContact OD1-O 3.13Å; N1245-F1367 HydrophobicContact CB-CD1 4.42Å; N1245-F1367 HydrophobicContact CB-CE1 4.33Å
1246	V	52.2	Low	50.9	Low	12 Å²	12	44.2 Å²	44.2	7%	0.073	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-4.4	-165.8	-145.5	0	0	0	0	113.8	L1232 H1244 V1257 V1366 A1368	L1232-V1246 HydrophobicContact CD1-CG1 4.24Å; L1232-V1246 HydrophobicContact CD2-CG1 3.68Å; H1244-V1246 WeakPolarHBondContact O-CG2 3.37Å; H1244-V1246 PolarHBondContact O-N 3.12Å; H1244-V1246 VanDerWaalsContact O-N 3.1Å; V1246-V1257 HydrophobicContact CG1-CG2 3.27Å; V1246-V1366 HydrophobicContact CG2-CG1 4.43Å; V1246-V1366 PolarHBondContact N-O 3.32Å; V1246-A1368 HydrophobicContact CG2-CB 3.51Å
1247	L	48	Very low	50.9	Low	18 Å²	18	44.2 Å²	44.2	9%	0.094	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	27	-162.8	-72.6	-170.9	0	0	0	116	N1245 S1328 T1331 I1332 V1366	N1245-L1247 VanDerWaalsContact C-N 3.32Å; N1245-L1247 PolarHBondContact O-N 2.96Å; L1247-S1328 PolarHBondContact O-OG 2.91Å; L1247-T1331 HydrophobicContact CD2-CG2 4.05Å; L1247-I1332 HydrophobicContact CD1-CD1 3.7Å; L1247-I1332 HydrophobicContact CD1-CG1 3.79Å; L1247-I1332 HydrophobicContact CD2-CG1 4.28Å; L1247-V1366 HydrophobicContact CD1-CB 3.53Å; L1247-V1366 HydrophobicContact CD1-CG1 4.23Å; L1247-V1366 HydrophobicContact CD1-CG2 3.44Å; L1247-V1366 VanDerWaalsContact CD1-CG2 3.44Å; L1247-V1366 HydrophobicContact CG-CB 3.89Å; L1247-V1366 HydrophobicContact CG-CG1 4.34Å; L1247-V1366 HydrophobicContact CG-CG2 4.35Å
1248	G	50.6	Low	50.7	Low	29 Å²	29	41 Å²	41	30%	0.299	23%	0.229	S	C	.	.			trans	-60.7	153.8	168.6	0	0	0	0	0	113.2	S1250	G1248-S1250 PolarHBondContact O-N 3.34Å
1249	D	45.7	Very low	50.4	Low	111 Å²	111	40.9 Å²	40.9	59%	0.594	23%	0.23	S	C	*	.	S	Bend	trans	-63	3.3	-171.6	-80.4	-13.8	0	0	0	116.7	S1325	D1249-S1325 WeakPolarHBondContact OD1-CB 3.37Å; D1249-S1325 PolarHBondContact OD1-OG 3.43Å
1250	S	52	Low	50.1	Low	20 Å²	20	39.1 Å²	39.1	14%	0.14	22%	0.222	C	C	.	.			trans	-81.2	124.9	178.7	-169.3	0	0	0	0	112.6	D1228 G1248 G1252 F1253	D1228-S1250 WeakPolarHBondContact CB-OG 3.14Å; D1228-S1250 VanDerWaalsContact CG-OG 3.23Å; D1228-S1250 WeakPolarHBondContact OD2-CB 3.4Å; D1228-S1250 PolarHBondContact OD2-OG 3.46Å; G1248-S1250 PolarHBondContact O-N 3.34Å; S1250-G1252 PolarHBondContact O-N 3.32Å; S1250-G1252 PolarHBondContact OG-N 3.22Å; S1250-F1253 PolarHBondContact O-N 3.11Å; S1250-F1253 VanDerWaalsContact O-N 3.14Å
1251	A	50.1	Low	50	Low	12 Å²	12	38.5 Å²	38.5	10%	0.099	22%	0.216	C	C	.	.	H	α-helix	trans	-52.4	-23.8	162.2	0	0	0	0	0	113	S1144 F1225 V1254	S1144-A1251 WeakPolarHBondContact OG-CB 3.4Å; F1225-A1251 HydrophobicContact CD2-CB 3.67Å; F1225-A1251 HydrophobicContact CE2-CB 3.94Å; F1225-A1251 WeakPolarHBondContact CE2-O 3.27Å; A1251-V1254 WeakPolarHBondContact O-CB 3.45Å
1252	G	52.2	Low	49.9	Very low	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.8	-45.8	175.7	0	0	0	0	0	113.6	F1225 A1229 S1250 V1254 C1255 S1256	F1225-G1252 WeakPolarHBondContact O-CA 3.48Å; A1229-G1252 VanDerWaalsContact CA-C 3.41Å; A1229-G1252 WeakPolarHBondContact CA-O 3.32Å; A1229-G1252 WeakPolarHBondContact CB-O 3.3Å; S1250-G1252 PolarHBondContact O-N 3.32Å; S1250-G1252 PolarHBondContact OG-N 3.22Å; G1252-V1254 PolarHBondContact O-N 2.96Å; G1252-C1255 WeakPolarHBondContact O-CA 3.28Å; G1252-C1255 WeakPolarHBondContact O-CB 3.15Å; G1252-C1255 PolarHBondContact O-N 3.39Å; G1252-S1256 PolarHBondContact O-N 3.26Å; G1252-S1256 PolarHBondContact O-OG 2.8Å
1253	F	58.2	Low	49.4	Very low	45 Å²	45	35.3 Å²	35.3	20%	0.197	19%	0.191	C	C	.	.	H	α-helix	trans	-55.4	-40	178.9	-72	3.3	0	0	0	111.3	D1228 A1231 L1232 S1250 C1255 S1256 V1257	D1228-F1253 HydrophobicContact CB-CD1 4.13Å; D1228-F1253 HydrophobicContact CB-CE1 4.1Å; D1228-F1253 WeakPolarHBondContact O-CD1 3.39Å; D1228-F1253 VanDerWaalsContact O-CE1 3.26Å; D1228-F1253 WeakPolarHBondContact O-CE1 3.07Å; A1231-F1253 HydrophobicContact CB-CE1 4.42Å; L1232-F1253 HydrophobicContact CB-CD1 3.62Å; L1232-F1253 HydrophobicContact CB-CE1 3.95Å; L1232-F1253 HydrophobicContact CB-CG 4.09Å; L1232-F1253 HydrophobicContact CD2-CB 3.83Å; L1232-F1253 HydrophobicContact CD2-CD1 4.48Å; L1232-F1253 HydrophobicContact CD2-CG 4.14Å; S1250-F1253 PolarHBondContact O-N 3.11Å; S1250-F1253 VanDerWaalsContact O-N 3.14Å; F1253-C1255 PolarHBondContact O-N 2.98Å; F1253-S1256 PolarHBondContact O-N 3.41Å; F1253-S1256 PolarHBondContact O-OG 2.72Å; F1253-V1257 WeakPolarHBondContact O-CG2 3.34Å; F1253-V1257 PolarHBondContact O-N 3.19Å
1254	V	52.4	Low	49	Very low	6 Å²	6	38.6 Å²	38.6	4%	0.036	20%	0.203	C	C	.	.	H	α-helix	trans	-55.6	-37.5	172.6	-164.8	0	0	0	0	112.5	V1148 A1251 G1252 A1258 V1327 T1331	V1148-V1254 HydrophobicContact CG2-CG1 3.72Å; A1251-V1254 WeakPolarHBondContact O-CB 3.45Å; G1252-V1254 PolarHBondContact O-N 2.96Å; V1254-A1258 VanDerWaalsContact O-CB 3.32Å; V1254-A1258 WeakPolarHBondContact O-CB 3.32Å; V1254-A1258 PolarHBondContact O-N 3.5Å; V1254-V1327 HydrophobicContact CG2-CG1 3.53Å; V1254-T1331 HydrophobicContact CG1-CG2 4.15Å; V1254-T1331 WeakPolarHBondContact CG2-OG1 3.29Å
1255	C	48.9	Very low	48.4	Very low	31 Å²	31	45.2 Å²	45.2	21%	0.209	23%	0.234	C	C	.	.	H	α-helix	trans	-73.3	-38.9	-178	-157.6	0	0	0	0	112.4	I1147 F1225 A1229 G1252 F1253 A1259	I1147-C1255 HydrophobicContact CG2-CB 4.31Å; F1225-C1255 HydrophobicContact CE1-CB 4.02Å; F1225-C1255 HydrophobicContact CE2-CB 4.24Å; F1225-C1255 HydrophobicContact CZ-CB 3.48Å; F1225-C1255 VanDerWaalsContact CZ-CB 3.48Å; F1225-C1255 VanDerWaalsContact CZ-SG 3.54Å; A1229-C1255 HydrophobicContact CB-CB 4.02Å; G1252-C1255 WeakPolarHBondContact O-CA 3.28Å; G1252-C1255 WeakPolarHBondContact O-CB 3.15Å; G1252-C1255 PolarHBondContact O-N 3.39Å; F1253-C1255 PolarHBondContact O-N 2.98Å; C1255-A1259 WeakPolarHBondContact O-CB 3.41Å; C1255-A1259 PolarHBondContact O-N 2.84Å
1256	S	51.1	Low	47.9	Very low	9 Å²	9	42.7 Å²	42.7	6%	0.063	22%	0.224	C	C	.	.	H	α-helix	trans	-75.3	-40.7	177.6	30.2	0	0	0	0	113.1	A1229 G1252 F1253 A1258 A1259 L1260	A1229-S1256 WeakPolarHBondContact CA-OG 3.46Å; A1229-S1256 WeakPolarHBondContact O-CB 3.37Å; A1229-S1256 PolarHBondContact O-OG 3.22Å; G1252-S1256 PolarHBondContact O-N 3.26Å; G1252-S1256 PolarHBondContact O-OG 2.8Å; F1253-S1256 PolarHBondContact O-N 3.41Å; F1253-S1256 PolarHBondContact O-OG 2.72Å; S1256-A1258 PolarHBondContact O-N 3.08Å; S1256-A1259 PolarHBondContact O-N 2.94Å; S1256-A1259 VanDerWaalsContact O-N 3.13Å; S1256-L1260 WeakPolarHBondContact O-CB 3.45Å; S1256-L1260 WeakPolarHBondContact O-CD1 3.32Å; S1256-L1260 WeakPolarHBondContact O-CG 3.31Å; S1256-L1260 PolarHBondContact O-N 2.99Å
1257	V	51.7	Low	47.1	Very low	6 Å²	6	44.7 Å²	44.7	4%	0.036	24%	0.239	C	C	.	.	H	α-helix	trans	-52.3	-47.5	170.1	174.3	0	0	0	0	110.2	L1232 V1246 F1253 L1260 M1261 F1268 V1335	L1232-V1257 HydrophobicContact CD2-CG2 3.71Å; V1246-V1257 HydrophobicContact CG1-CG2 3.27Å; F1253-V1257 WeakPolarHBondContact O-CG2 3.34Å; F1253-V1257 PolarHBondContact O-N 3.19Å; V1257-L1260 PolarHBondContact O-N 3.26Å; V1257-M1261 HydrophobicContact CG1-CE 4.38Å; V1257-M1261 HydrophobicContact CG1-SD 4.33Å; V1257-M1261 WeakPolarHBondContact O-CB 3.47Å; V1257-M1261 WeakPolarHBondContact O-CG 3.22Å; V1257-M1261 PolarHBondContact O-N 3.33Å; V1257-F1268 HydrophobicContact CG1-CE1 4.49Å; V1257-V1335 HydrophobicContact CG1-CG2 3.91Å
1258	A	49.1	Very low	46.7	Very low	14 Å²	14	46.7 Å²	46.7	12%	0.116	25%	0.247	C	C	.	.	H	α-helix	trans	-75.7	-23.7	-177.9	0	0	0	0	0	114.3	L1151 V1254 S1256 N1262	L1151-A1258 HydrophobicContact CB-CB 4.05Å; L1151-A1258 HydrophobicContact CD1-CB 3.37Å; L1151-A1258 HydrophobicContact CD2-CB 3.72Å; L1151-A1258 HydrophobicContact CG-CB 3.89Å; V1254-A1258 VanDerWaalsContact O-CB 3.32Å; V1254-A1258 WeakPolarHBondContact O-CB 3.32Å; V1254-A1258 PolarHBondContact O-N 3.5Å; S1256-A1258 PolarHBondContact O-N 3.08Å; A1258-N1262 PolarHBondContact O-N 3.13Å
1259	A	46.1	Very low	46	Very low	25 Å²	25	48.5 Å²	48.5	21%	0.207	25%	0.248	C	C	.	.	H	α-helix	trans	-72.1	-43.7	169.8	0	0	0	0	0	111.4	C1255 S1256 N1262 R1263	C1255-A1259 WeakPolarHBondContact O-CB 3.41Å; C1255-A1259 PolarHBondContact O-N 2.84Å; S1256-A1259 PolarHBondContact O-N 2.94Å; S1256-A1259 VanDerWaalsContact O-N 3.13Å; A1259-N1262 WeakPolarHBondContact O-CA 3.25Å; A1259-N1262 WeakPolarHBondContact O-CB 3.39Å; A1259-N1262 PolarHBondContact O-N 2.8Å; A1259-R1263 PolarHBondContact O-N 3.4Å
1260	L	49.7	Very low	45.6	Very low	33 Å²	33	46.1 Å²	46.1	17%	0.173	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-41.4	173.7	-70.3	161.2	0	0	0	111.1	I1236 S1256 V1257 N1262 R1263 A1266 F1370	I1236-L1260 HydrophobicContact CD1-CD1 3.53Å; I1236-L1260 HydrophobicContact CG2-CD1 4.15Å; S1256-L1260 WeakPolarHBondContact O-CB 3.45Å; S1256-L1260 WeakPolarHBondContact O-CD1 3.32Å; S1256-L1260 WeakPolarHBondContact O-CG 3.31Å; S1256-L1260 PolarHBondContact O-N 2.99Å; V1257-L1260 PolarHBondContact O-N 3.26Å; L1260-N1262 PolarHBondContact O-N 3.19Å; L1260-R1263 WeakPolarHBondContact O-CB 3.4Å; L1260-R1263 PolarHBondContact O-N 2.74Å; L1260-A1266 HydrophobicContact CB-CB 4.48Å; L1260-F1370 HydrophobicContact CD1-CZ 4.16Å
1261	M	48.3	Very low	44.8	Very low	34 Å²	34	47.7 Å²	47.7	17%	0.167	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-24.8	170.8	-74.6	-173.3	165.4	0	0	114	V1257 R1263 F1268 V1335 K1338	V1257-M1261 HydrophobicContact CG1-CE 4.38Å; V1257-M1261 HydrophobicContact CG1-SD 4.33Å; V1257-M1261 WeakPolarHBondContact O-CB 3.47Å; V1257-M1261 WeakPolarHBondContact O-CG 3.22Å; V1257-M1261 PolarHBondContact O-N 3.33Å; M1261-R1263 VanDerWaalsContact C-N 3.3Å; M1261-F1268 HydrophobicContact CE-CD2 3.75Å; M1261-F1268 HydrophobicContact CE-CE1 4.31Å; M1261-F1268 HydrophobicContact CE-CE2 3.42Å; M1261-F1268 VanDerWaalsContact CE-CE2 3.42Å; M1261-F1268 HydrophobicContact CE-CG 4.33Å; M1261-F1268 HydrophobicContact CE-CZ 3.73Å; M1261-F1268 HydrophobicContact CG-CE2 3.71Å; M1261-F1268 HydrophobicContact CG-CZ 3.85Å; M1261-V1335 HydrophobicContact CE-CB 4.16Å; M1261-V1335 HydrophobicContact CE-CG1 3.91Å; M1261-V1335 HydrophobicContact CE-CG2 3.76Å; M1261-V1335 HydrophobicContact SD-CG2 4.12Å; M1261-K1338 HydrophobicContact CB-CD 4.29Å
1262	N	44.9	Very low	44	Very low	63 Å²	63	50 Å²	50	34%	0.337	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-10.1	173.1	-113.3	31.8	0	0	0	113.4	A1258 A1259 L1260 K1338	A1258-N1262 PolarHBondContact O-N 3.13Å; A1259-N1262 WeakPolarHBondContact O-CA 3.25Å; A1259-N1262 WeakPolarHBondContact O-CB 3.39Å; A1259-N1262 PolarHBondContact O-N 2.8Å; L1260-N1262 PolarHBondContact O-N 3.19Å; N1262-K1338 WeakPolarHBondContact OD1-CE 3.45Å; N1262-K1338 PolarHBondContact OD1-NZ 3.18Å
1263	R	40.5	Very low	43	Very low	58 Å²	58	53.1 Å²	53.1	22%	0.219	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-10.8	-176.8	-76.9	174.5	162.4	-96.9	-1.1	115.3	A1259 L1260 M1261 Q1265 N1488 L1489 D1490	A1259-R1263 PolarHBondContact O-N 3.4Å; L1260-R1263 WeakPolarHBondContact O-CB 3.4Å; L1260-R1263 PolarHBondContact O-N 2.74Å; M1261-R1263 VanDerWaalsContact C-N 3.3Å; R1263-Q1265 HydrophobicContact CB-CB 4.46Å; R1263-Q1265 PolarHBondContact O-N 3.07Å; R1263-Q1265 VanDerWaalsContact O-N 3.12Å; R1263-N1488 PolarHBondContact NH2-OD1 3.46Å; R1263-L1489 VanDerWaalsContact NH2-CB 3.3Å; R1263-D1490 VanDerWaalsContact CZ-CG 3.41Å; R1263-D1490 IonicContact CZ-OD1 2.69Å; R1263-D1490 IonicContact CZ-OD2 2.67Å; R1263-D1490 IonicContact NE-OD1 2.81Å; R1263-D1490 PolarHBondContact NE-OD1 2.85Å; R1263-D1490 IonicContact NH1-OD1 3.68Å; R1263-D1490 PolarHBondContact NH1-OD1 3.43Å; R1263-D1490 VanDerWaalsContact NH1-OD1 3.11Å; R1263-D1490 IonicContact NH1-OD2 3.19Å; R1263-D1490 PolarHBondContact NH1-OD2 3.49Å; R1263-D1490 VanDerWaalsContact NH2-N 3.18Å; R1263-D1490 IonicContact NH2-OD1 3.7Å; R1263-D1490 PolarHBondContact NH2-OD1 3.01Å; R1263-D1490 IonicContact NH2-OD2 2.92Å; R1263-D1490 PolarHBondContact NH2-OD2 2.63Å
1264	R	38.8	Very low	41.7	Very low	195 Å²	195	56.8 Å²	56.8	74%	0.736	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	17.5	-175	-63.6	178.1	161.1	163.5	-5.1	115.2	E1342	R1264-E1342 IonicContact NE-OE2 2.87Å
1265	Q	37.4	Very low	41.1	Very low	150 Å²	150	63.4 Å²	63.4	70%	0.701	33%	0.33	S	S	*	.			trans	-110.4	10.9	-175.8	-74.1	173.2	-45.5	0	0	113.5	R1263	R1263-Q1265 HydrophobicContact CB-CB 4.46Å; R1263-Q1265 PolarHBondContact O-N 3.07Å; R1263-Q1265 VanDerWaalsContact O-N 3.12Å
1266	A	38.1	Very low	40.4	Very low	26 Å²	26	67 Å²	67	22%	0.215	35%	0.346	C	S	.	.			trans	-127.8	118.1	-173.9	0	0	0	0	0	111.5	L1260 F1268 F1370	L1260-A1266 HydrophobicContact CB-CB 4.48Å; A1266-F1268 HydrophobicContact CB-CE2 3.74Å; A1266-F1268 HydrophobicContact CB-CZ 3.91Å; A1266-F1370 HydrophobicContact CB-CD1 4.25Å; A1266-F1370 HydrophobicContact CB-CE1 3.4Å; A1266-F1370 HydrophobicContact CB-CZ 3.75Å
1267	S	35.5	Very low	39.6	Very low	54 Å²	54	72.4 Å²	72.4	38%	0.378	37%	0.374	S	S	.	.			trans	-95.2	136.2	161.9	61.7	0	0	0	0	109.4
1268	F	38.6	Very low	38.5	Very low	59 Å²	59	75.8 Å²	75.8	26%	0.259	40%	0.402	S	S	.	.			trans	-109	102.1	-179.8	-63.1	-94.2	0	0	0	109.7	V1257 M1261 A1266 A1368 F1370	V1257-F1268 HydrophobicContact CG1-CE1 4.49Å; M1261-F1268 HydrophobicContact CE-CD2 3.75Å; M1261-F1268 HydrophobicContact CE-CE1 4.31Å; M1261-F1268 HydrophobicContact CE-CE2 3.42Å; M1261-F1268 VanDerWaalsContact CE-CE2 3.42Å; M1261-F1268 HydrophobicContact CE-CG 4.33Å; M1261-F1268 HydrophobicContact CE-CZ 3.73Å; M1261-F1268 HydrophobicContact CG-CE2 3.71Å; M1261-F1268 HydrophobicContact CG-CZ 3.85Å; A1266-F1268 HydrophobicContact CB-CE2 3.74Å; A1266-F1268 HydrophobicContact CB-CZ 3.91Å; F1268-A1368 HydrophobicContact CD1-CB 4Å; F1268-A1368 HydrophobicContact CE1-CB 4.49Å; F1268-F1370 HydrophobicContact CE1-CE2 4.41Å; F1268-F1370 HydrophobicContact CE1-CZ 4.36Å; F1268-F1370 HydrophobicContact CZ-CZ 4.49Å
1269	E	36.3	Very low	37.6	Very low	68 Å²	68	81.6 Å²	81.6	32%	0.318	43%	0.432	S	S	.	.			trans	-84	124.3	173.1	-170.2	154.4	-151.7	0	0	109.8	R1371	E1269-R1371 VanDerWaalsContact CD-NH2 3.31Å; E1269-R1371 IonicContact OE1-CZ 3.46Å; E1269-R1371 IonicContact OE1-NE 3.1Å; E1269-R1371 IonicContact OE1-NH2 3.58Å; E1269-R1371 PolarHBondContact OE1-NH2 2.63Å; E1269-R1371 IonicContact OE2-CZ 3.67Å; E1269-R1371 IonicContact OE2-NE 3.69Å; E1269-R1371 PolarHBondContact OE2-NE 3.12Å; E1269-R1371 IonicContact OE2-NH2 2.81Å; E1269-R1371 PolarHBondContact OE2-NH2 3.26Å; E1269-R1371 VanDerWaalsContact OE2-NH2 3.09Å
1270	I	38.6	Very low	36.7	Very low	60 Å²	60	87.2 Å²	87.2	31%	0.308	45%	0.454	S	S	.	.			trans	-117.3	123.6	-170.6	-52.1	173.9	0	0	0	109.2	L1359 L1361	I1270-L1359 HydrophobicContact CB-CD2 4.12Å; I1270-L1359 HydrophobicContact CD1-CD1 4.16Å; I1270-L1359 HydrophobicContact CG2-CD2 3.84Å; I1270-L1361 HydrophobicContact CG2-CD1 3.99Å; I1270-L1361 HydrophobicContact CG2-CD2 3.28Å; I1270-L1361 HydrophobicContact CG2-CG 4.22Å
1271	V	35.1	Very low	35.9	Very low	53 Å²	53	93.1 Å²	93.1	32%	0.321	48%	0.48	S	S	.	.			trans	-115.3	135.9	-167.3	-176.1	0	0	0	0	111.3
1272	I	32.9	Very low	34.9	Very low	62 Å²	62	98.1 Å²	98.1	32%	0.318	51%	0.508	S	S	.	.			trans	-116.2	128.8	177.1	-56.4	170.7	0	0	0	107.5	L1359 R1360 L1361	I1272-L1359 HydrophobicContact CD1-CD2 4.22Å; I1272-R1360 WeakPolarHBondContact CD1-O 3.33Å; I1272-L1361 HydrophobicContact CG1-CD2 4.44Å
1273	P	30.6	Very low	34.2	Very low	65 Å²	65	100.8 Å²	100.8	42%	0.422	53%	0.527	S	S	.	.			trans	-67.4	142.5	171.3	-20	33.4	0	0	0	112.4	D1275 L1276	P1273-D1275 VanDerWaalsContact C-N 3.27Å; P1273-D1275 WeakPolarHBondContact CB-OD2 3.48Å; P1273-D1275 PolarHBondContact O-N 2.96Å; P1273-L1276 PolarHBondContact O-N 3.38Å
1274	N	31.5	Very low	33.8	Very low	122 Å²	122	101.8 Å²	101.8	65%	0.652	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-69	-26.8	-179.1	-76.7	-9	0	0	0	112.8	L1276 L1277	N1274-L1276 PolarHBondContact O-N 2.58Å; N1274-L1277 WeakPolarHBondContact O-CB 3.3Å; N1274-L1277 PolarHBondContact O-N 2.77Å
1275	D	38.9	Very low	33.4	Very low	144 Å²	144	99.2 Å²	99.2	77%	0.77	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-61.4	-2.4	175.9	17.4	-59.3	0	0	0	114	P1273	P1273-D1275 VanDerWaalsContact C-N 3.27Å; P1273-D1275 WeakPolarHBondContact CB-OD2 3.48Å; P1273-D1275 PolarHBondContact O-N 2.96Å
1276	L	34.2	Very low	33.1	Very low	107 Å²	107	97 Å²	97	56%	0.56	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-117.6	19.8	171.5	-67.2	169.9	0	0	0	113.2	P1273 N1274 N1362	P1273-L1276 PolarHBondContact O-N 3.38Å; N1274-L1276 PolarHBondContact O-N 2.58Å; L1276-N1362 HydrophobicContact CD1-CB 4.5Å
1277	L	34	Very low	32.8	Very low	122 Å²	122	102.2 Å²	102.2	64%	0.639	58%	0.581	S	S	*	*	S	Bend	trans	-123.4	13.8	-178.1	-61.9	177.4	0	0	0	114.1	N1274	N1274-L1277 WeakPolarHBondContact O-CB 3.3Å; N1274-L1277 PolarHBondContact O-N 2.77Å
1278	A	30.1	Very low	32.6	Very low	77 Å²	77	103.7 Å²	103.7	64%	0.636	60%	0.596	S	S	*	*			trans	-120.1	156.1	177.5	0	0	0	0	0	112
1279	N	29.4	Very low	32.2	Very low	136 Å²	136	109.9 Å²	109.9	73%	0.727	63%	0.626	S	S	*	*			trans	66	128.9	-168.6	-57.8	40.6	0	0	0	113.5
1280	E	28.3	Very low	32	Very low	143 Å²	143	114 Å²	114	67%	0.668	65%	0.65	S	S	*	*			cis	-153.3	149.6	-2.2	-114.3	152.1	-155.3	0	0	109.7
1281	Q	31.1	Very low	31.7	Very low	158 Å²	158	118.3 Å²	118.3	74%	0.738	67%	0.674	S	S	*	*			trans	25.4	135.2	146.8	-64.7	146.7	-0.2	0	0	119.8
1282	D	28.7	Very low	31.5	Very low	138 Å²	138	119.9 Å²	119.9	74%	0.738	69%	0.692	S	S	*	*			cis	-168.6	-172.2	-8	-120.1	-56.3	0	0	0	107.4
1283	T	30.4	Very low	31.4	Very low	120 Å²	120	120.1 Å²	120.1	74%	0.736	71%	0.71	S	S	*	*			cis	-149.9	177.3	8.9	-10.6	0	0	0	0	110.5
1284	A	30.4	Very low	31.4	Very low	78 Å²	78	123.8 Å²	123.8	65%	0.645	73%	0.731	S	S	*	*			trans	31.5	132.9	146.3	0	0	0	0	0	120.9
1285	D	32.3	Very low	31.3	Very low	141 Å²	141	123.6 Å²	123.6	75%	0.754	74%	0.74	S	S	*	*			cis	-156.9	134.9	7.5	-121.4	-42.2	0	0	0	114.3
1286	S	29.6	Very low	30.9	Very low	103 Å²	103	120.9 Å²	120.9	72%	0.72	74%	0.738	S	S	*	*			trans	41.1	121.2	135.9	-54.7	0	0	0	0	123.5
1287	P	33.1	Very low	30.6	Very low	136 Å²	136	123.4 Å²	123.4	88%	0.883	75%	0.751	S	S	*	*			trans	-112.8	177.8	171.1	42.1	-33.4	0	0	0	115.5
1288	A	31.5	Very low	30.3	Very low	85 Å²	85	128.1 Å²	128.1	70%	0.702	76%	0.761	S	S	*	*			trans	-149.6	132.1	168	0	0	0	0	0	108.4
1289	E	29.9	Very low	30.1	Very low	190 Å²	190	130.1 Å²	130.1	89%	0.888	76%	0.761	S	S	*	*				73.6	122.6	71.9	-66.8	-178.9	170.7	0	0	114.7
1290	D	32.2	Very low	29.9	Very low	154 Å²	154	135.1 Å²	135.1	82%	0.824	77%	0.769	S	S	*	*			cis	-134.3	-107.4	-24.2	-168.4	52.6	0	0	0	114.4
1291	D	32.4	Very low	29.8	Very low	151 Å²	151	140.8 Å²	140.8	81%	0.807	79%	0.785	S	S	*	*			cis	-148.9	177.6	9.7	178.2	33.5	0	0	0	111.2
1292	A	29.4	Very low	29.4	Very low	85 Å²	85	137.5 Å²	137.5	70%	0.702	78%	0.779	S	S	*	*			trans	-91.9	172.7	-155	0	0	0	0	0	120.2
1293	G	31.7	Very low	29.1	Very low	68 Å²	68	141.2 Å²	141.2	70%	0.701	79%	0.789	S	S	*	*			trans	103	150.8	153.4	0	0	0	0	0	118.1
1294	T	30.9	Very low	28.7	Very low	141 Å²	141	142.5 Å²	142.5	87%	0.865	79%	0.79	S	S	*	*			cis	-161.1	147.6	-18.1	-36.2	0	0	0	0	109.4
1295	S	29.3	Very low	28.3	Very low	118 Å²	118	145.6 Å²	145.6	83%	0.825	80%	0.801	S	S	*	*			trans	65.8	149.6	158.9	-164.8	0	0	0	0	119.2
1296	A	29.2	Very low	28	Very low	88 Å²	88	141.7 Å²	141.7	73%	0.727	79%	0.794	S	S	*	*			cis	-167.3	130.5	-36.9	0	0	0	0	0	109.2
1297	D	28.8	Very low	27.7	Very low	159 Å²	159	143 Å²	143	85%	0.85	80%	0.797	S	S	*	*			trans	-164	165.1	140.9	-142.7	-19.3	0	0	0	112.2
1298	R	27.3	Very low	27.4	Very low	221 Å²	221	144.2 Å²	144.2	83%	0.834	80%	0.796	S	S	*	*	S	Bend	trans	-89.4	127.7	-156.4	-61.5	166.4	176.5	176.6	-2.8	115.2
1299	N	25.6	Very low	27.1	Very low	119 Å²	119	147 Å²	147	64%	0.636	80%	0.799	S	S	*	*				163.7	83.6	127	-89.3	18.9	0	0	0	109.6	H1376	N1299-H1376 PolarHBondContact ND2-NE2 3.47Å
1300	R	25.8	Very low	26.9	Very low	242 Å²	242	141.6 Å²	141.6	91%	0.913	80%	0.795	S	S	*	*			trans	-144.5	111.1	-174.6	-160	-178.5	-161.7	-179.3	5.4	110.3
1301	W	25.8	Very low	26.7	Very low	261 Å²	261	138.4 Å²	138.4	99%	0.989	79%	0.79	S	S	*	*			trans	-103.9	153.2	168.3	-72.7	80.9	0	0	0	109.7
1302	S	22.4	Very low	26.5	Very low	89 Å²	89	139.8 Å²	139.8	62%	0.622	79%	0.792	S	S	*	*			trans	-129.7	150.9	-164.2	52.4	0	0	0	0	112.5
1303	F	23.1	Very low	26.5	Very low	216 Å²	216	141.8 Å²	141.8	95%	0.947	80%	0.796	S	S	*	*			trans	-133.6	148.1	153.7	-91.4	-81.3	0	0	0	110.4
1304	I	21.4	Very low	26.2	Very low	147 Å²	147	143.8 Å²	143.8	75%	0.754	80%	0.799	S	S	*	*			trans	-123.5	-173.5	-174.3	-63.8	170.3	0	0	0	106.6
1305	V	23.7	Very low	26	Very low	143 Å²	143	146.6 Å²	146.6	87%	0.867	80%	0.802	S	S	*	*			trans	80	134.8	177.3	-167.6	0	0	0	0	112.5
1306	G	25.1	Very low	25.8	Very low	60 Å²	60	150.5 Å²	150.5	62%	0.619	81%	0.807	S	S	*	*			cis	159.7	148.3	-5.2	0	0	0	0	0	110.1
1307	V	22.9	Very low	25.7	Very low	130 Å²	130	151.6 Å²	151.6	79%	0.788	81%	0.81	S	S	*	*			trans	-76.9	136.4	176.3	-175.1	0	0	0	0	108.8	N1309	V1307-N1309 WeakPolarHBondContact CG1-OD1 3.5Å
1308	N	27.4	Very low	25.6	Very low	161 Å²	161	150 Å²	150	86%	0.861	81%	0.81	S	S	*	*			trans	-135.4	128.2	166.2	-149	12.6	0	0	0	108.5
1309	N	24.1	Very low	25.6	Very low	143 Å²	143	147.2 Å²	147.2	77%	0.765	81%	0.811	S	S	*	*			trans	-102.3	140.3	-168.9	-73.7	-24.4	0	0	0	111.6	V1307	V1307-N1309 WeakPolarHBondContact CG1-OD1 3.5Å
1310	G	27.1	Very low	25.7	Very low	78 Å²	78	145.7 Å²	145.7	80%	0.804	82%	0.815	S	S	*	*			trans	83.7	167.8	169.4	0	0	0	0	0	115.7
1311	A	28.4	Very low	25.8	Very low	87 Å²	87	140.3 Å²	140.3	72%	0.719	81%	0.814	S	S	*	*			cis	-158.2	137.1	-9.3	0	0	0	0	0	112.6
1312	Q	27.1	Very low	26.1	Very low	180 Å²	180	133 Å²	133	84%	0.841	80%	0.803	S	S	*	*			trans	63.3	172.9	148	-65.6	-179	-8.2	0	0	120.1
1313	T	29.1	Very low	26.7	Very low	127 Å²	127	137 Å²	137	78%	0.779	81%	0.812	S	S	*	*			trans	54.6	95.7	176.8	55.8	0	0	0	0	116.1
1314	S	25.8	Very low	27.3	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	78%	0.781	S	S	*	*			cis	83.1	103.1	42.9	86.6	0	0	0	0	115.5
1315	E	27.5	Very low	28.3	Very low	200 Å²	200	123.8 Å²	123.8	94%	0.935	76%	0.755	S	S	*	*			trans	-152.1	146	142.4	-124.5	171.4	-148.3	0	0	109.5
1316	Q	25.4	Very low	29	Very low	200 Å²	200	119.2 Å²	119.2	94%	0.935	73%	0.731	S	S	*	*			trans	-113.7	115.6	-170.1	-66.9	179.8	-7.6	0	0	111.2
1317	S	27.1	Very low	29.6	Very low	111 Å²	111	117 Å²	117	78%	0.776	71%	0.706	S	S	*	*			trans	-144.2	126.4	166.8	68.6	0	0	0	0	111.8	I1319	S1317-I1319 PolarHBondContact O-N 3.26Å
1318	S	24.8	Very low	30.4	Very low	124 Å²	124	111 Å²	111	87%	0.867	67%	0.669	S	S	*	*			trans	-70.2	120.8	-173.7	53.6	0	0	0	0	114
1319	I	28.5	Very low	31.2	Very low	163 Å²	163	105.5 Å²	105.5	84%	0.836	64%	0.638	S	S	*	*			trans	-131.1	133.7	162.9	-59.6	-177.2	0	0	0	109	S1317	S1317-I1319 PolarHBondContact O-N 3.26Å
1320	A	28.1	Very low	32	Very low	88 Å²	88	100.6 Å²	100.6	73%	0.727	61%	0.611	S	S	*	*			trans	-77.7	141.6	-165.3	0	0	0	0	0	114.8	S1322	A1320-S1322 PolarHBondContact O-N 2.7Å
1321	S	26.9	Very low	32.7	Very low	129 Å²	129	97.3 Å²	97.3	90%	0.902	58%	0.575	S	S	*	*			trans	-74.2	117	177	50.8	0	0	0	0	112.2
1322	S	32.9	Very low	33.6	Very low	107 Å²	107	95.2 Å²	95.2	75%	0.748	55%	0.551	S	S	*	*			trans	-126.3	116.9	-175.2	49.5	0	0	0	0	114.7	A1320	A1320-S1322 PolarHBondContact O-N 2.7Å
1323	Q	33.9	Very low	34.4	Very low	174 Å²	174	90.6 Å²	90.6	81%	0.813	53%	0.532	S	S	*	.			trans	45.6	81.3	144.2	-52.4	-164.9	30.5	0	0	120	S1325	Q1323-S1325 PolarHBondContact O-N 3.19Å
1324	L	37.1	Very low	35.1	Very low	56 Å²	56	86 Å²	86	29%	0.293	51%	0.506	S	S	.	.			trans	-73	115.9	157	-115.4	147.9	0	0	0	110.8	P1363	L1324-P1363 HydrophobicContact CD1-CB 3.9Å; L1324-P1363 HydrophobicContact CD2-CB 4.49Å
1325	S	42.3	Very low	36	Very low	29 Å²	29	82.4 Å²	82.4	20%	0.203	48%	0.479	C	S	.	.			trans	-69.4	162.6	-172.4	85.1	0	0	0	0	114.6	D1249 Q1323 V1327 S1328	D1249-S1325 WeakPolarHBondContact OD1-CB 3.37Å; D1249-S1325 PolarHBondContact OD1-OG 3.43Å; Q1323-S1325 PolarHBondContact O-N 3.19Å; S1325-V1327 PolarHBondContact O-N 3.04Å; S1325-V1327 PolarHBondContact OG-N 3.4Å; S1325-S1328 PolarHBondContact O-N 3.45Å
1326	A	38.5	Very low	36.7	Very low	46 Å²	46	77.8 Å²	77.8	38%	0.38	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-22.7	178.7	0	0	0	0	0	113.7	W1141 M1330	W1141-A1326 HydrophobicContact CZ2-CB 4.18Å; A1326-M1330 WeakPolarHBondContact O-CB 3.29Å; A1326-M1330 PolarHBondContact O-N 2.83Å
1327	V	36.5	Very low	37.6	Very low	15 Å²	15	74.5 Å²	74.5	9%	0.091	43%	0.432	C	S	.	.	H	α-helix	trans	-69.9	-45.8	-178	-178.3	0	0	0	0	110.5	V1254 S1325 K1329 M1330 T1331	V1254-V1327 HydrophobicContact CG2-CG1 3.53Å; S1325-V1327 PolarHBondContact O-N 3.04Å; S1325-V1327 PolarHBondContact OG-N 3.4Å; V1327-K1329 PolarHBondContact O-N 3.26Å; V1327-M1330 PolarHBondContact O-N 2.87Å; V1327-T1331 PolarHBondContact O-N 2.78Å; V1327-T1331 PolarHBondContact O-OG1 2.83Å
1328	S	39.5	Very low	38.4	Very low	2 Å²	2	70.6 Å²	70.6	1%	0.014	40%	0.401	C	S	.	.	H	α-helix	trans	-64.5	-43.3	-178.1	-46.8	0	0	0	0	111.7	L1247 S1325 T1331 I1332	L1247-S1328 PolarHBondContact O-OG 2.91Å; S1325-S1328 PolarHBondContact O-N 3.45Å; S1328-T1331 WeakPolarHBondContact O-CB 3.45Å; S1328-T1331 PolarHBondContact O-N 2.78Å; S1328-T1331 VanDerWaalsContact O-N 3.08Å; S1328-I1332 PolarHBondContact O-N 3.37Å; S1328-I1332 VanDerWaalsContact O-N 3.14Å
1329	K	45.2	Very low	39.3	Very low	47 Å²	47	69.4 Å²	69.4	20%	0.204	38%	0.384	C	S	.	.	H	α-helix	trans	-61.4	-45.6	175.7	-67.4	173.3	-179.6	169.9	0	112.2	L1119 V1327 T1331 I1332 L1333	L1119-K1329 HydrophobicContact CD1-CD 3.92Å; V1327-K1329 PolarHBondContact O-N 3.26Å; K1329-T1331 PolarHBondContact O-N 2.88Å; K1329-I1332 PolarHBondContact O-N 3.01Å; K1329-L1333 WeakPolarHBondContact O-CG 3.3Å; K1329-L1333 PolarHBondContact O-N 3.35Å
1330	M	39.7	Very low	40	Very low	40 Å²	40	66 Å²	66	20%	0.197	37%	0.367	C	S	.	.	H	α-helix	trans	-62.5	-25.3	174	-87.1	-71.8	-69.3	0	0	113.2	W1021 N1145 V1148 A1326 V1327 S1334	W1021-M1330 HydrophobicContact CB-CE 4.4Å; W1021-M1330 HydrophobicContact CD2-CE 2.35Å; W1021-M1330 HydrophobicContact CD2-CG 3.95Å; W1021-M1330 HydrophobicContact CD2-SD 2.48Å; W1021-M1330 HydrophobicContact CE3-CB 4.16Å; W1021-M1330 HydrophobicContact CE3-CE 2.35Å; W1021-M1330 HydrophobicContact CE3-CG 3.18Å; W1021-M1330 HydrophobicContact CE3-SD 2.46Å; W1021-M1330 HydrophobicContact CG-CE 3.41Å; W1021-M1330 VanDerWaalsContact CG-CE 3.41Å; W1021-M1330 HydrophobicContact CG-SD 3.7Å; W1021-M1330 HydrophobicContact CH2-CB 3.25Å; W1021-M1330 HydrophobicContact CH2-CE 2.34Å; W1021-M1330 HydrophobicContact CH2-CG 3.22Å; W1021-M1330 HydrophobicContact CH2-SD 2.46Å; W1021-M1330 WeakPolarHBondContact CH2-SD 3.33Å; W1021-M1330 HydrophobicContact CZ2-CB 4.38Å; W1021-M1330 HydrophobicContact CZ2-CE 2.35Å; W1021-M1330 HydrophobicContact CZ2-CG 3.97Å; W1021-M1330 HydrophobicContact CZ2-SD 2.47Å; W1021-M1330 WeakPolarHBondContact CZ2-SD 3.42Å; W1021-M1330 HydrophobicContact CZ3-CB 3.13Å; W1021-M1330 HydrophobicContact CZ3-CE 2.32Å; W1021-M1330 HydrophobicContact CZ3-CG 2.76Å; W1021-M1330 HydrophobicContact CZ3-SD 2.48Å; W1021-M1330 WeakPolarHBondContact CZ3-SD 3.5Å; N1145-M1330 HydrophobicContact CB-CE 4.39Å; V1148-M1330 HydrophobicContact CB-CE 4.22Å; V1148-M1330 HydrophobicContact CG1-CE 4.12Å; A1326-M1330 WeakPolarHBondContact O-CB 3.29Å; A1326-M1330 PolarHBondContact O-N 2.83Å; V1327-M1330 PolarHBondContact O-N 2.87Å; M1330-S1334 PolarHBondContact O-N 2.96Å; M1330-S1334 PolarHBondContact O-OG 2.96Å
1331	T	42.2	Very low	40.7	Very low	8 Å²	8	64.3 Å²	64.3	5%	0.049	35%	0.345	C	S	.	.	H	α-helix	trans	-74.1	-50.1	176.9	-54	0	0	0	0	110.9	L1247 V1254 V1327 S1328 K1329 L1333 S1334 V1335	L1247-T1331 HydrophobicContact CD2-CG2 4.05Å; V1254-T1331 HydrophobicContact CG1-CG2 4.15Å; V1254-T1331 WeakPolarHBondContact CG2-OG1 3.29Å; V1327-T1331 PolarHBondContact O-N 2.78Å; V1327-T1331 PolarHBondContact O-OG1 2.83Å; S1328-T1331 WeakPolarHBondContact O-CB 3.45Å; S1328-T1331 PolarHBondContact O-N 2.78Å; S1328-T1331 VanDerWaalsContact O-N 3.08Å; K1329-T1331 PolarHBondContact O-N 2.88Å; T1331-L1333 VanDerWaalsContact C-N 3.25Å; T1331-L1333 PolarHBondContact O-N 3.27Å; T1331-S1334 PolarHBondContact O-N 2.78Å; T1331-S1334 VanDerWaalsContact O-N 3.09Å; T1331-S1334 PolarHBondContact O-OG 2.86Å; T1331-V1335 WeakPolarHBondContact O-CG2 3.48Å; T1331-V1335 PolarHBondContact O-N 2.79Å
1332	I	46.5	Very low	41.3	Very low	43 Å²	43	60.9 Å²	60.9	22%	0.221	32%	0.315	C	S	.	.	H	α-helix	trans	-54.4	-42.6	174.7	-58.2	168.7	0	0	0	111.2	L1247 S1328 K1329 S1334 R1336 P1363	L1247-I1332 HydrophobicContact CD1-CD1 3.7Å; L1247-I1332 HydrophobicContact CD1-CG1 3.79Å; L1247-I1332 HydrophobicContact CD2-CG1 4.28Å; S1328-I1332 PolarHBondContact O-N 3.37Å; S1328-I1332 VanDerWaalsContact O-N 3.14Å; K1329-I1332 PolarHBondContact O-N 3.01Å; I1332-S1334 PolarHBondContact O-N 3.21Å; I1332-R1336 PolarHBondContact O-N 3.36Å; I1332-P1363 HydrophobicContact CD1-CB 4.42Å
1333	L	45.4	Very low	41.5	Very low	83 Å²	83	65.9 Å²	65.9	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-66.4	-33.2	179.8	-68.7	173.9	0	0	0	113.7	L1114 K1329 T1331 R1337	L1114-L1333 HydrophobicContact CD1-CD2 3.38Å; K1329-L1333 WeakPolarHBondContact O-CG 3.3Å; K1329-L1333 PolarHBondContact O-N 3.35Å; T1331-L1333 VanDerWaalsContact C-N 3.25Å; T1331-L1333 PolarHBondContact O-N 3.27Å; L1333-R1337 PolarHBondContact O-N 3.07Å
1334	S	42.7	Very low	41.7	Very low	32 Å²	32	65.4 Å²	65.4	22%	0.224	32%	0.316	C	S	.	.	H	α-helix	trans	-83.3	-33.1	179	46.6	0	0	0	0	112.7	M1330 T1331 I1332 K1338	M1330-S1334 PolarHBondContact O-N 2.96Å; M1330-S1334 PolarHBondContact O-OG 2.96Å; T1331-S1334 PolarHBondContact O-N 2.78Å; T1331-S1334 VanDerWaalsContact O-N 3.09Å; T1331-S1334 PolarHBondContact O-OG 2.86Å; I1332-S1334 PolarHBondContact O-N 3.21Å; S1334-K1338 WeakPolarHBondContact O-CB 3.39Å; S1334-K1338 PolarHBondContact O-N 2.84Å
1335	V	44.3	Very low	41.8	Very low	34 Å²	34	68.8 Å²	68.8	21%	0.206	33%	0.325	C	S	.	.	H	α-helix	trans	-53	-55.6	163.5	157.7	0	0	0	0	110.8	V1257 M1261 T1331 R1337 K1338 L1339	V1257-V1335 HydrophobicContact CG1-CG2 3.91Å; M1261-V1335 HydrophobicContact CE-CB 4.16Å; M1261-V1335 HydrophobicContact CE-CG1 3.91Å; M1261-V1335 HydrophobicContact CE-CG2 3.76Å; M1261-V1335 HydrophobicContact SD-CG2 4.12Å; T1331-V1335 WeakPolarHBondContact O-CG2 3.48Å; T1331-V1335 PolarHBondContact O-N 2.79Å; V1335-R1337 PolarHBondContact O-N 3.08Å; V1335-K1338 PolarHBondContact O-N 3.35Å; V1335-L1339 HydrophobicContact CG1-CD1 4.2Å; V1335-L1339 PolarHBondContact O-N 2.86Å; V1335-L1339 VanDerWaalsContact O-N 3.1Å
1336	R	43.8	Very low	41.4	Very low	102 Å²	102	71.9 Å²	71.9	39%	0.385	34%	0.343	S	S	.	.	H	α-helix	trans	-59.3	-47.4	-178.2	-170.5	-178.5	-178.7	125.5	-10.2	112.1	I1332 K1338 L1339 D1340	I1332-R1336 PolarHBondContact O-N 3.36Å; R1336-K1338 VanDerWaalsContact C-N 3.29Å; R1336-K1338 PolarHBondContact O-N 2.83Å; R1336-L1339 WeakPolarHBondContact O-CB 3.34Å; R1336-L1339 PolarHBondContact O-N 3.19Å; R1336-D1340 PolarHBondContact O-N 3.22Å
1337	R	44.6	Very low	41	Very low	132 Å²	132	71.9 Å²	71.9	50%	0.498	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-34.5	178.4	178.7	173.5	168.2	-159.7	-15.2	112.9	L1333 V1335 D1340 E1341	L1333-R1337 PolarHBondContact O-N 3.07Å; V1335-R1337 PolarHBondContact O-N 3.08Å; R1337-D1340 PolarHBondContact O-N 2.86Å; R1337-E1341 IonicContact CZ-OE1 2.66Å; R1337-E1341 IonicContact NE-OE1 3.18Å; R1337-E1341 PolarHBondContact NE-OE1 2.79Å; R1337-E1341 IonicContact NH2-OE1 2.76Å; R1337-E1341 PolarHBondContact NH2-OE1 2.98Å; R1337-E1341 WeakPolarHBondContact O-CG 3.34Å; R1337-E1341 PolarHBondContact O-N 3.01Å
1338	K	43.7	Very low	40.7	Very low	28 Å²	28	78.1 Å²	78.1	12%	0.122	39%	0.385	C	S	.	.	H	α-helix	trans	-74.9	-31.8	180	-161.3	154.2	-171.9	162.5	0	112.3	L1151 M1261 N1262 S1334 V1335 R1336 E1341 E1342	L1151-K1338 PolarHBondContact O-NZ 3.45Å; M1261-K1338 HydrophobicContact CB-CD 4.29Å; N1262-K1338 WeakPolarHBondContact OD1-CE 3.45Å; N1262-K1338 PolarHBondContact OD1-NZ 3.18Å; S1334-K1338 WeakPolarHBondContact O-CB 3.39Å; S1334-K1338 PolarHBondContact O-N 2.84Å; V1335-K1338 PolarHBondContact O-N 3.35Å; R1336-K1338 VanDerWaalsContact C-N 3.29Å; R1336-K1338 PolarHBondContact O-N 2.83Å; K1338-E1341 PolarHBondContact O-N 3.02Å; K1338-E1342 PolarHBondContact O-N 2.88Å
1339	L	42.9	Very low	40.2	Very low	100 Å²	100	83.2 Å²	83.2	52%	0.524	42%	0.421	S	S	.	.	H	α-helix	trans	-64.3	-45.4	167	-71.1	164.1	0	0	0	111.3	V1335 R1336 E1341 E1342 Y1343	V1335-L1339 HydrophobicContact CG1-CD1 4.2Å; V1335-L1339 PolarHBondContact O-N 2.86Å; V1335-L1339 VanDerWaalsContact O-N 3.1Å; R1336-L1339 WeakPolarHBondContact O-CB 3.34Å; R1336-L1339 PolarHBondContact O-N 3.19Å; L1339-E1341 VanDerWaalsContact C-N 3.31Å; L1339-E1341 PolarHBondContact O-N 3.49Å; L1339-E1342 PolarHBondContact O-N 3.37Å; L1339-Y1343 WeakPolarHBondContact O-CB 3.18Å; L1339-Y1343 PolarHBondContact O-N 2.88Å
1340	D	43.3	Very low	39.6	Very low	90 Å²	90	89.5 Å²	89.5	48%	0.481	45%	0.451	S	S	.	.	H	α-helix	trans	-58.9	-40.1	174.1	-66.3	-36	0	0	0	112.1	R1336 R1337 Y1343 Q1344	R1336-D1340 PolarHBondContact O-N 3.22Å; R1337-D1340 PolarHBondContact O-N 2.86Å; D1340-Y1343 PolarHBondContact O-N 3.47Å; D1340-Q1344 WeakPolarHBondContact O-CG 3.45Å; D1340-Q1344 PolarHBondContact O-N 2.7Å; D1340-Q1344 VanDerWaalsContact O-N 3.1Å
1341	E	43.7	Very low	39	Very low	53 Å²	53	92.7 Å²	92.7	25%	0.248	48%	0.477	C	S	.	.	H	α-helix	trans	-72.3	-34.8	178.9	-76.5	-179	-165	0	0	113.4	R1337 K1338 L1339 R1345	R1337-E1341 IonicContact CZ-OE1 2.66Å; R1337-E1341 IonicContact NE-OE1 3.18Å; R1337-E1341 PolarHBondContact NE-OE1 2.79Å; R1337-E1341 IonicContact NH2-OE1 2.76Å; R1337-E1341 PolarHBondContact NH2-OE1 2.98Å; R1337-E1341 WeakPolarHBondContact O-CG 3.34Å; R1337-E1341 PolarHBondContact O-N 3.01Å; K1338-E1341 PolarHBondContact O-N 3.02Å; L1339-E1341 VanDerWaalsContact C-N 3.31Å; L1339-E1341 PolarHBondContact O-N 3.49Å; E1341-R1345 WeakPolarHBondContact O-CD 3.42Å; E1341-R1345 WeakPolarHBondContact O-CG 3.5Å; E1341-R1345 PolarHBondContact O-N 3.02Å
1342	E	39.3	Very low	38.4	Very low	58 Å²	58	99.5 Å²	99.5	27%	0.271	52%	0.519	S	S	.	.	H	α-helix	trans	-70.2	-38.7	168.9	-75.2	-70.6	106.4	0	0	111.5	R1264 K1338 L1339 Q1344 R1345 V1346	R1264-E1342 IonicContact NE-OE2 2.87Å; K1338-E1342 PolarHBondContact O-N 2.88Å; L1339-E1342 PolarHBondContact O-N 3.37Å; E1342-Q1344 PolarHBondContact O-N 2.79Å; E1342-R1345 WeakPolarHBondContact O-CA 3.46Å; E1342-R1345 WeakPolarHBondContact O-CB 3.24Å; E1342-R1345 PolarHBondContact O-N 2.74Å; E1342-R1345 WeakPolarHBondContact OE1-CD 3.33Å; E1342-R1345 IonicContact OE1-CZ 2.71Å; E1342-R1345 IonicContact OE1-NE 2.86Å; E1342-R1345 IonicContact OE1-NH1 2.71Å; E1342-R1345 PolarHBondContact OE1-NH1 3.05Å; E1342-V1346 WeakPolarHBondContact O-CG2 3.17Å; E1342-V1346 PolarHBondContact O-N 3.32Å
1343	Y	36.1	Very low	37.5	Very low	212 Å²	212	103.8 Å²	103.8	83%	0.831	55%	0.547	S	S	*	.	H	α-helix	trans	-59.2	-32.4	175.7	-158.5	-85.7	0	0	0	112.3	L1339 D1340	L1339-Y1343 WeakPolarHBondContact O-CB 3.18Å; L1339-Y1343 PolarHBondContact O-N 2.88Å; D1340-Y1343 PolarHBondContact O-N 3.47Å
1344	Q	39.2	Very low	36.6	Very low	163 Å²	163	103 Å²	103	76%	0.762	56%	0.558	S	S	*	*	H	α-helix	trans	-81.2	-17.3	171.7	-69.4	-174.3	14.2	0	0	114.5	D1340 E1342	D1340-Q1344 WeakPolarHBondContact O-CG 3.45Å; D1340-Q1344 PolarHBondContact O-N 2.7Å; D1340-Q1344 VanDerWaalsContact O-N 3.1Å; E1342-Q1344 PolarHBondContact O-N 2.79Å
1345	R	37.9	Very low	35.9	Very low	127 Å²	127	113.2 Å²	113.2	48%	0.479	59%	0.592	S	S	.	*	H	α-helix	trans	-85.5	-32.4	177	-73	162.4	-176.3	-168.5	1.1	112.9	D1154 E1341 E1342 G1347	D1154-R1345 IonicContact OD2-NH2 3.94Å; D1154-R1345 PolarHBondContact OD2-NH2 2.8Å; E1341-R1345 WeakPolarHBondContact O-CD 3.42Å; E1341-R1345 WeakPolarHBondContact O-CG 3.5Å; E1341-R1345 PolarHBondContact O-N 3.02Å; E1342-R1345 WeakPolarHBondContact O-CA 3.46Å; E1342-R1345 WeakPolarHBondContact O-CB 3.24Å; E1342-R1345 PolarHBondContact O-N 2.74Å; E1342-R1345 WeakPolarHBondContact OE1-CD 3.33Å; E1342-R1345 IonicContact OE1-CZ 2.71Å; E1342-R1345 IonicContact OE1-NE 2.86Å; E1342-R1345 IonicContact OE1-NH1 2.71Å; E1342-R1345 PolarHBondContact OE1-NH1 3.05Å; R1345-G1347 PolarHBondContact O-N 2.95Å
1346	V	34	Very low	35.1	Very low	95 Å²	95	116.7 Å²	116.7	58%	0.576	61%	0.613	S	S	*	*	S	Bend	trans	-80.7	55.5	-177.3	-171.8	0	0	0	0	111.5	E1342 T1348	E1342-V1346 WeakPolarHBondContact O-CG2 3.17Å; E1342-V1346 PolarHBondContact O-N 3.32Å; V1346-T1348 PolarHBondContact O-N 3.44Å; V1346-T1348 VanDerWaalsContact O-N 3.14Å
1347	G	30.7	Very low	34.2	Very low	45 Å²	45	121 Å²	121	46%	0.464	64%	0.637	S	S	.	*			trans	-65.6	108.6	-176.6	0	0	0	0	0	114.3	R1345 S1349	R1345-G1347 PolarHBondContact O-N 2.95Å; G1347-S1349 PolarHBondContact O-N 3.44Å
1348	T	30.4	Very low	33.3	Very low	147 Å²	147	122.1 Å²	122.1	90%	0.902	65%	0.648	S	S	*	*	S	Bend	trans	64.4	22	148.6	65.2	0	0	0	0	119.4	V1346	V1346-T1348 PolarHBondContact O-N 3.44Å; V1346-T1348 VanDerWaalsContact O-N 3.14Å
1349	S	29.5	Very low	32.5	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	66%	0.658	S	S	*	*	S	Bend	trans	-139.2	-14.3	-177.4	-52.6	0	0	0	0	119.4	G1347	G1347-S1349 PolarHBondContact O-N 3.44Å
1350	Q	31	Very low	31.8	Very low	179 Å²	179	127 Å²	127	84%	0.836	66%	0.663	S	S	*	*			trans	-139.8	131.7	-179.3	-72.8	-173.8	-23.6	0	0	111.7
1351	S	28.3	Very low	31.2	Very low	108 Å²	108	124.2 Å²	124.2	76%	0.755	65%	0.648	S	S	*	*			trans	-94.6	119.7	-176.2	53.3	0	0	0	0	111.9
1352	V	29.2	Very low	30.8	Very low	151 Å²	151	126.7 Å²	126.7	92%	0.915	66%	0.663	S	S	*	*			trans	-113.1	117.1	156.7	179.7	0	0	0	0	106.7
1353	T	27.1	Very low	30.5	Very low	132 Å²	132	125 Å²	125	81%	0.81	66%	0.657	S	S	*	*			trans	-99.9	126.9	-166.8	35.6	0	0	0	0	112.7
1354	G	27.4	Very low	30.5	Very low	66 Å²	66	119.3 Å²	119.3	68%	0.68	65%	0.647	S	S	*	*			trans	106.2	115.8	153.6	0	0	0	0	0	117.2
1355	R	27	Very low	30.4	Very low	248 Å²	248	118.7 Å²	118.7	94%	0.936	64%	0.642	S	S	*	*			trans	69.2	137.5	158.7	-52.2	170.6	-176.2	175.4	-1.1	113.6
1356	V	27.2	Very low	30.6	Very low	106 Å²	106	113.9 Å²	113.9	64%	0.642	63%	0.627	S	S	*	*			cis	-124.5	138.7	24.6	176.5	0	0	0	0	111.4	H1358 L1359	V1356-H1358 VanDerWaalsContact CG1-O 3.23Å; V1356-H1358 WeakPolarHBondContact CG1-O 3.49Å; V1356-L1359 HydrophobicContact CB-CD1 4.49Å; V1356-L1359 HydrophobicContact CG1-CD1 4.28Å; V1356-L1359 HydrophobicContact CG1-CG 4.11Å
1357	Q	26.4	Very low	30.9	Very low	192 Å²	192	112.4 Å²	112.4	90%	0.897	61%	0.613	S	S	*	*	S	Bend	trans	-96.9	-16.9	-178.6	-85.1	176	-46.4	0	0	115.5
1358	H	25.6	Very low	31.4	Very low	157 Å²	157	110.4 Å²	110.4	73%	0.727	59%	0.591	S	S	*	*			trans	-134.6	128.5	174.3	-86.4	-106.3	0	0	0	111.1	V1356	V1356-H1358 VanDerWaalsContact CG1-O 3.23Å; V1356-H1358 WeakPolarHBondContact CG1-O 3.49Å
1359	L	27.3	Very low	31.8	Very low	63 Å²	63	105.6 Å²	105.6	33%	0.33	56%	0.559	S	S	.	*			trans	-136.5	89.6	176	-99	161.1	0	0	0	109.8	I1270 I1272 V1356 L1361	I1270-L1359 HydrophobicContact CB-CD2 4.12Å; I1270-L1359 HydrophobicContact CD1-CD1 4.16Å; I1270-L1359 HydrophobicContact CG2-CD2 3.84Å; I1272-L1359 HydrophobicContact CD1-CD2 4.22Å; V1356-L1359 HydrophobicContact CB-CD1 4.49Å; V1356-L1359 HydrophobicContact CG1-CD1 4.28Å; V1356-L1359 HydrophobicContact CG1-CG 4.11Å; L1359-L1361 HydrophobicContact CD2-CD1 4.09Å; L1359-L1361 HydrophobicContact CD2-CD2 3.81Å; L1359-L1361 HydrophobicContact CD2-CG 3.86Å
1360	R	26.3	Very low	32.4	Very low	168 Å²	168	101.7 Å²	101.7	63%	0.634	53%	0.528	S	S	*	.			trans	-84.8	126.3	158.7	-76.5	178.2	168.7	168.2	-5.6	106.9	N1116 I1272	N1116-R1360 PolarHBondContact OD1-NE 3.09Å; N1116-R1360 PolarHBondContact OD1-NH2 3.3Å; I1272-R1360 WeakPolarHBondContact CD1-O 3.33Å
1361	L	31	Very low	32.6	Very low	30 Å²	30	100.7 Å²	100.7	16%	0.157	52%	0.517	C	S	.	.			trans	-127.4	90	-172.5	-75.4	166.7	0	0	0	111.9	F1117 I1270 I1272 L1359	F1117-L1361 WeakPolarHBondContact CE1-O 3.48Å; F1117-L1361 HydrophobicContact CZ-CB 3.94Å; F1117-L1361 VanDerWaalsContact CZ-N 3.35Å; F1117-L1361 WeakPolarHBondContact CZ-O 3.44Å; I1270-L1361 HydrophobicContact CG2-CD1 3.99Å; I1270-L1361 HydrophobicContact CG2-CD2 3.28Å; I1270-L1361 HydrophobicContact CG2-CG 4.22Å; I1272-L1361 HydrophobicContact CG1-CD2 4.44Å; L1359-L1361 HydrophobicContact CD2-CD1 4.09Å; L1359-L1361 HydrophobicContact CD2-CD2 3.81Å; L1359-L1361 HydrophobicContact CD2-CG 3.86Å
1362	N	35.1	Very low	32.9	Very low	105 Å²	105	101.3 Å²	101.3	56%	0.561	51%	0.512	S	S	*	.			trans	-60.6	119.5	173.3	-163.1	-7.9	0	0	0	109	L1276 C1364	L1276-N1362 HydrophobicContact CD1-CB 4.5Å; N1362-C1364 VanDerWaalsContact C-N 3.26Å; N1362-C1364 PolarHBondContact O-N 3.15Å
1363	P	34.2	Very low	33	Very low	24 Å²	24	100.5 Å²	100.5	16%	0.156	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	9.6	-147.2	-13.2	30.1	0	0	0	116.1	L1324 I1332	L1324-P1363 HydrophobicContact CD1-CB 3.9Å; L1324-P1363 HydrophobicContact CD2-CB 4.49Å; I1332-P1363 HydrophobicContact CD1-CB 4.42Å
1364	C	34.8	Very low	33	Very low	91 Å²	91	100.8 Å²	100.8	62%	0.615	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-23.9	-166	-59.5	0	0	0	0	115	N1362	N1362-C1364 VanDerWaalsContact C-N 3.26Å; N1362-C1364 PolarHBondContact O-N 3.15Å
1365	K	38.1	Very low	32.9	Very low	150 Å²	150	106.3 Å²	106.3	65%	0.652	51%	0.508	S	S	*	.			trans	-146.2	79.6	179.1	-64.4	-177.1	-177	175.8	0	110.7	F1367	K1365-F1367 HydrophobicContact CB-CD2 4.34Å; K1365-F1367 HydrophobicContact CB-CE2 3.73Å; K1365-F1367 HydrophobicContact CB-CZ 4Å; K1365-F1367 HydrophobicContact CD-CE2 4.21Å; K1365-F1367 HydrophobicContact CD-CZ 4.12Å; K1365-F1367 HydrophobicContact CG-CE2 4.5Å; K1365-F1367 HydrophobicContact CG-CZ 4.42Å; K1365-F1367 PolarHBondContact O-N 3.17Å
1366	V	41.5	Very low	32.8	Very low	26 Å²	26	101.1 Å²	101.1	16%	0.158	49%	0.494	C	S	.	.			trans	-85	107.8	170.8	172.3	0	0	0	0	108.7	N1245 V1246 L1247	N1245-V1366 WeakPolarHBondContact CA-O 3.22Å; N1245-V1366 PolarHBondContact OD1-O 3.13Å; V1246-V1366 HydrophobicContact CG2-CG1 4.43Å; V1246-V1366 PolarHBondContact N-O 3.32Å; L1247-V1366 HydrophobicContact CD1-CB 3.53Å; L1247-V1366 HydrophobicContact CD1-CG1 4.23Å; L1247-V1366 HydrophobicContact CD1-CG2 3.44Å; L1247-V1366 VanDerWaalsContact CD1-CG2 3.44Å; L1247-V1366 HydrophobicContact CG-CB 3.89Å; L1247-V1366 HydrophobicContact CG-CG1 4.34Å; L1247-V1366 HydrophobicContact CG-CG2 4.35Å
1367	F	41.1	Very low	32.7	Very low	65 Å²	65	100.8 Å²	100.8	29%	0.285	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	142.4	173.2	-62.8	-65.3	0	0	0	111.2	R1243 H1244 N1245 K1365	R1243-F1367 HydrophobicContact CB-CB 3.76Å; R1243-F1367 HydrophobicContact CB-CD1 3.79Å; R1243-F1367 HydrophobicContact CB-CE1 4.47Å; R1243-F1367 HydrophobicContact CB-CG 3.78Å; R1243-F1367 HydrophobicContact CG-CB 4.12Å; R1243-F1367 HydrophobicContact CG-CG 4.46Å; R1243-F1367 WeakPolarHBondContact O-CD1 3.23Å; H1244-F1367 CarbonylContact O-C 3.6Å; H1244-F1367 VanDerWaalsContact O-CA 3.24Å; H1244-F1367 WeakPolarHBondContact O-CA 3.46Å; N1245-F1367 HydrophobicContact CB-CD1 4.42Å; N1245-F1367 HydrophobicContact CB-CE1 4.33Å; K1365-F1367 HydrophobicContact CB-CD2 4.34Å; K1365-F1367 HydrophobicContact CB-CE2 3.73Å; K1365-F1367 HydrophobicContact CB-CZ 4Å; K1365-F1367 HydrophobicContact CD-CE2 4.21Å; K1365-F1367 HydrophobicContact CD-CZ 4.12Å; K1365-F1367 HydrophobicContact CG-CE2 4.5Å; K1365-F1367 HydrophobicContact CG-CZ 4.42Å; K1365-F1367 PolarHBondContact O-N 3.17Å
1368	A	41	Very low	32.7	Very low	2 Å²	2	96.6 Å²	96.6	2%	0.017	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134	159.3	0	0	0	0	0	109.5	H1244 V1246 F1268 F1370	H1244-A1368 PolarHBondContact N-O 2.79Å; H1244-A1368 PolarHBondContact O-N 3.02Å; V1246-A1368 HydrophobicContact CG2-CB 3.51Å; F1268-A1368 HydrophobicContact CD1-CB 4Å; F1268-A1368 HydrophobicContact CE1-CB 4.49Å; A1368-F1370 HydrophobicContact CB-CE2 4.27Å
1369	Q	38.9	Very low	32.7	Very low	47 Å²	47	98.6 Å²	98.6	22%	0.22	50%	0.495	C	S	.	.			trans	-123.4	125.3	173.7	-170.6	168.9	6.6	0	0	107.7	S1241 E1242 R1243	S1241-Q1369 WeakPolarHBondContact O-CG 3.28Å; S1241-Q1369 PolarHBondContact O-NE2 2.81Å; E1242-Q1369 WeakPolarHBondContact O-CA 3.39Å; R1243-Q1369 HydrophobicContact CG-CB 4.12Å; R1243-Q1369 HydrophobicContact CG-CG 4.4Å
1370	F	41.3	Very low	32.7	Very low	25 Å²	25	98.2 Å²	98.2	11%	0.11	51%	0.506	C	S	.	.			trans	-95.5	104.3	-174	-85.2	-119	0	0	0	110	I1236 P1240 L1260 A1266 F1268 A1368 N1372	I1236-F1370 HydrophobicContact CB-CE2 4.32Å; I1236-F1370 HydrophobicContact CB-CZ 4.46Å; I1236-F1370 HydrophobicContact CD1-CE2 3.84Å; I1236-F1370 HydrophobicContact CD1-CZ 4.03Å; I1236-F1370 HydrophobicContact CG1-CD2 4.47Å; I1236-F1370 HydrophobicContact CG1-CE2 3.91Å; I1236-F1370 HydrophobicContact CG1-CZ 4.35Å; I1236-F1370 HydrophobicContact CG2-CD1 3.89Å; I1236-F1370 HydrophobicContact CG2-CD2 3.85Å; I1236-F1370 HydrophobicContact CG2-CE1 3.52Å; I1236-F1370 HydrophobicContact CG2-CE2 3.51Å; I1236-F1370 HydrophobicContact CG2-CG 4.06Å; I1236-F1370 HydrophobicContact CG2-CZ 3.35Å; P1240-F1370 HydrophobicContact CB-CB 3.85Å; P1240-F1370 WeakPolarHBondContact O-CA 3.28Å; P1240-F1370 WeakPolarHBondContact O-CB 3.21Å; P1240-F1370 PolarHBondContact O-N 3.24Å; L1260-F1370 HydrophobicContact CD1-CZ 4.16Å; A1266-F1370 HydrophobicContact CB-CD1 4.25Å; A1266-F1370 HydrophobicContact CB-CE1 3.4Å; A1266-F1370 HydrophobicContact CB-CZ 3.75Å; F1268-F1370 HydrophobicContact CE1-CE2 4.41Å; F1268-F1370 HydrophobicContact CE1-CZ 4.36Å; F1268-F1370 HydrophobicContact CZ-CZ 4.49Å; A1368-F1370 HydrophobicContact CB-CE2 4.27Å; F1370-N1372 PolarHBondContact O-N 3.33Å
1371	R	37	Very low	32.8	Very low	159 Å²	159	101.6 Å²	101.6	60%	0.6	52%	0.519	S	S	*	.			trans	-71.2	111.1	166.9	-67.6	-169.2	-176.3	-152.8	4.5	109.5	E1269 T1373	E1269-R1371 VanDerWaalsContact CD-NH2 3.31Å; E1269-R1371 IonicContact OE1-CZ 3.46Å; E1269-R1371 IonicContact OE1-NE 3.1Å; E1269-R1371 IonicContact OE1-NH2 3.58Å; E1269-R1371 PolarHBondContact OE1-NH2 2.63Å; E1269-R1371 IonicContact OE2-CZ 3.67Å; E1269-R1371 IonicContact OE2-NE 3.69Å; E1269-R1371 PolarHBondContact OE2-NE 3.12Å; E1269-R1371 IonicContact OE2-NH2 2.81Å; E1269-R1371 PolarHBondContact OE2-NH2 3.26Å; E1269-R1371 VanDerWaalsContact OE2-NH2 3.09Å; R1371-T1373 PolarHBondContact O-N 2.97Å
1372	N	32.9	Very low	32.9	Very low	121 Å²	121	103.3 Å²	103.3	65%	0.647	54%	0.544	S	S	*	.			trans	-63	113.1	169.3	-154.4	23.6	0	0	0	108.3	F1370 E1374	F1370-N1372 PolarHBondContact O-N 3.33Å; N1372-E1374 HydrophobicContact CB-CG 4.27Å; N1372-E1374 PolarHBondContact O-N 3.14Å
1373	T	31.4	Very low	32.9	Very low	133 Å²	133	104.6 Å²	104.6	82%	0.816	56%	0.561	S	S	*	*			trans	-77.1	77.1	172	53	0	0	0	0	108.8	R1371 Q1375	R1371-T1373 PolarHBondContact O-N 2.97Å; T1373-Q1375 PolarHBondContact O-N 3.18Å; T1373-Q1375 VanDerWaalsContact O-N 3.15Å
1374	E	27.8	Very low	33.7	Very low	138 Å²	138	106 Å²	106	65%	0.645	57%	0.57	S	S	*	*			trans	-60.2	117.8	176.6	-64.9	-171.7	167.9	0	0	109.4	N1372 H1376	N1372-E1374 HydrophobicContact CB-CG 4.27Å; N1372-E1374 PolarHBondContact O-N 3.14Å; E1374-H1376 PolarHBondContact O-N 3.04Å
1375	Q	25.8	Very low	35.1	Very low	183 Å²	183	103.8 Å²	103.8	86%	0.855	55%	0.552	S	S	*	*			trans	-58.5	115.8	142.9	-70.1	-177.3	-20.1	0	0	105.3	T1373 P1377	T1373-Q1375 PolarHBondContact O-N 3.18Å; T1373-Q1375 VanDerWaalsContact O-N 3.15Å; Q1375-P1377 WeakPolarHBondContact O-CD 3.37Å
1376	H	24.7	Very low	36.3	Very low	139 Å²	139	99.3 Å²	99.3	64%	0.644	54%	0.538	S	S	*	.			trans	-47.4	117.5	167.6	-81.5	-84.2	0	0	0	108.5	N1299 E1374 S1378	N1299-H1376 PolarHBondContact ND2-NE2 3.47Å; E1374-H1376 PolarHBondContact O-N 3.04Å; H1376-S1378 PolarHBondContact O-N 3.48Å
1377	P	24.2	Very low	38.1	Very low	98 Å²	98	98.5 Å²	98.5	64%	0.636	53%	0.532	S	S	*	.			trans	-64	123.7	145.8	-1.6	20.8	0	0	0	104.7	Q1375 E1379	Q1375-P1377 WeakPolarHBondContact O-CD 3.37Å; P1377-E1379 VanDerWaalsContact C-N 3.3Å; P1377-E1379 PolarHBondContact O-N 3.23Å
1378	S	26.9	Very low	39.7	Very low	105 Å²	105	99 Å²	99	73%	0.734	54%	0.535	S	S	*	.			trans	-60.2	101.2	156.2	52.7	0	0	0	0	107.3	H1376 G1380	H1376-S1378 PolarHBondContact O-N 3.48Å; S1378-G1380 PolarHBondContact O-N 3.13Å
1379	E	25.3	Very low	41	Very low	199 Å²	199	103 Å²	103	93%	0.93	56%	0.555	S	S	*	*	S	Bend	trans	41.3	68.7	149.6	-62.1	166.9	168.9	0	0	114.6	P1377	P1377-E1379 VanDerWaalsContact C-N 3.3Å; P1377-E1379 PolarHBondContact O-N 3.23Å
1380	G	28	Very low	42.4	Very low	54 Å²	54	101 Å²	101	56%	0.557	55%	0.547	S	S	*	.			trans	-145.4	-12	-161.7	0	0	0	0	0	121.1	S1378	S1378-G1380 PolarHBondContact O-N 3.13Å
1381	R	28.9	Very low	43.9	Very low	239 Å²	239	100.8 Å²	100.8	90%	0.902	55%	0.546	S	S	*	.			trans	170.8	128.8	160	-95.4	144.5	-155.6	-112.6	-0.3	110
1382	G	32	Very low	45.6	Very low	67 Å²	67	99.5 Å²	99.5	69%	0.691	54%	0.541	S	S	*	.			trans	-78.3	177.8	-173.6	0	0	0	0	0	115.1	T1384	G1382-T1384 PolarHBondContact O-N 2.68Å; G1382-T1384 VanDerWaalsContact O-N 3.07Å
1383	S	35.1	Very low	47.2	Very low	131 Å²	131	97.5 Å²	97.5	92%	0.916	53%	0.528	S	S	*	.			trans	-39.8	108.6	178.4	-174.2	0	0	0	0	113.1	D1385	S1383-D1385 PolarHBondContact O-N 2.75Å
1384	T	50.6	Low	49.1	Very low	55 Å²	55	91.3 Å²	91.3	34%	0.337	49%	0.49	S	S	.	.			trans	-84.7	99.4	172.6	47.7	0	0	0	0	109.5	G1382	G1382-T1384 PolarHBondContact O-N 2.68Å; G1382-T1384 VanDerWaalsContact O-N 3.07Å
1385	D	65.6	Low	51.1	Low	44 Å²	44	85.8 Å²	85.8	24%	0.235	47%	0.465	C	S	.	.			trans	-24.9	126.1	157.8	169.4	3.4	0	0	0	111.2	S1383 W1387 Q1388 I1389 K1420	S1383-D1385 PolarHBondContact O-N 2.75Å; D1385-W1387 PolarHBondContact O-N 3.04Å; D1385-W1387 VanDerWaalsContact O-N 3.09Å; D1385-W1387 VanDerWaalsContact OD1-CB 3.31Å; D1385-W1387 WeakPolarHBondContact OD1-CB 3.31Å; D1385-W1387 PolarHBondContact OD1-N 2.67Å; D1385-Q1388 HydrophobicContact CB-CB 4.25Å; D1385-Q1388 HydrophobicContact CB-CG 3.79Å; D1385-Q1388 WeakPolarHBondContact O-CA 3.44Å; D1385-Q1388 WeakPolarHBondContact O-CB 3.48Å; D1385-Q1388 PolarHBondContact O-N 3.33Å; D1385-I1389 PolarHBondContact O-N 3.02Å; D1385-K1420 WeakPolarHBondContact OD2-CE 3.19Å; D1385-K1420 IonicContact OD2-NZ 3.49Å; D1385-K1420 PolarHBondContact OD2-NZ 3.3Å
1386	P	63.3	Low	53.1	Low	56 Å²	56	83.6 Å²	83.6	36%	0.364	45%	0.453	S	S	.	.	H	α-helix	trans	-52.4	-33.4	-179.7	-28.4	35.8	0	0	0	113.3	Q1388 I1389 A1390 F1423	P1386-Q1388 VanDerWaalsContact C-N 3.32Å; P1386-Q1388 PolarHBondContact O-N 3.03Å; P1386-I1389 PolarHBondContact O-N 3Å; P1386-A1390 WeakPolarHBondContact O-CB 3.43Å; P1386-A1390 PolarHBondContact O-N 3.04Å; P1386-F1423 HydrophobicContact CB-CE1 4.24Å
1387	W	77.8	Confident	54.8	Low	9 Å²	9	83 Å²	83	3%	0.034	45%	0.445	C	S	.	.	H	α-helix	trans	-64.7	-32.4	173.2	174.6	-112.2	0	0	0	112.9	D1385 A1390 K1391 V1416 L1419 K1420 F1423 L1454	D1385-W1387 PolarHBondContact O-N 3.04Å; D1385-W1387 VanDerWaalsContact O-N 3.09Å; D1385-W1387 VanDerWaalsContact OD1-CB 3.31Å; D1385-W1387 WeakPolarHBondContact OD1-CB 3.31Å; D1385-W1387 PolarHBondContact OD1-N 2.67Å; W1387-A1390 HydrophobicContact CE3-CB 4.39Å; W1387-A1390 PolarHBondContact O-N 3.5Å; W1387-K1391 VanDerWaalsContact O-CB 3.23Å; W1387-K1391 WeakPolarHBondContact O-CB 3.13Å; W1387-K1391 PolarHBondContact O-N 3.07Å; W1387-V1416 HydrophobicContact CZ2-CG1 3.95Å; W1387-L1419 HydrophobicContact CH2-CB 4.2Å; W1387-L1419 HydrophobicContact CH2-CD1 4.21Å; W1387-L1419 HydrophobicContact CH2-CD2 3.93Å; W1387-L1419 HydrophobicContact CH2-CG 4.34Å; W1387-L1419 HydrophobicContact CZ3-CD2 4.17Å; W1387-K1420 HydrophobicContact CB-CD 4.31Å; W1387-K1420 HydrophobicContact CB-CG 4.1Å; W1387-K1420 VanDerWaalsContact CD1-CD 3.45Å; W1387-K1420 HydrophobicContact CD2-CB 3.97Å; W1387-K1420 HydrophobicContact CD2-CG 3.91Å; W1387-K1420 HydrophobicContact CG-CB 4.2Å; W1387-K1420 HydrophobicContact CG-CD 3.84Å; W1387-K1420 HydrophobicContact CG-CG 3.61Å; W1387-K1420 HydrophobicContact CZ2-CB 4.29Å; W1387-F1423 HydrophobicContact CB-CD1 4.44Å; W1387-F1423 HydrophobicContact CE3-CB 3.82Å; W1387-F1423 AromaticContact CE3-CD1 3.81Å; W1387-F1423 HydrophobicContact CE3-CD1 3.81Å; W1387-F1423 AromaticContact CE3-CG 3.92Å; W1387-F1423 HydrophobicContact CE3-CG 3.92Å; W1387-F1423 HydrophobicContact CZ3-CB 3.95Å; W1387-F1423 HydrophobicContact CZ3-CG 4.26Å; W1387-L1454 HydrophobicContact CZ3-CD2 4.39Å
1388	Q	74.3	Confident	56.8	Low	76 Å²	76	82.9 Å²	82.9	36%	0.355	44%	0.435	S	S	.	.	H	α-helix	trans	-74.1	-28.1	174.7	-62.6	-68.3	-14.6	0	0	112.4	D1385 P1386 R1392	D1385-Q1388 HydrophobicContact CB-CB 4.25Å; D1385-Q1388 HydrophobicContact CB-CG 3.79Å; D1385-Q1388 WeakPolarHBondContact O-CA 3.44Å; D1385-Q1388 WeakPolarHBondContact O-CB 3.48Å; D1385-Q1388 PolarHBondContact O-N 3.33Å; P1386-Q1388 VanDerWaalsContact C-N 3.32Å; P1386-Q1388 PolarHBondContact O-N 3.03Å; Q1388-R1392 WeakPolarHBondContact O-CB 3.42Å; Q1388-R1392 VanDerWaalsContact O-CG 3.23Å; Q1388-R1392 WeakPolarHBondContact O-CG 3.15Å; Q1388-R1392 PolarHBondContact O-N 2.81Å; Q1388-R1392 VanDerWaalsContact O-N 3.15Å
1389	I	69.8	Low	57.8	Low	84 Å²	84	79.9 Å²	79.9	43%	0.431	42%	0.416	S	S	.	.	H	α-helix	trans	-70.3	-47.8	169.7	-55.1	178.5	0	0	0	109.2	D1385 P1386 K1391 R1392 E1393	D1385-I1389 PolarHBondContact O-N 3.02Å; P1386-I1389 PolarHBondContact O-N 3Å; I1389-K1391 PolarHBondContact O-N 3.26Å; I1389-R1392 WeakPolarHBondContact O-CB 3.43Å; I1389-R1392 PolarHBondContact O-N 2.98Å; I1389-E1393 PolarHBondContact O-N 3.37Å
1390	A	67.3	Low	59	Low	6 Å²	6	75.8 Å²	75.8	5%	0.05	41%	0.41	C	S	.	.	H	α-helix	trans	-60.1	-44.2	175.6	0	0	0	0	0	113	P1386 W1387 R1392 E1393 L1394 F1423 L1459	P1386-A1390 WeakPolarHBondContact O-CB 3.43Å; P1386-A1390 PolarHBondContact O-N 3.04Å; W1387-A1390 HydrophobicContact CE3-CB 4.39Å; W1387-A1390 PolarHBondContact O-N 3.5Å; A1390-R1392 VanDerWaalsContact C-N 3.29Å; A1390-R1392 PolarHBondContact O-N 2.76Å; A1390-E1393 PolarHBondContact O-N 2.8Å; A1390-L1394 PolarHBondContact O-N 2.91Å; A1390-F1423 HydrophobicContact CB-CD1 4.19Å; A1390-F1423 HydrophobicContact CB-CE1 3.67Å; A1390-F1423 HydrophobicContact CB-CE2 4.04Å; A1390-F1423 HydrophobicContact CB-CZ 3.59Å; A1390-L1459 HydrophobicContact CB-CD1 3.98Å; A1390-L1459 HydrophobicContact CB-CD2 3.86Å
1391	K	74.2	Confident	60	Low	20 Å²	20	79.6 Å²	79.6	9%	0.087	42%	0.418	C	S	.	.	H	α-helix	trans	-64.1	-32.3	176	-164.1	172.5	-172.3	179.3	0	111.3	W1387 I1389 V1395 L1405 V1408 E1409	W1387-K1391 VanDerWaalsContact O-CB 3.23Å; W1387-K1391 WeakPolarHBondContact O-CB 3.13Å; W1387-K1391 PolarHBondContact O-N 3.07Å; I1389-K1391 PolarHBondContact O-N 3.26Å; K1391-V1395 WeakPolarHBondContact O-CB 3.31Å; K1391-V1395 VanDerWaalsContact O-CG2 3.24Å; K1391-V1395 WeakPolarHBondContact O-CG2 3.49Å; K1391-V1395 PolarHBondContact O-N 2.72Å; K1391-L1405 HydrophobicContact CD-CD2 3.83Å; K1391-L1405 HydrophobicContact CG-CD2 4.33Å; K1391-V1408 HydrophobicContact CG-CG2 4.45Å; K1391-E1409 IonicContact NZ-OE1 2.81Å; K1391-E1409 PolarHBondContact NZ-OE1 3.26Å
1392	R	71.5	Confident	60.7	Low	132 Å²	132	73.9 Å²	73.9	50%	0.498	41%	0.409	S	S	.	.	H	α-helix	trans	-69.9	-40.4	172.1	-76.6	173.3	-169.8	169.4	8.2	113.1	Q1388 I1389 A1390 V1395 K1396	Q1388-R1392 WeakPolarHBondContact O-CB 3.42Å; Q1388-R1392 VanDerWaalsContact O-CG 3.23Å; Q1388-R1392 WeakPolarHBondContact O-CG 3.15Å; Q1388-R1392 PolarHBondContact O-N 2.81Å; Q1388-R1392 VanDerWaalsContact O-N 3.15Å; I1389-R1392 WeakPolarHBondContact O-CB 3.43Å; I1389-R1392 PolarHBondContact O-N 2.98Å; A1390-R1392 VanDerWaalsContact C-N 3.29Å; A1390-R1392 PolarHBondContact O-N 2.76Å; R1392-V1395 PolarHBondContact O-N 2.68Å; R1392-K1396 WeakPolarHBondContact O-CG 3.33Å; R1392-K1396 PolarHBondContact O-N 2.76Å
1393	E	66.8	Low	61.3	Low	80 Å²	80	75.9 Å²	75.9	37%	0.374	41%	0.41	S	S	.	.	H	α-helix	trans	-70.8	-35	175.4	-64.9	-54.4	131.2	0	0	112.3	I1389 A1390 K1396 R1397	I1389-E1393 PolarHBondContact O-N 3.37Å; A1390-E1393 PolarHBondContact O-N 2.8Å; E1393-K1396 PolarHBondContact O-N 2.77Å; E1393-K1396 WeakPolarHBondContact OE1-CE 3.41Å; E1393-K1396 IonicContact OE1-NZ 2.97Å; E1393-K1396 PolarHBondContact OE1-NZ 3.1Å; E1393-K1396 WeakPolarHBondContact OE2-CD 3.3Å; E1393-K1396 IonicContact OE2-NZ 3.27Å; E1393-K1396 PolarHBondContact OE2-NZ 3.02Å; E1393-R1397 PolarHBondContact O-N 2.82Å
1394	L	70.4	Confident	62.2	Low	2 Å²	2	73.5 Å²	73.5	1%	0.01	39%	0.387	C	S	.	.	H	α-helix	trans	-55.7	-53.8	165.9	-96.3	168.4	0	0	0	111.2	A1390 K1396 R1397 F1398 V1408 F1453 N1457 L1459	A1390-L1394 PolarHBondContact O-N 2.91Å; L1394-K1396 VanDerWaalsContact C-N 3.34Å; L1394-K1396 PolarHBondContact O-N 2.87Å; L1394-R1397 PolarHBondContact O-N 2.93Å; L1394-R1397 VanDerWaalsContact O-N 3.12Å; L1394-F1398 HydrophobicContact CD2-CD2 4.33Å; L1394-F1398 HydrophobicContact CD2-CE2 3.77Å; L1394-F1398 VanDerWaalsContact O-CD2 3.31Å; L1394-F1398 WeakPolarHBondContact O-CD2 3.31Å; L1394-F1398 PolarHBondContact O-N 3.35Å; L1394-V1408 HydrophobicContact CB-CG2 4.4Å; L1394-V1408 HydrophobicContact CD1-CG1 4.16Å; L1394-F1453 HydrophobicContact CD2-CE1 4.14Å; L1394-F1453 HydrophobicContact CD2-CZ 4.41Å; L1394-N1457 HydrophobicContact CD2-CB 3.86Å; L1394-N1457 WeakPolarHBondContact CD2-OD1 3.31Å; L1394-L1459 HydrophobicContact CD1-CD1 3.5Å; L1394-L1459 HydrophobicContact CG-CD1 3.71Å; L1394-L1459 HydrophobicContact CG-CG 4.4Å
1395	V	70.5	Confident	62.1	Low	22 Å²	22	75.5 Å²	75.5	13%	0.133	40%	0.395	C	S	.	.	H	α-helix	trans	-59.7	-43.2	179.2	167.8	0	0	0	0	111.1	K1391 R1392 R1397 F1398 A1399 P1403 V1408	K1391-V1395 WeakPolarHBondContact O-CB 3.31Å; K1391-V1395 VanDerWaalsContact O-CG2 3.24Å; K1391-V1395 WeakPolarHBondContact O-CG2 3.49Å; K1391-V1395 PolarHBondContact O-N 2.72Å; R1392-V1395 PolarHBondContact O-N 2.68Å; V1395-R1397 VanDerWaalsContact C-N 3.32Å; V1395-R1397 PolarHBondContact O-N 2.79Å; V1395-F1398 PolarHBondContact O-N 3.32Å; V1395-A1399 WeakPolarHBondContact O-CB 3.35Å; V1395-A1399 PolarHBondContact O-N 2.68Å; V1395-P1403 HydrophobicContact CG1-CB 3.69Å; V1395-V1408 HydrophobicContact CG2-CG2 3.81Å
1396	K	67.2	Low	61.7	Low	137 Å²	137	81.9 Å²	81.9	60%	0.596	42%	0.416	S	S	*	.	H	α-helix	trans	-58.5	-39.1	174.3	-78.5	179.8	-177.4	172.5	0	113.4	R1392 E1393 L1394 F1398	R1392-K1396 WeakPolarHBondContact O-CG 3.33Å; R1392-K1396 PolarHBondContact O-N 2.76Å; E1393-K1396 PolarHBondContact O-N 2.77Å; E1393-K1396 WeakPolarHBondContact OE1-CE 3.41Å; E1393-K1396 IonicContact OE1-NZ 2.97Å; E1393-K1396 PolarHBondContact OE1-NZ 3.1Å; E1393-K1396 WeakPolarHBondContact OE2-CD 3.3Å; E1393-K1396 IonicContact OE2-NZ 3.27Å; E1393-K1396 PolarHBondContact OE2-NZ 3.02Å; L1394-K1396 VanDerWaalsContact C-N 3.34Å; L1394-K1396 PolarHBondContact O-N 2.87Å; K1396-F1398 VanDerWaalsContact C-N 3.32Å; K1396-F1398 PolarHBondContact O-N 2.67Å
1397	R	61.3	Low	61.5	Low	127 Å²	127	82 Å²	82	48%	0.479	42%	0.418	S	S	.	.	H	α-helix	trans	-69.7	-27.3	-179.2	-86.6	-173.2	155.9	-166.6	-10.7	113.7	E1393 L1394 V1395 N1457 D1458	E1393-R1397 PolarHBondContact O-N 2.82Å; L1394-R1397 PolarHBondContact O-N 2.93Å; L1394-R1397 VanDerWaalsContact O-N 3.12Å; V1395-R1397 VanDerWaalsContact C-N 3.32Å; V1395-R1397 PolarHBondContact O-N 2.79Å; R1397-N1457 PolarHBondContact NH1-O 3.21Å; R1397-D1458 IonicContact CZ-OD2 2.74Å; R1397-D1458 IonicContact NH1-OD2 3.79Å; R1397-D1458 PolarHBondContact NH1-OD2 3.01Å; R1397-D1458 IonicContact NH2-OD2 3.41Å; R1397-D1458 PolarHBondContact NH2-OD2 2.52Å
1398	F	65.5	Low	60.5	Low	95 Å²	95	81.7 Å²	81.7	42%	0.417	42%	0.417	S	S	.	.	H	α-helix	trans	-102.1	-13.8	178.3	-66.5	-65.5	0	0	0	114.4	L1394 V1395 K1396 S1400 L1411 N1457	L1394-F1398 HydrophobicContact CD2-CD2 4.33Å; L1394-F1398 HydrophobicContact CD2-CE2 3.77Å; L1394-F1398 VanDerWaalsContact O-CD2 3.31Å; L1394-F1398 WeakPolarHBondContact O-CD2 3.31Å; L1394-F1398 PolarHBondContact O-N 3.35Å; V1395-F1398 PolarHBondContact O-N 3.32Å; K1396-F1398 VanDerWaalsContact C-N 3.32Å; K1396-F1398 PolarHBondContact O-N 2.67Å; F1398-S1400 PolarHBondContact O-N 3.18Å; F1398-L1411 HydrophobicContact CB-CD1 4.36Å; F1398-L1411 HydrophobicContact CD1-CD1 3.78Å; F1398-L1411 HydrophobicContact CD2-CD1 3.68Å; F1398-L1411 HydrophobicContact CE1-CD1 3.93Å; F1398-L1411 HydrophobicContact CE2-CD1 3.83Å; F1398-L1411 HydrophobicContact CG-CD1 3.67Å; F1398-L1411 HydrophobicContact CZ-CD1 3.96Å; F1398-N1457 WeakPolarHBondContact CE2-OD1 3.48Å; F1398-N1457 VanDerWaalsContact CZ-OD1 3.27Å; F1398-N1457 WeakPolarHBondContact CZ-OD1 3.49Å
1399	A	48.5	Very low	59.9	Low	42 Å²	42	82.6 Å²	82.6	35%	0.347	42%	0.422	S	S	.	.			trans	-79.8	86.8	179.8	0	0	0	0	0	112	V1395 D1401	V1395-A1399 WeakPolarHBondContact O-CB 3.35Å; V1395-A1399 PolarHBondContact O-N 2.68Å; A1399-D1401 VanDerWaalsContact C-N 3.3Å
1400	S	49.8	Very low	59.8	Low	114 Å²	114	87.3 Å²	87.3	80%	0.797	44%	0.439	S	S	*	.	S	Bend	trans	-66.3	-35.8	158.5	58.6	0	0	0	0	111.4	F1398	F1398-S1400 PolarHBondContact O-N 3.18Å
1401	D	49.2	Very low	59.7	Low	134 Å²	134	90.9 Å²	90.9	72%	0.717	46%	0.457	S	S	*	.	S	Bend	trans	-149.3	138.4	172.7	-88	-61.2	0	0	0	110.6	A1399	A1399-D1401 VanDerWaalsContact C-N 3.3Å
1402	T	44.9	Very low	59.7	Low	118 Å²	118	90.5 Å²	90.5	72%	0.724	46%	0.455	S	S	*	.			trans	56.6	123.2	173.9	63.1	0	0	0	0	118.4	D1404	T1402-D1404 PolarHBondContact O-N 3.19Å
1403	P	44.3	Very low	59.7	Low	109 Å²	109	93.9 Å²	93.9	71%	0.708	47%	0.473	S	S	*	.			trans	-89	83.7	-179.4	35.2	-34.8	0	0	0	113.3	V1395	V1395-P1403 HydrophobicContact CG1-CB 3.69Å
1404	D	53.3	Low	60	Low	81 Å²	81	90.9 Å²	90.9	43%	0.433	46%	0.464	S	S	.	.			trans	-88.8	137.3	164.6	-169.7	4.6	0	0	0	111.5	T1402 R1406	T1402-D1404 PolarHBondContact O-N 3.19Å; D1404-R1406 VanDerWaalsContact C-N 3.29Å; D1404-R1406 PolarHBondContact O-N 3.47Å; D1404-R1406 PolarHBondContact OD1-N 2.85Å
1405	L	47.9	Very low	60.4	Low	97 Å²	97	94 Å²	94	51%	0.508	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-68.3	-25.9	179.2	-85.1	157.1	0	0	0	113.1	K1391 S1407	K1391-L1405 HydrophobicContact CD-CD2 3.83Å; K1391-L1405 HydrophobicContact CG-CD2 4.33Å; L1405-S1407 VanDerWaalsContact C-N 3.25Å; L1405-S1407 PolarHBondContact O-N 2.96Å
1406	R	57.9	Low	60.8	Low	178 Å²	178	94.3 Å²	94.3	67%	0.672	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-70.1	-15.9	-179.5	-69.4	172.9	165.5	172.2	-4.2	114.2	D1404 V1408 E1409	D1404-R1406 VanDerWaalsContact C-N 3.29Å; D1404-R1406 PolarHBondContact O-N 3.47Å; D1404-R1406 PolarHBondContact OD1-N 2.85Å; R1406-V1408 VanDerWaalsContact C-N 3.33Å; R1406-V1408 PolarHBondContact O-N 3.27Å; R1406-E1409 PolarHBondContact O-N 3.08Å
1407	S	58.9	Low	61.5	Low	59 Å²	59	93.1 Å²	93.1	41%	0.413	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-68.8	-30.6	-177.3	-59.1	0	0	0	0	113.1	L1405 K1410	L1405-S1407 VanDerWaalsContact C-N 3.25Å; L1405-S1407 PolarHBondContact O-N 2.96Å; S1407-K1410 PolarHBondContact O-N 3.1Å
1408	V	58	Low	62.4	Low	3 Å²	3	87.3 Å²	87.3	2%	0.018	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-69.8	-35.9	177.6	-177	0	0	0	0	111.3	K1391 L1394 V1395 R1406 K1410 L1411 Y1412	K1391-V1408 HydrophobicContact CG-CG2 4.45Å; L1394-V1408 HydrophobicContact CB-CG2 4.4Å; L1394-V1408 HydrophobicContact CD1-CG1 4.16Å; V1395-V1408 HydrophobicContact CG2-CG2 3.81Å; R1406-V1408 VanDerWaalsContact C-N 3.33Å; R1406-V1408 PolarHBondContact O-N 3.27Å; V1408-K1410 PolarHBondContact O-N 2.79Å; V1408-L1411 PolarHBondContact O-N 3.25Å; V1408-L1411 VanDerWaalsContact O-N 3.13Å; V1408-Y1412 PolarHBondContact O-N 2.97Å
1409	E	61.5	Low	63.3	Low	95 Å²	95	82.8 Å²	82.8	44%	0.444	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-68.2	-8.5	178.4	-73.4	138.6	-143.6	0	0	113.6	K1391 R1406 V1416	K1391-E1409 IonicContact NZ-OE1 2.81Å; K1391-E1409 PolarHBondContact NZ-OE1 3.26Å; R1406-E1409 PolarHBondContact O-N 3.08Å; E1409-V1416 HydrophobicContact CG-CG2 3.78Å
1410	K	65.9	Low	64.9	Low	182 Å²	182	84 Å²	84	79%	0.791	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-98.2	-16.2	172.1	-70.6	-174.6	175.2	-179	0	114.4	S1407 V1408	S1407-K1410 PolarHBondContact O-N 3.1Å; V1408-K1410 PolarHBondContact O-N 2.79Å
1411	L	66.9	Low	66.6	Low	82 Å²	82	84.8 Å²	84.8	43%	0.429	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-37.9	-173.5	-75.5	165.6	0	0	0	112.5	F1398 V1408 F1453	F1398-L1411 HydrophobicContact CB-CD1 4.36Å; F1398-L1411 HydrophobicContact CD1-CD1 3.78Å; F1398-L1411 HydrophobicContact CD2-CD1 3.68Å; F1398-L1411 HydrophobicContact CE1-CD1 3.93Å; F1398-L1411 HydrophobicContact CE2-CD1 3.83Å; F1398-L1411 HydrophobicContact CG-CD1 3.67Å; F1398-L1411 HydrophobicContact CZ-CD1 3.96Å; V1408-L1411 PolarHBondContact O-N 3.25Å; V1408-L1411 VanDerWaalsContact O-N 3.13Å; L1411-F1453 HydrophobicContact CB-CE2 4.26Å; L1411-F1453 HydrophobicContact CB-CZ 4.3Å
1412	Y	73	Confident	68.2	Low	11 Å²	11	78.5 Å²	78.5	4%	0.043	39%	0.391	C	S	.	.	S	Bend	trans	-90.3	127.5	168.2	-176.4	-111.4	0	0	0	109.7	V1408 G1414 L1419 E1446 Q1449 A1450 F1453	V1408-Y1412 PolarHBondContact O-N 2.97Å; Y1412-G1414 WeakPolarHBondContact CD1-O 2.9Å; Y1412-G1414 WeakPolarHBondContact CE1-O 3.18Å; Y1412-L1419 HydrophobicContact CD1-CB 4.18Å; Y1412-L1419 HydrophobicContact CD1-CD1 3.48Å; Y1412-L1419 VanDerWaalsContact CD1-CD1 3.48Å; Y1412-L1419 HydrophobicContact CD1-CG 3.83Å; Y1412-L1419 HydrophobicContact CD2-CD1 4.1Å; Y1412-L1419 HydrophobicContact CD2-CG 4.35Å; Y1412-L1419 HydrophobicContact CE1-CB 4.12Å; Y1412-L1419 HydrophobicContact CE1-CD1 4.15Å; Y1412-L1419 HydrophobicContact CE1-CG 3.97Å; Y1412-L1419 HydrophobicContact CG-CD1 3.45Å; Y1412-L1419 VanDerWaalsContact CG-CD1 3.45Å; Y1412-L1419 HydrophobicContact CG-CG 4.04Å; Y1412-E1446 PolarHBondContact OH-O 3.43Å; Y1412-E1446 VanDerWaalsContact OH-O 3.1Å; Y1412-Q1449 HydrophobicContact CE2-CB 4.34Å; Y1412-A1450 HydrophobicContact CE2-CB 4.18Å; Y1412-A1450 WeakPolarHBondContact OH-CB 3.25Å; Y1412-A1450 PolarHBondContact OH-N 2.81Å; Y1412-F1453 HydrophobicContact CD2-CB 3.84Å; Y1412-F1453 HydrophobicContact CD2-CD1 4.14Å; Y1412-F1453 AromaticContact CD2-CD2 3.95Å; Y1412-F1453 HydrophobicContact CD2-CD2 3.95Å; Y1412-F1453 AromaticContact CD2-CG 3.71Å; Y1412-F1453 HydrophobicContact CD2-CG 3.71Å; Y1412-F1453 HydrophobicContact CE2-CB 4.18Å; Y1412-F1453 HydrophobicContact CG-CG 4.44Å
1413	K	72.1	Confident	70.2	Confident	203 Å²	203	73.3 Å²	73.3	88%	0.883	36%	0.358	S	S	*	.			trans	-89.3	-2	-173.9	-71.7	-170.5	177.5	-178	0	115.2
1414	G	73.5	Confident	72.1	Confident	18 Å²	18	69.9 Å²	69.9	19%	0.186	34%	0.335	C	S	.	.	S	Bend	trans	-109	-174.4	176.1	0	0	0	0	0	113	Y1412 V1416 E1446	Y1412-G1414 WeakPolarHBondContact CD1-O 2.9Å; Y1412-G1414 WeakPolarHBondContact CE1-O 3.18Å; G1414-V1416 PolarHBondContact O-N 3.41Å; G1414-E1446 WeakPolarHBondContact CA-OE1 3.43Å
1415	D	78.7	Confident	73.5	Confident	68 Å²	68	70.7 Å²	70.7	36%	0.364	33%	0.332	S	S	.	.			trans	-63.7	123.7	178.2	-177.2	10.4	0	0	0	112.1	N1417 V1418 L1419 E1446	D1415-N1417 PolarHBondContact O-N 2.71Å; D1415-N1417 WeakPolarHBondContact OD1-CB 3.49Å; D1415-N1417 PolarHBondContact OD1-N 2.71Å; D1415-N1417 PolarHBondContact OD1-ND2 3.02Å; D1415-N1417 WeakPolarHBondContact OD2-CB 3.36Å; D1415-N1417 PolarHBondContact OD2-ND2 3.29Å; D1415-V1418 HydrophobicContact CB-CB 4.38Å; D1415-V1418 HydrophobicContact CB-CG2 4.02Å; D1415-V1418 WeakPolarHBondContact O-CB 3.27Å; D1415-V1418 PolarHBondContact O-N 2.98Å; D1415-L1419 PolarHBondContact O-N 3.36Å; D1415-L1419 VanDerWaalsContact O-N 3.07Å; D1415-E1446 PolarHBondContact N-OE1 3.14Å
1416	V	79	Confident	75.2	Confident	28 Å²	28	66 Å²	66	17%	0.17	31%	0.308	C	S	.	.	H	α-helix	trans	-64.5	-21.1	175.7	-179.4	0	0	0	0	111.7	W1387 E1409 G1414 L1419 K1420	W1387-V1416 HydrophobicContact CZ2-CG1 3.95Å; E1409-V1416 HydrophobicContact CG-CG2 3.78Å; G1414-V1416 PolarHBondContact O-N 3.41Å; V1416-L1419 WeakPolarHBondContact O-CB 3.46Å; V1416-K1420 WeakPolarHBondContact O-CB 3.33Å; V1416-K1420 PolarHBondContact O-N 3.1Å
1417	N	80.4	Confident	76.4	Confident	111 Å²	111	58.3 Å²	58.3	59%	0.594	28%	0.28	S	S	*	.	H	α-helix	trans	-73.1	-32.3	170.6	-53.7	-74.3	0	0	0	112.4	D1415 R1421	D1415-N1417 PolarHBondContact O-N 2.71Å; D1415-N1417 WeakPolarHBondContact OD1-CB 3.49Å; D1415-N1417 PolarHBondContact OD1-N 2.71Å; D1415-N1417 PolarHBondContact OD1-ND2 3.02Å; D1415-N1417 WeakPolarHBondContact OD2-CB 3.36Å; D1415-N1417 PolarHBondContact OD2-ND2 3.29Å; N1417-R1421 WeakPolarHBondContact O-CB 3.19Å; N1417-R1421 PolarHBondContact O-N 2.86Å
1418	V	82.2	Confident	77.5	Confident	6 Å²	6	62.1 Å²	62.1	4%	0.036	29%	0.291	C	S	.	.	H	α-helix	trans	-66.8	-45.4	169.4	173.1	0	0	0	0	109.8	D1415 K1420 R1421 I1422 E1447 A1450	D1415-V1418 HydrophobicContact CB-CB 4.38Å; D1415-V1418 HydrophobicContact CB-CG2 4.02Å; D1415-V1418 WeakPolarHBondContact O-CB 3.27Å; D1415-V1418 PolarHBondContact O-N 2.98Å; V1418-K1420 VanDerWaalsContact C-N 3.33Å; V1418-K1420 PolarHBondContact O-N 2.66Å; V1418-R1421 WeakPolarHBondContact O-CB 3.44Å; V1418-R1421 PolarHBondContact O-N 3.4Å; V1418-R1421 VanDerWaalsContact O-N 3.16Å; V1418-I1422 HydrophobicContact CG1-CD1 3.64Å; V1418-I1422 WeakPolarHBondContact O-CG1 3.42Å; V1418-I1422 PolarHBondContact O-N 2.76Å; V1418-E1447 HydrophobicContact CG1-CB 4.45Å; V1418-E1447 HydrophobicContact CG1-CG 3.88Å; V1418-A1450 HydrophobicContact CG1-CB 4.27Å
1419	L	83.4	Confident	78.5	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.2	-46.2	174.9	-134.9	-171.1	0	0	0	111.6	W1387 Y1412 D1415 V1416 F1423 A1450 F1453 L1454	W1387-L1419 HydrophobicContact CH2-CB 4.2Å; W1387-L1419 HydrophobicContact CH2-CD1 4.21Å; W1387-L1419 HydrophobicContact CH2-CD2 3.93Å; W1387-L1419 HydrophobicContact CH2-CG 4.34Å; W1387-L1419 HydrophobicContact CZ3-CD2 4.17Å; Y1412-L1419 HydrophobicContact CD1-CB 4.18Å; Y1412-L1419 HydrophobicContact CD1-CD1 3.48Å; Y1412-L1419 VanDerWaalsContact CD1-CD1 3.48Å; Y1412-L1419 HydrophobicContact CD1-CG 3.83Å; Y1412-L1419 HydrophobicContact CD2-CD1 4.1Å; Y1412-L1419 HydrophobicContact CD2-CG 4.35Å; Y1412-L1419 HydrophobicContact CE1-CB 4.12Å; Y1412-L1419 HydrophobicContact CE1-CD1 4.15Å; Y1412-L1419 HydrophobicContact CE1-CG 3.97Å; Y1412-L1419 HydrophobicContact CG-CD1 3.45Å; Y1412-L1419 VanDerWaalsContact CG-CD1 3.45Å; Y1412-L1419 HydrophobicContact CG-CG 4.04Å; D1415-L1419 PolarHBondContact O-N 3.36Å; D1415-L1419 VanDerWaalsContact O-N 3.07Å; V1416-L1419 WeakPolarHBondContact O-CB 3.46Å; L1419-F1423 PolarHBondContact O-N 3.13Å; L1419-F1423 VanDerWaalsContact O-N 3.13Å; L1419-A1450 HydrophobicContact CG-CB 4.36Å; L1419-F1453 HydrophobicContact CD1-CD1 3.93Å; L1419-F1453 HydrophobicContact CD1-CE1 3.95Å; L1419-F1453 HydrophobicContact CD2-CD1 4.23Å; L1419-F1453 HydrophobicContact CG-CD1 4.45Å; L1419-L1454 HydrophobicContact CD2-CD1 3.95Å; L1419-L1454 HydrophobicContact CD2-CD2 3.4Å; L1419-L1454 VanDerWaalsContact CD2-CD2 3.4Å; L1419-L1454 HydrophobicContact CD2-CG 3.47Å; L1419-L1454 VanDerWaalsContact CD2-CG 3.47Å
1420	K	83.1	Confident	79.2	Confident	67 Å²	67	61.3 Å²	61.3	29%	0.291	29%	0.292	S	S	.	.	H	α-helix	trans	-64.2	-47.3	173.4	-178.4	174.3	-169	179.4	0	111.9	D1385 W1387 V1416 V1418 I1422 F1423 T1424	D1385-K1420 WeakPolarHBondContact OD2-CE 3.19Å; D1385-K1420 IonicContact OD2-NZ 3.49Å; D1385-K1420 PolarHBondContact OD2-NZ 3.3Å; W1387-K1420 HydrophobicContact CB-CD 4.31Å; W1387-K1420 HydrophobicContact CB-CG 4.1Å; W1387-K1420 VanDerWaalsContact CD1-CD 3.45Å; W1387-K1420 HydrophobicContact CD2-CB 3.97Å; W1387-K1420 HydrophobicContact CD2-CG 3.91Å; W1387-K1420 HydrophobicContact CG-CB 4.2Å; W1387-K1420 HydrophobicContact CG-CD 3.84Å; W1387-K1420 HydrophobicContact CG-CG 3.61Å; W1387-K1420 HydrophobicContact CZ2-CB 4.29Å; V1416-K1420 WeakPolarHBondContact O-CB 3.33Å; V1416-K1420 PolarHBondContact O-N 3.1Å; V1418-K1420 VanDerWaalsContact C-N 3.33Å; V1418-K1420 PolarHBondContact O-N 2.66Å; K1420-I1422 VanDerWaalsContact C-N 3.27Å; K1420-I1422 PolarHBondContact O-N 3Å; K1420-F1423 PolarHBondContact O-N 3.49Å; K1420-T1424 VanDerWaalsContact O-CB 3.24Å; K1420-T1424 WeakPolarHBondContact O-CB 3.42Å; K1420-T1424 PolarHBondContact O-N 3.3Å; K1420-T1424 PolarHBondContact O-OG1 3.31Å
1421	R	83.7	Confident	79.6	Confident	131 Å²	131	54 Å²	54	49%	0.494	26%	0.26	S	S	.	.	H	α-helix	trans	-53.2	-48.7	-178.9	179.6	169.6	77.3	-140.3	10.7	110	N1417 V1418 W1425 E1447	N1417-R1421 WeakPolarHBondContact O-CB 3.19Å; N1417-R1421 PolarHBondContact O-N 2.86Å; V1418-R1421 WeakPolarHBondContact O-CB 3.44Å; V1418-R1421 PolarHBondContact O-N 3.4Å; V1418-R1421 VanDerWaalsContact O-N 3.16Å; R1421-W1425 WeakPolarHBondContact O-CB 3.45Å; R1421-W1425 PolarHBondContact O-N 2.81Å; R1421-E1447 IonicContact CZ-OE1 2.75Å; R1421-E1447 IonicContact NE-OE1 3.97Å; R1421-E1447 IonicContact NH2-OE1 2.68Å; R1421-E1447 PolarHBondContact NH2-OE1 2.96Å
1422	I	84.1	Confident	79.9	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-71.2	-47.1	-176.6	-65.6	163.2	0	0	0	111.7	V1418 K1420 T1424 W1425 V1426 F1441 E1447 A1450 V1451 L1454	V1418-I1422 HydrophobicContact CG1-CD1 3.64Å; V1418-I1422 WeakPolarHBondContact O-CG1 3.42Å; V1418-I1422 PolarHBondContact O-N 2.76Å; K1420-I1422 VanDerWaalsContact C-N 3.27Å; K1420-I1422 PolarHBondContact O-N 3Å; I1422-T1424 VanDerWaalsContact C-N 3.31Å; I1422-T1424 PolarHBondContact O-N 2.97Å; I1422-W1425 PolarHBondContact O-N 3.03Å; I1422-V1426 WeakPolarHBondContact O-CG2 3.33Å; I1422-V1426 PolarHBondContact O-N 3.09Å; I1422-F1441 HydrophobicContact CD1-CE2 3.94Å; I1422-F1441 HydrophobicContact CD1-CZ 4.14Å; I1422-F1441 HydrophobicContact CG1-CE2 3.83Å; I1422-F1441 HydrophobicContact CG1-CZ 3.67Å; I1422-F1441 HydrophobicContact CG2-CE2 4.08Å; I1422-F1441 HydrophobicContact CG2-CZ 4.47Å; I1422-E1447 HydrophobicContact CD1-CB 3.59Å; I1422-E1447 HydrophobicContact CD1-CG 4.05Å; I1422-A1450 HydrophobicContact CD1-CB 3.51Å; I1422-V1451 HydrophobicContact CG2-CG2 3.72Å; I1422-L1454 HydrophobicContact CB-CD1 4.26Å; I1422-L1454 HydrophobicContact CG2-CD1 3.82Å
1423	F	86	Confident	80.1	Confident	10 Å²	10	56.2 Å²	56.2	4%	0.044	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-43.9	176	-179.7	-94.1	0	0	0	111.8	P1386 W1387 A1390 L1419 K1420 V1426 D1427 L1454 L1459 L1460 A1472	P1386-F1423 HydrophobicContact CB-CE1 4.24Å; W1387-F1423 HydrophobicContact CB-CD1 4.44Å; W1387-F1423 HydrophobicContact CE3-CB 3.82Å; W1387-F1423 AromaticContact CE3-CD1 3.81Å; W1387-F1423 HydrophobicContact CE3-CD1 3.81Å; W1387-F1423 AromaticContact CE3-CG 3.92Å; W1387-F1423 HydrophobicContact CE3-CG 3.92Å; W1387-F1423 HydrophobicContact CZ3-CB 3.95Å; W1387-F1423 HydrophobicContact CZ3-CG 4.26Å; A1390-F1423 HydrophobicContact CB-CD1 4.19Å; A1390-F1423 HydrophobicContact CB-CE1 3.67Å; A1390-F1423 HydrophobicContact CB-CE2 4.04Å; A1390-F1423 HydrophobicContact CB-CZ 3.59Å; L1419-F1423 PolarHBondContact O-N 3.13Å; L1419-F1423 VanDerWaalsContact O-N 3.13Å; K1420-F1423 PolarHBondContact O-N 3.49Å; F1423-V1426 PolarHBondContact O-N 2.86Å; F1423-D1427 PolarHBondContact O-N 3.2Å; F1423-L1454 HydrophobicContact CB-CD1 3.93Å; F1423-L1454 HydrophobicContact CB-CD2 4.05Å; F1423-L1454 HydrophobicContact CD2-CD2 4.02Å; F1423-L1454 HydrophobicContact CG-CD2 4.41Å; F1423-L1459 HydrophobicContact CD2-CB 4.16Å; F1423-L1459 HydrophobicContact CE2-CB 4.02Å; F1423-L1460 HydrophobicContact CD2-CD2 4.04Å; F1423-L1460 HydrophobicContact CE2-CD2 4.29Å; F1423-A1472 HydrophobicContact CE2-CB 4.07Å; F1423-A1472 HydrophobicContact CZ-CB 4.25Å
1424	T	84.5	Confident	80.6	Confident	37 Å²	37	46.8 Å²	46.8	23%	0.227	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-41.9	179.4	-49.2	0	0	0	0	110.9	K1420 I1422 D1427 Q1428	K1420-T1424 VanDerWaalsContact O-CB 3.24Å; K1420-T1424 WeakPolarHBondContact O-CB 3.42Å; K1420-T1424 PolarHBondContact O-N 3.3Å; K1420-T1424 PolarHBondContact O-OG1 3.31Å; I1422-T1424 VanDerWaalsContact C-N 3.31Å; I1422-T1424 PolarHBondContact O-N 2.97Å; T1424-D1427 PolarHBondContact O-N 3.08Å; T1424-Q1428 WeakPolarHBondContact O-CB 3.47Å; T1424-Q1428 WeakPolarHBondContact O-CG 3.4Å; T1424-Q1428 PolarHBondContact O-N 3.22Å
1425	W	83.7	Confident	80.9	Confident	97 Å²	97	46.2 Å²	46.2	37%	0.367	22%	0.222	S	C	.	.	H	α-helix	trans	-69.9	-33.6	-179.7	-168.2	34.4	0	0	0	112.6	R1421 I1422 L1429 M1434 P1440 F1441	R1421-W1425 WeakPolarHBondContact O-CB 3.45Å; R1421-W1425 PolarHBondContact O-N 2.81Å; I1422-W1425 PolarHBondContact O-N 3.03Å; W1425-L1429 PolarHBondContact O-N 3.07Å; W1425-M1434 HydrophobicContact CD2-CE 3.51Å; W1425-M1434 HydrophobicContact CE3-CE 3.32Å; W1425-M1434 HydrophobicContact CE3-SD 4.41Å; W1425-M1434 HydrophobicContact CG-CE 4.16Å; W1425-M1434 HydrophobicContact CH2-CE 3.77Å; W1425-M1434 HydrophobicContact CH2-SD 4.48Å; W1425-M1434 HydrophobicContact CZ2-CE 4.01Å; W1425-M1434 HydrophobicContact CZ3-CE 3.45Å; W1425-M1434 VanDerWaalsContact CZ3-CE 3.45Å; W1425-M1434 HydrophobicContact CZ3-SD 4.11Å; W1425-P1440 HydrophobicContact CH2-CG 3.55Å; W1425-P1440 HydrophobicContact CZ3-CG 3.63Å; W1425-F1441 HydrophobicContact CE3-CE1 4.23Å; W1425-F1441 AromaticContact CE3-CZ 3.89Å; W1425-F1441 HydrophobicContact CE3-CZ 3.89Å; W1425-F1441 AromaticContact CZ3-CE1 3.75Å; W1425-F1441 HydrophobicContact CZ3-CE1 3.75Å; W1425-F1441 AromaticContact CZ3-CZ 3.72Å; W1425-F1441 HydrophobicContact CZ3-CZ 3.72Å
1426	V	83.6	Confident	80.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-75.9	-33.7	173.2	178.8	0	0	0	0	112.5	I1422 F1423 Q1428 L1429 M1434 L1460 L1470	I1422-V1426 WeakPolarHBondContact O-CG2 3.33Å; I1422-V1426 PolarHBondContact O-N 3.09Å; F1423-V1426 PolarHBondContact O-N 2.86Å; V1426-Q1428 VanDerWaalsContact C-N 3.34Å; V1426-L1429 PolarHBondContact O-N 3.26Å; V1426-M1434 HydrophobicContact CG2-CB 4.23Å; V1426-M1434 HydrophobicContact CG2-CE 3.8Å; V1426-M1434 HydrophobicContact CG2-SD 4.22Å; V1426-L1460 HydrophobicContact CB-CD1 4.19Å; V1426-L1460 HydrophobicContact CB-CD2 3.85Å; V1426-L1460 HydrophobicContact CG1-CD1 4.14Å; V1426-L1460 HydrophobicContact CG1-CD2 3.47Å; V1426-L1460 VanDerWaalsContact CG1-CD2 3.47Å; V1426-L1460 HydrophobicContact CG1-CG 4.41Å; V1426-L1460 HydrophobicContact CG2-CD1 4.04Å; V1426-L1470 HydrophobicContact CG1-CB 4.31Å; V1426-L1470 VanDerWaalsContact CG1-O 3.25Å; V1426-L1470 WeakPolarHBondContact CG1-O 3.5Å
1427	D	82.3	Confident	80.6	Confident	16 Å²	16	48.9 Å²	48.9	9%	0.086	24%	0.237	C	C	.	.	H	α-helix	trans	-69.7	-30.3	171.1	-170.2	69.5	0	0	0	112.5	F1423 T1424 L1429 G1430 A1472 R1475	F1423-D1427 PolarHBondContact O-N 3.2Å; T1424-D1427 PolarHBondContact O-N 3.08Å; D1427-L1429 VanDerWaalsContact C-N 3.3Å; D1427-L1429 PolarHBondContact O-N 3.2Å; D1427-G1430 WeakPolarHBondContact O-CA 3.35Å; D1427-G1430 PolarHBondContact O-N 3.16Å; D1427-A1472 HydrophobicContact CB-CB 4.09Å; D1427-R1475 WeakPolarHBondContact OD1-CG 3.33Å; D1427-R1475 IonicContact OD1-CZ 3.94Å; D1427-R1475 IonicContact OD1-NE 3.49Å; D1427-R1475 PolarHBondContact OD1-NE 3.38Å; D1427-R1475 IonicContact OD1-NH2 3.16Å; D1427-R1475 IonicContact OD2-CZ 2.72Å; D1427-R1475 IonicContact OD2-NE 2.8Å; D1427-R1475 PolarHBondContact OD2-NE 3.24Å; D1427-R1475 IonicContact OD2-NH2 3.88Å; D1427-R1475 PolarHBondContact OD2-NH2 3.32Å
1428	Q	81.4	Confident	80.2	Confident	138 Å²	138	48.8 Å²	48.8	65%	0.645	23%	0.233	S	C	*	.	H	α-helix	trans	-63.6	-31.2	172.5	-79.6	168.7	-3.7	0	0	113	T1424 V1426 G1430	T1424-Q1428 WeakPolarHBondContact O-CB 3.47Å; T1424-Q1428 WeakPolarHBondContact O-CG 3.4Å; T1424-Q1428 PolarHBondContact O-N 3.22Å; V1426-Q1428 VanDerWaalsContact C-N 3.34Å; Q1428-G1430 PolarHBondContact O-N 3.36Å
1429	L	79.7	Confident	79.5	Confident	70 Å²	70	50.1 Å²	50.1	37%	0.366	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-1.6	170	-63.3	173.5	0	0	0	113	W1425 V1426 D1427 F1431 E1432 G1433 M1434	W1425-L1429 PolarHBondContact O-N 3.07Å; V1426-L1429 PolarHBondContact O-N 3.26Å; D1427-L1429 VanDerWaalsContact C-N 3.3Å; D1427-L1429 PolarHBondContact O-N 3.2Å; L1429-F1431 PolarHBondContact O-N 2.92Å; L1429-E1432 PolarHBondContact O-N 2.92Å; L1429-G1433 PolarHBondContact O-N 3.3Å; L1429-M1434 HydrophobicContact CD1-CB 3.65Å; L1429-M1434 HydrophobicContact CD1-CE 3.77Å; L1429-M1434 HydrophobicContact CD1-CG 4.03Å
1430	G	76.1	Confident	78.5	Confident	11 Å²	11	54.3 Å²	54.3	11%	0.113	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	-119.7	170	0	0	0	0	0	112.9	D1427 Q1428 R1475	D1427-G1430 WeakPolarHBondContact O-CA 3.35Å; D1427-G1430 PolarHBondContact O-N 3.16Å; Q1428-G1430 PolarHBondContact O-N 3.36Å; G1430-R1475 WeakPolarHBondContact O-CB 3.48Å
1431	F	73.8	Confident	77.6	Confident	29 Å²	29	52.2 Å²	52.2	13%	0.127	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-17.3	-173.2	-67.9	-56.9	0	0	0	114.8	R1234 S1238 L1429 R1475 E1477 P1478 W1479	R1234-F1431 VanDerWaalsContact C-CE2 3.42Å; R1234-F1431 HydrophobicContact CB-CD1 4.35Å; R1234-F1431 HydrophobicContact CB-CD2 3.6Å; R1234-F1431 HydrophobicContact CB-CE1 4.28Å; R1234-F1431 HydrophobicContact CB-CE2 3.53Å; R1234-F1431 HydrophobicContact CB-CG 3.99Å; R1234-F1431 HydrophobicContact CB-CZ 3.87Å; R1234-F1431 HydrophobicContact CG-CD1 4.44Å; R1234-F1431 HydrophobicContact CG-CE1 4.32Å; R1234-F1431 HydrophobicContact CG-CE2 4.41Å; R1234-F1431 HydrophobicContact CG-CG 4.48Å; R1234-F1431 HydrophobicContact CG-CZ 4.29Å; R1234-F1431 WeakPolarHBondContact O-CE2 3.37Å; S1238-F1431 VanDerWaalsContact OG-CE2 3.3Å; S1238-F1431 WeakPolarHBondContact OG-CE2 3.27Å; L1429-F1431 PolarHBondContact O-N 2.92Å; F1431-R1475 HydrophobicContact CD1-CB 3.85Å; F1431-R1475 VanDerWaalsContact CD1-O 3.28Å; F1431-R1475 WeakPolarHBondContact CD1-O 3.3Å; F1431-R1475 HydrophobicContact CE1-CB 4.06Å; F1431-E1477 HydrophobicContact CE1-CB 4.11Å; F1431-P1478 HydrophobicContact CB-CG 3.6Å; F1431-P1478 VanDerWaalsContact CD1-CD 3.43Å; F1431-P1478 HydrophobicContact CD1-CG 3.24Å; F1431-P1478 HydrophobicContact CE1-CG 4.12Å; F1431-P1478 HydrophobicContact CG-CG 3.77Å; F1431-W1479 PolarHBondContact O-NE1 3.43Å
1432	E	73.4	Confident	76.1	Confident	137 Å²	137	49.4 Å²	49.4	64%	0.64	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-41.7	175.1	-72.9	-140.5	144.4	0	0	111.4	L1429 R1469	L1429-E1432 PolarHBondContact O-N 2.92Å; E1432-R1469 WeakPolarHBondContact O-CD 3.25Å; E1432-R1469 PolarHBondContact O-NH1 2.91Å; E1432-R1469 IonicContact OE2-NH1 3.76Å
1433	G	77.6	Confident	74.8	Confident	2 Å²	2	58.4 Å²	58.4	2%	0.021	30%	0.3	C	S	.	.			trans	67.8	170.4	-174.9	0	0	0	0	0	114.1	L1429 P1435 R1469 L1470	L1429-G1433 PolarHBondContact O-N 3.3Å; G1433-P1435 WeakPolarHBondContact O-CD 3.46Å; G1433-R1469 PolarHBondContact O-NH1 3.22Å; G1433-R1469 VanDerWaalsContact O-NH1 3.1Å; G1433-L1470 CarbonylContact C-O 3.48Å; G1433-L1470 WeakPolarHBondContact CA-O 3.13Å
1434	M	82.8	Confident	73.5	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.025	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	118.8	-179.3	-161.7	171.2	-74.9	0	0	110	W1425 V1426 L1429 I1439 R1469 L1470	W1425-M1434 HydrophobicContact CD2-CE 3.51Å; W1425-M1434 HydrophobicContact CE3-CE 3.32Å; W1425-M1434 HydrophobicContact CE3-SD 4.41Å; W1425-M1434 HydrophobicContact CG-CE 4.16Å; W1425-M1434 HydrophobicContact CH2-CE 3.77Å; W1425-M1434 HydrophobicContact CH2-SD 4.48Å; W1425-M1434 HydrophobicContact CZ2-CE 4.01Å; W1425-M1434 HydrophobicContact CZ3-CE 3.45Å; W1425-M1434 VanDerWaalsContact CZ3-CE 3.45Å; W1425-M1434 HydrophobicContact CZ3-SD 4.11Å; V1426-M1434 HydrophobicContact CG2-CB 4.23Å; V1426-M1434 HydrophobicContact CG2-CE 3.8Å; V1426-M1434 HydrophobicContact CG2-SD 4.22Å; L1429-M1434 HydrophobicContact CD1-CB 3.65Å; L1429-M1434 HydrophobicContact CD1-CE 3.77Å; L1429-M1434 HydrophobicContact CD1-CG 4.03Å; M1434-I1439 HydrophobicContact CG-CG1 3.92Å; M1434-I1439 HydrophobicContact SD-CB 4.3Å; M1434-I1439 HydrophobicContact SD-CG1 3.81Å; M1434-I1439 HydrophobicContact SD-CG2 4.35Å; M1434-R1469 CarbonylContact O-C 3.16Å; M1434-R1469 WeakPolarHBondContact O-CA 3.5Å; M1434-L1470 PolarHBondContact N-O 3.45Å; M1434-L1470 PolarHBondContact O-N 2.96Å
1435	P	80.1	Confident	72.7	Confident	7 Å²	7	62.5 Å²	62.5	5%	0.045	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	136.9	171	-21.7	35.2	0	0	0	110.1	G1433 D1437 E1438 I1439 K1467 E1468 R1469	G1433-P1435 WeakPolarHBondContact O-CD 3.46Å; P1435-D1437 PolarHBondContact O-N 3.47Å; P1435-D1437 VanDerWaalsContact O-N 3.17Å; P1435-E1438 HydrophobicContact CB-CB 4.02Å; P1435-E1438 HydrophobicContact CB-CG 4.17Å; P1435-E1438 HydrophobicContact CG-CB 4.19Å; P1435-E1438 HydrophobicContact CG-CG 4.34Å; P1435-E1438 WeakPolarHBondContact CG-OE2 3.21Å; P1435-E1438 PolarHBondContact O-N 3.42Å; P1435-I1439 WeakPolarHBondContact O-CG1 3.5Å; P1435-I1439 PolarHBondContact O-N 2.89Å; P1435-K1467 HydrophobicContact CB-CD 4.28Å; P1435-E1468 WeakPolarHBondContact CA-O 3.38Å; P1435-R1469 HydrophobicContact CB-CG 4.15Å; P1435-R1469 HydrophobicContact CG-CG 4.08Å
1436	T	76.3	Confident	72.4	Confident	48 Å²	48	62 Å²	62	29%	0.294	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-59.7	-33.4	-174.9	-38.7	0	0	0	0	111.9	E1438 I1439 E1468	T1436-E1438 VanDerWaalsContact C-N 3.35Å; T1436-I1439 HydrophobicContact CG2-CD1 3.96Å; T1436-I1439 WeakPolarHBondContact O-CG1 3.33Å; T1436-E1468 PolarHBondContact N-O 3.02Å; T1436-E1468 WeakPolarHBondContact OG1-CB 3.42Å; T1436-E1468 WeakPolarHBondContact OG1-CG 3.41Å; T1436-E1468 PolarHBondContact OG1-O 3.46Å
1437	D	73.4	Confident	72.1	Confident	103 Å²	103	63.8 Å²	63.8	55%	0.551	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-86.3	6.6	176.6	45.8	-64.5	0	0	0	114.8	P1435 K1467	P1435-D1437 PolarHBondContact O-N 3.47Å; P1435-D1437 VanDerWaalsContact O-N 3.17Å; D1437-K1467 VanDerWaalsContact OD2-CD 3.25Å; D1437-K1467 WeakPolarHBondContact OD2-CD 3.45Å; D1437-K1467 WeakPolarHBondContact OD2-CE 3.23Å; D1437-K1467 IonicContact OD2-NZ 3.51Å; D1437-K1467 PolarHBondContact OD2-NZ 3.49Å
1438	E	73.8	Confident	71.8	Confident	110 Å²	110	65.6 Å²	65.6	51%	0.514	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-119.1	8.3	169.5	-70.7	161.1	-134.2	0	0	112	P1435 T1436 P1440 K1467	P1435-E1438 HydrophobicContact CB-CB 4.02Å; P1435-E1438 HydrophobicContact CB-CG 4.17Å; P1435-E1438 HydrophobicContact CG-CB 4.19Å; P1435-E1438 HydrophobicContact CG-CG 4.34Å; P1435-E1438 WeakPolarHBondContact CG-OE2 3.21Å; P1435-E1438 PolarHBondContact O-N 3.42Å; T1436-E1438 VanDerWaalsContact C-N 3.35Å; E1438-P1440 WeakPolarHBondContact O-CD 3.45Å; E1438-K1467 IonicContact OE1-NZ 3.52Å; E1438-K1467 PolarHBondContact OE1-NZ 3.01Å
1439	I	67.6	Low	71.8	Confident	34 Å²	34	64.9 Å²	64.9	17%	0.174	35%	0.352	C	S	.	.			trans	-69.3	118.4	168.8	-57.4	177.3	0	0	0	107.8	M1434 P1435 T1436 F1441 L1470	M1434-I1439 HydrophobicContact CG-CG1 3.92Å; M1434-I1439 HydrophobicContact SD-CB 4.3Å; M1434-I1439 HydrophobicContact SD-CG1 3.81Å; M1434-I1439 HydrophobicContact SD-CG2 4.35Å; P1435-I1439 WeakPolarHBondContact O-CG1 3.5Å; P1435-I1439 PolarHBondContact O-N 2.89Å; T1436-I1439 HydrophobicContact CG2-CD1 3.96Å; T1436-I1439 WeakPolarHBondContact O-CG1 3.33Å; I1439-F1441 HydrophobicContact CG2-CB 3.75Å; I1439-F1441 HydrophobicContact CG2-CD1 4.29Å; I1439-F1441 HydrophobicContact CG2-CD2 3.08Å; I1439-F1441 HydrophobicContact CG2-CE2 3.59Å; I1439-F1441 HydrophobicContact CG2-CG 3.46Å; I1439-F1441 VanDerWaalsContact CG2-CG 3.46Å; I1439-F1441 HydrophobicContact CG2-CZ 4.35Å; I1439-F1441 PolarHBondContact O-N 3.33Å; I1439-L1470 HydrophobicContact CD1-CD1 3.7Å
1440	P	61	Low	72	Confident	88 Å²	88	61.5 Å²	61.5	57%	0.571	33%	0.334	S	S	*	.			trans	-81.1	7.7	-175.8	37.8	-40.8	0	0	0	113.3	W1425 E1438 S1442	W1425-P1440 HydrophobicContact CH2-CG 3.55Å; W1425-P1440 HydrophobicContact CZ3-CG 3.63Å; E1438-P1440 WeakPolarHBondContact O-CD 3.45Å; P1440-S1442 PolarHBondContact O-N 2.92Å
1441	F	64	Low	72.3	Confident	23 Å²	23	61.7 Å²	61.7	10%	0.101	33%	0.333	C	S	.	.			trans	-81.2	115.1	-175.6	-51.6	-26.1	0	0	0	108.3	I1422 W1425 I1439 E1447 V1451	I1422-F1441 HydrophobicContact CD1-CE2 3.94Å; I1422-F1441 HydrophobicContact CD1-CZ 4.14Å; I1422-F1441 HydrophobicContact CG1-CE2 3.83Å; I1422-F1441 HydrophobicContact CG1-CZ 3.67Å; I1422-F1441 HydrophobicContact CG2-CE2 4.08Å; I1422-F1441 HydrophobicContact CG2-CZ 4.47Å; W1425-F1441 HydrophobicContact CE3-CE1 4.23Å; W1425-F1441 AromaticContact CE3-CZ 3.89Å; W1425-F1441 HydrophobicContact CE3-CZ 3.89Å; W1425-F1441 AromaticContact CZ3-CE1 3.75Å; W1425-F1441 HydrophobicContact CZ3-CE1 3.75Å; W1425-F1441 AromaticContact CZ3-CZ 3.72Å; W1425-F1441 HydrophobicContact CZ3-CZ 3.72Å; I1439-F1441 HydrophobicContact CG2-CB 3.75Å; I1439-F1441 HydrophobicContact CG2-CD1 4.29Å; I1439-F1441 HydrophobicContact CG2-CD2 3.08Å; I1439-F1441 HydrophobicContact CG2-CE2 3.59Å; I1439-F1441 HydrophobicContact CG2-CG 3.46Å; I1439-F1441 VanDerWaalsContact CG2-CG 3.46Å; I1439-F1441 HydrophobicContact CG2-CZ 4.35Å; I1439-F1441 PolarHBondContact O-N 3.33Å; F1441-E1447 HydrophobicContact CB-CB 3.85Å; F1441-E1447 HydrophobicContact CD1-CB 3.68Å; F1441-E1447 HydrophobicContact CD1-CG 4.05Å; F1441-E1447 WeakPolarHBondContact CD1-OE1 3.29Å; F1441-E1447 WeakPolarHBondContact CD1-OE2 3.49Å; F1441-E1447 HydrophobicContact CD2-CB 3.56Å; F1441-E1447 HydrophobicContact CE1-CB 4.15Å; F1441-E1447 HydrophobicContact CE1-CG 4.36Å; F1441-E1447 VanDerWaalsContact CE1-OE1 3.26Å; F1441-E1447 WeakPolarHBondContact CE1-OE1 3.44Å; F1441-E1447 HydrophobicContact CE2-CB 4.06Å; F1441-E1447 HydrophobicContact CG-CB 3.39Å; F1441-E1447 HydrophobicContact CG-CG 4.27Å; F1441-E1447 HydrophobicContact CZ-CB 4.35Å; F1441-V1451 HydrophobicContact CD2-CG2 3.92Å; F1441-V1451 HydrophobicContact CE2-CG2 3.77Å
1442	S	54	Low	72.7	Confident	72 Å²	72	64.8 Å²	64.8	50%	0.503	35%	0.348	S	S	.	.			trans	-57.1	145.5	170.4	56.5	0	0	0	0	109.9	P1440 S1444 S1445	P1440-S1442 PolarHBondContact O-N 2.92Å; S1442-S1444 PolarHBondContact O-N 3.12Å; S1442-S1445 VanDerWaalsContact O-CB 3.32Å; S1442-S1445 WeakPolarHBondContact O-CB 3.19Å; S1442-S1445 PolarHBondContact O-N 2.98Å; S1442-S1445 PolarHBondContact O-OG 3.34Å
1443	E	55.6	Low	73.3	Confident	190 Å²	190	59.4 Å²	59.4	89%	0.888	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.1	-173.1	-62.1	-169.3	128	0	0	113.6
1444	S	59	Low	73.6	Confident	114 Å²	114	59.3 Å²	59.3	80%	0.797	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-4.6	177.6	54.4	0	0	0	0	115.4	S1442	S1442-S1444 PolarHBondContact O-N 3.12Å
1445	S	67.5	Low	73.6	Confident	19 Å²	19	60.5 Å²	60.5	13%	0.133	33%	0.329	C	S	.	.	S	Bend	trans	-79.6	150.5	-174.4	64.7	0	0	0	0	113.8	S1442 E1447 S1448	S1442-S1445 VanDerWaalsContact O-CB 3.32Å; S1442-S1445 WeakPolarHBondContact O-CB 3.19Å; S1442-S1445 PolarHBondContact O-N 2.98Å; S1442-S1445 PolarHBondContact O-OG 3.34Å; S1445-E1447 PolarHBondContact O-N 3.03Å; S1445-E1447 VanDerWaalsContact O-N 3.13Å; S1445-S1448 VanDerWaalsContact O-CB 3.31Å; S1445-S1448 WeakPolarHBondContact O-CB 3.41Å; S1445-S1448 PolarHBondContact O-N 3.14Å
1446	E	78.5	Confident	73.8	Confident	85 Å²	85	66.4 Å²	66.4	40%	0.397	36%	0.356	S	S	.	.	H	α-helix	trans	-53.9	-28.1	169.2	-173.7	177.6	-152	0	0	112.3	Y1412 G1414 D1415 S1448 Q1449 A1450	Y1412-E1446 PolarHBondContact OH-O 3.43Å; Y1412-E1446 VanDerWaalsContact OH-O 3.1Å; G1414-E1446 WeakPolarHBondContact CA-OE1 3.43Å; D1415-E1446 PolarHBondContact N-OE1 3.14Å; E1446-S1448 VanDerWaalsContact C-N 3.33Å; E1446-S1448 PolarHBondContact O-N 3Å; E1446-Q1449 PolarHBondContact O-N 3.25Å; E1446-A1450 PolarHBondContact O-N 3.25Å
1447	E	76.8	Confident	73.9	Confident	39 Å²	39	65 Å²	65	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-34.7	178.3	-54.1	-177.2	109.2	0	0	112.4	V1418 R1421 I1422 F1441 S1445 Q1449 A1450 V1451	V1418-E1447 HydrophobicContact CG1-CB 4.45Å; V1418-E1447 HydrophobicContact CG1-CG 3.88Å; R1421-E1447 IonicContact CZ-OE1 2.75Å; R1421-E1447 IonicContact NE-OE1 3.97Å; R1421-E1447 IonicContact NH2-OE1 2.68Å; R1421-E1447 PolarHBondContact NH2-OE1 2.96Å; I1422-E1447 HydrophobicContact CD1-CB 3.59Å; I1422-E1447 HydrophobicContact CD1-CG 4.05Å; F1441-E1447 HydrophobicContact CB-CB 3.85Å; F1441-E1447 HydrophobicContact CD1-CB 3.68Å; F1441-E1447 HydrophobicContact CD1-CG 4.05Å; F1441-E1447 WeakPolarHBondContact CD1-OE1 3.29Å; F1441-E1447 WeakPolarHBondContact CD1-OE2 3.49Å; F1441-E1447 HydrophobicContact CD2-CB 3.56Å; F1441-E1447 HydrophobicContact CE1-CB 4.15Å; F1441-E1447 HydrophobicContact CE1-CG 4.36Å; F1441-E1447 VanDerWaalsContact CE1-OE1 3.26Å; F1441-E1447 WeakPolarHBondContact CE1-OE1 3.44Å; F1441-E1447 HydrophobicContact CE2-CB 4.06Å; F1441-E1447 HydrophobicContact CG-CB 3.39Å; F1441-E1447 HydrophobicContact CG-CG 4.27Å; F1441-E1447 HydrophobicContact CZ-CB 4.35Å; S1445-E1447 PolarHBondContact O-N 3.03Å; S1445-E1447 VanDerWaalsContact O-N 3.13Å; E1447-Q1449 VanDerWaalsContact C-N 3.34Å; E1447-Q1449 PolarHBondContact O-N 3.16Å; E1447-A1450 PolarHBondContact O-N 2.76Å; E1447-V1451 WeakPolarHBondContact O-CG2 3.43Å; E1447-V1451 PolarHBondContact O-N 2.91Å
1448	S	76.6	Confident	74	Confident	53 Å²	53	63 Å²	63	37%	0.371	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-39.8	173.4	-171.5	0	0	0	0	111.7	S1445 E1446 V1451 H1452	S1445-S1448 VanDerWaalsContact O-CB 3.31Å; S1445-S1448 WeakPolarHBondContact O-CB 3.41Å; S1445-S1448 PolarHBondContact O-N 3.14Å; E1446-S1448 VanDerWaalsContact C-N 3.33Å; E1446-S1448 PolarHBondContact O-N 3Å; S1448-V1451 PolarHBondContact O-N 3.23Å; S1448-H1452 PolarHBondContact O-N 3.15Å
1449	Q	81	Confident	74.5	Confident	123 Å²	123	58.1 Å²	58.1	58%	0.575	31%	0.313	S	S	*	.	H	α-helix	trans	-68.6	-40.7	175.7	-60.4	-171.6	13.3	0	0	111.8	Y1412 E1446 E1447 H1452 F1453	Y1412-Q1449 HydrophobicContact CE2-CB 4.34Å; E1446-Q1449 PolarHBondContact O-N 3.25Å; E1447-Q1449 VanDerWaalsContact C-N 3.34Å; E1447-Q1449 PolarHBondContact O-N 3.16Å; Q1449-H1452 PolarHBondContact O-N 3.12Å; Q1449-F1453 WeakPolarHBondContact O-CB 3.44Å; Q1449-F1453 PolarHBondContact O-N 2.82Å
1450	A	83.1	Confident	75.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-42.4	173.1	0	0	0	0	0	112.2	Y1412 V1418 L1419 I1422 E1446 E1447 H1452 F1453 L1454	Y1412-A1450 HydrophobicContact CE2-CB 4.18Å; Y1412-A1450 WeakPolarHBondContact OH-CB 3.25Å; Y1412-A1450 PolarHBondContact OH-N 2.81Å; V1418-A1450 HydrophobicContact CG1-CB 4.27Å; L1419-A1450 HydrophobicContact CG-CB 4.36Å; I1422-A1450 HydrophobicContact CD1-CB 3.51Å; E1446-A1450 PolarHBondContact O-N 3.25Å; E1447-A1450 PolarHBondContact O-N 2.76Å; A1450-H1452 PolarHBondContact O-N 2.96Å; A1450-F1453 PolarHBondContact O-N 3.37Å; A1450-L1454 WeakPolarHBondContact O-CB 3.32Å; A1450-L1454 VanDerWaalsContact O-CG 3.24Å; A1450-L1454 WeakPolarHBondContact O-CG 3.13Å; A1450-L1454 PolarHBondContact O-N 3.09Å
1451	V	81.7	Confident	76.3	Confident	14 Å²	14	53.3 Å²	53.3	9%	0.085	28%	0.284	C	S	.	.	H	α-helix	trans	-59.1	-45.7	173.6	166.1	0	0	0	0	111.1	I1422 F1441 E1447 S1448 L1454 V1455 L1470	I1422-V1451 HydrophobicContact CG2-CG2 3.72Å; F1441-V1451 HydrophobicContact CD2-CG2 3.92Å; F1441-V1451 HydrophobicContact CE2-CG2 3.77Å; E1447-V1451 WeakPolarHBondContact O-CG2 3.43Å; E1447-V1451 PolarHBondContact O-N 2.91Å; S1448-V1451 PolarHBondContact O-N 3.23Å; V1451-L1454 PolarHBondContact O-N 2.97Å; V1451-V1455 WeakPolarHBondContact O-CG2 3.42Å; V1451-V1455 PolarHBondContact O-N 3.19Å; V1451-V1455 VanDerWaalsContact O-N 3.13Å; V1451-L1470 HydrophobicContact CG1-CD1 3.55Å; V1451-L1470 HydrophobicContact CG2-CD1 4.5Å
1452	H	83.2	Confident	77.2	Confident	95 Å²	95	56.1 Å²	56.1	44%	0.44	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-49.1	178.7	-155.9	-79.5	0	0	0	111.7	S1448 Q1449 A1450 L1454 V1455 E1456	S1448-H1452 PolarHBondContact O-N 3.15Å; Q1449-H1452 PolarHBondContact O-N 3.12Å; A1450-H1452 PolarHBondContact O-N 2.96Å; H1452-L1454 VanDerWaalsContact C-N 3.33Å; H1452-L1454 PolarHBondContact O-N 3.21Å; H1452-V1455 PolarHBondContact O-N 3.3Å; H1452-E1456 IonicContact CE1-OE2 2.79Å; H1452-E1456 PolarHBondContact CE1-OE2 2.67Å; H1452-E1456 IonicContact CG-OE2 3.58Å; H1452-E1456 IonicContact ND1-OE2 2.69Å; H1452-E1456 PolarHBondContact ND1-OE2 2.66Å; H1452-E1456 PolarHBondContact O-N 2.65Å
1453	F	85.2	Confident	78.4	Confident	23 Å²	23	52.8 Å²	52.8	10%	0.101	27%	0.27	C	S	.	.	H	α-helix	trans	-59.7	-40.4	178.3	-176	-89.4	0	0	0	112.5	L1394 L1411 Y1412 L1419 Q1449 A1450 V1455 N1457	L1394-F1453 HydrophobicContact CD2-CE1 4.14Å; L1394-F1453 HydrophobicContact CD2-CZ 4.41Å; L1411-F1453 HydrophobicContact CB-CE2 4.26Å; L1411-F1453 HydrophobicContact CB-CZ 4.3Å; Y1412-F1453 HydrophobicContact CD2-CB 3.84Å; Y1412-F1453 HydrophobicContact CD2-CD1 4.14Å; Y1412-F1453 AromaticContact CD2-CD2 3.95Å; Y1412-F1453 HydrophobicContact CD2-CD2 3.95Å; Y1412-F1453 AromaticContact CD2-CG 3.71Å; Y1412-F1453 HydrophobicContact CD2-CG 3.71Å; Y1412-F1453 HydrophobicContact CE2-CB 4.18Å; Y1412-F1453 HydrophobicContact CG-CG 4.44Å; L1419-F1453 HydrophobicContact CD1-CD1 3.93Å; L1419-F1453 HydrophobicContact CD1-CE1 3.95Å; L1419-F1453 HydrophobicContact CD2-CD1 4.23Å; L1419-F1453 HydrophobicContact CG-CD1 4.45Å; Q1449-F1453 WeakPolarHBondContact O-CB 3.44Å; Q1449-F1453 PolarHBondContact O-N 2.82Å; A1450-F1453 PolarHBondContact O-N 3.37Å; F1453-V1455 VanDerWaalsContact C-N 3.3Å; F1453-V1455 PolarHBondContact O-N 3.22Å; F1453-N1457 WeakPolarHBondContact O-CB 3.36Å; F1453-N1457 PolarHBondContact O-N 3.18Å; F1453-N1457 VanDerWaalsContact O-N 3.16Å; F1453-N1457 PolarHBondContact O-ND2 3.46Å
1454	L	84.9	Confident	79.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-32.1	175.8	-76.7	173	0	0	0	113.1	W1387 L1419 I1422 F1423 A1450 V1451 H1452 L1459 L1460	W1387-L1454 HydrophobicContact CZ3-CD2 4.39Å; L1419-L1454 HydrophobicContact CD2-CD1 3.95Å; L1419-L1454 HydrophobicContact CD2-CD2 3.4Å; L1419-L1454 VanDerWaalsContact CD2-CD2 3.4Å; L1419-L1454 HydrophobicContact CD2-CG 3.47Å; L1419-L1454 VanDerWaalsContact CD2-CG 3.47Å; I1422-L1454 HydrophobicContact CB-CD1 4.26Å; I1422-L1454 HydrophobicContact CG2-CD1 3.82Å; F1423-L1454 HydrophobicContact CB-CD1 3.93Å; F1423-L1454 HydrophobicContact CB-CD2 4.05Å; F1423-L1454 HydrophobicContact CD2-CD2 4.02Å; F1423-L1454 HydrophobicContact CG-CD2 4.41Å; A1450-L1454 WeakPolarHBondContact O-CB 3.32Å; A1450-L1454 VanDerWaalsContact O-CG 3.24Å; A1450-L1454 WeakPolarHBondContact O-CG 3.13Å; A1450-L1454 PolarHBondContact O-N 3.09Å; V1451-L1454 PolarHBondContact O-N 2.97Å; H1452-L1454 VanDerWaalsContact C-N 3.33Å; H1452-L1454 PolarHBondContact O-N 3.21Å; L1454-L1459 HydrophobicContact CD2-CB 3.93Å; L1454-L1459 HydrophobicContact CD2-CD1 3.71Å; L1454-L1459 HydrophobicContact CD2-CG 4.47Å; L1454-L1459 PolarHBondContact O-N 3.35Å; L1454-L1460 HydrophobicContact CB-CB 4.25Å; L1454-L1460 HydrophobicContact CB-CD1 3.9Å; L1454-L1460 HydrophobicContact CB-CG 3.85Å; L1454-L1460 HydrophobicContact CD1-CD1 3.76Å; L1454-L1460 HydrophobicContact CD1-CG 4.18Å; L1454-L1460 HydrophobicContact CG-CD1 4.46Å; L1454-L1460 PolarHBondContact O-N 3.16Å
1455	V	83.5	Confident	79.9	Confident	30 Å²	30	41.4 Å²	41.4	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-78.1	-43.9	176.9	173.7	0	0	0	0	111.7	V1451 H1452 F1453 N1457 D1458 L1460 R1462 L1470	V1451-V1455 WeakPolarHBondContact O-CG2 3.42Å; V1451-V1455 PolarHBondContact O-N 3.19Å; V1451-V1455 VanDerWaalsContact O-N 3.13Å; H1452-V1455 PolarHBondContact O-N 3.3Å; F1453-V1455 VanDerWaalsContact C-N 3.3Å; F1453-V1455 PolarHBondContact O-N 3.22Å; V1455-N1457 PolarHBondContact O-N 2.86Å; V1455-D1458 PolarHBondContact O-N 2.8Å; V1455-L1460 WeakPolarHBondContact CA-O 3.48Å; V1455-L1460 HydrophobicContact CG2-CB 3.98Å; V1455-R1462 HydrophobicContact CG1-CG 4.36Å; V1455-L1470 HydrophobicContact CG2-CD2 3.74Å
1456	E	82.7	Confident	80.1	Confident	132 Å²	132	44.7 Å²	44.7	62%	0.617	23%	0.231	S	C	*	.	H	α-helix	trans	-58.5	-33.2	175.2	-83	177.3	102.7	0	0	112.8	H1452 D1458	H1452-E1456 IonicContact CE1-OE2 2.79Å; H1452-E1456 PolarHBondContact CE1-OE2 2.67Å; H1452-E1456 IonicContact CG-OE2 3.58Å; H1452-E1456 IonicContact ND1-OE2 2.69Å; H1452-E1456 PolarHBondContact ND1-OE2 2.66Å; H1452-E1456 PolarHBondContact O-N 2.65Å; E1456-D1458 VanDerWaalsContact C-N 3.28Å; E1456-D1458 PolarHBondContact O-N 3.11Å
1457	N	79.7	Confident	79.9	Confident	18 Å²	18	44.5 Å²	44.5	10%	0.096	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	7.4	178.1	-74.4	-82.8	0	0	0	114.2	L1394 R1397 F1398 F1453 V1455 L1459	L1394-N1457 HydrophobicContact CD2-CB 3.86Å; L1394-N1457 WeakPolarHBondContact CD2-OD1 3.31Å; R1397-N1457 PolarHBondContact NH1-O 3.21Å; F1398-N1457 WeakPolarHBondContact CE2-OD1 3.48Å; F1398-N1457 VanDerWaalsContact CZ-OD1 3.27Å; F1398-N1457 WeakPolarHBondContact CZ-OD1 3.49Å; F1453-N1457 WeakPolarHBondContact O-CB 3.36Å; F1453-N1457 PolarHBondContact O-N 3.18Å; F1453-N1457 VanDerWaalsContact O-N 3.16Å; F1453-N1457 PolarHBondContact O-ND2 3.46Å; V1455-N1457 PolarHBondContact O-N 2.86Å; N1457-L1459 HydrophobicContact CB-CG 4.45Å; N1457-L1459 PolarHBondContact O-N 3.47Å
1458	D	75.7	Confident	80	Confident	62 Å²	62	44.8 Å²	44.8	33%	0.332	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	34.4	-171.2	-60.3	-63.7	0	0	0	113.7	R1397 V1455 E1456 R1473	R1397-D1458 IonicContact CZ-OD2 2.74Å; R1397-D1458 IonicContact NH1-OD2 3.79Å; R1397-D1458 PolarHBondContact NH1-OD2 3.01Å; R1397-D1458 IonicContact NH2-OD2 3.41Å; R1397-D1458 PolarHBondContact NH2-OD2 2.52Å; V1455-D1458 PolarHBondContact O-N 2.8Å; E1456-D1458 VanDerWaalsContact C-N 3.28Å; E1456-D1458 PolarHBondContact O-N 3.11Å; D1458-R1473 WeakPolarHBondContact O-CB 3.43Å; D1458-R1473 WeakPolarHBondContact O-CD 3.28Å; D1458-R1473 PolarHBondContact O-NH1 3.45Å; D1458-R1473 IonicContact OD2-NH1 3.11Å
1459	L	82.7	Confident	80.3	Confident	7 Å²	7	45 Å²	45	4%	0.037	22%	0.223	C	C	.	.	S	Bend	trans	-85.5	-39.5	170	-72.7	-172.3	0	0	0	110.9	A1390 L1394 F1423 L1454 N1457 A1472 R1473	A1390-L1459 HydrophobicContact CB-CD1 3.98Å; A1390-L1459 HydrophobicContact CB-CD2 3.86Å; L1394-L1459 HydrophobicContact CD1-CD1 3.5Å; L1394-L1459 HydrophobicContact CG-CD1 3.71Å; L1394-L1459 HydrophobicContact CG-CG 4.4Å; F1423-L1459 HydrophobicContact CD2-CB 4.16Å; F1423-L1459 HydrophobicContact CE2-CB 4.02Å; L1454-L1459 HydrophobicContact CD2-CB 3.93Å; L1454-L1459 HydrophobicContact CD2-CD1 3.71Å; L1454-L1459 HydrophobicContact CD2-CG 4.47Å; L1454-L1459 PolarHBondContact O-N 3.35Å; N1457-L1459 HydrophobicContact CB-CG 4.45Å; N1457-L1459 PolarHBondContact O-N 3.47Å; L1459-A1472 CarbonylContact O-C 3.54Å; L1459-A1472 WeakPolarHBondContact O-CA 3.5Å; L1459-R1473 PolarHBondContact O-N 3.18Å
1460	L	85.1	Confident	80.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	147.9	162.7	-61.7	-175.4	0	0	0	109	F1423 V1426 L1454 V1455 V1471 A1472	F1423-L1460 HydrophobicContact CD2-CD2 4.04Å; F1423-L1460 HydrophobicContact CE2-CD2 4.29Å; V1426-L1460 HydrophobicContact CB-CD1 4.19Å; V1426-L1460 HydrophobicContact CB-CD2 3.85Å; V1426-L1460 HydrophobicContact CG1-CD1 4.14Å; V1426-L1460 HydrophobicContact CG1-CD2 3.47Å; V1426-L1460 VanDerWaalsContact CG1-CD2 3.47Å; V1426-L1460 HydrophobicContact CG1-CG 4.41Å; V1426-L1460 HydrophobicContact CG2-CD1 4.04Å; L1454-L1460 HydrophobicContact CB-CB 4.25Å; L1454-L1460 HydrophobicContact CB-CD1 3.9Å; L1454-L1460 HydrophobicContact CB-CG 3.85Å; L1454-L1460 HydrophobicContact CD1-CD1 3.76Å; L1454-L1460 HydrophobicContact CD1-CG 4.18Å; L1454-L1460 HydrophobicContact CG-CD1 4.46Å; L1454-L1460 PolarHBondContact O-N 3.16Å; V1455-L1460 WeakPolarHBondContact CA-O 3.48Å; V1455-L1460 HydrophobicContact CG2-CB 3.98Å; L1460-V1471 CarbonylContact C-O 3.55Å; L1460-V1471 WeakPolarHBondContact CA-O 3.35Å; L1460-A1472 HydrophobicContact CD2-CB 3.93Å
1461	V	82	Confident	80.5	Confident	21 Å²	21	39.2 Å²	39.2	13%	0.127	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.1	178.2	180	0	0	0	0	110.1	V1463 V1471 L1476 L1534	V1461-V1463 HydrophobicContact CG1-CG1 4.29Å; V1461-V1471 PolarHBondContact N-O 2.91Å; V1461-V1471 PolarHBondContact O-N 3.03Å; V1461-L1476 HydrophobicContact CB-CD1 3.58Å; V1461-L1476 HydrophobicContact CG1-CD1 4.08Å; V1461-L1476 HydrophobicContact CG2-CD1 3.47Å; V1461-L1476 VanDerWaalsContact CG2-CD1 3.47Å; V1461-L1534 HydrophobicContact CG1-CD1 3.8Å
1462	R	82.2	Confident	80.6	Confident	82 Å²	82	38.6 Å²	38.6	31%	0.309	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	120.6	178.3	-69	165.5	174.4	-101.3	4.2	110.4	V1455 E1468 R1469 L1470	V1455-R1462 HydrophobicContact CG1-CG 4.36Å; R1462-E1468 HydrophobicContact CB-CG 4.45Å; R1462-E1468 WeakPolarHBondContact CB-OE1 3.37Å; R1462-E1468 WeakPolarHBondContact CD-OE1 2.94Å; R1462-E1468 WeakPolarHBondContact CG-OE1 3.35Å; R1462-E1468 IonicContact CZ-OE1 3.52Å; R1462-E1468 IonicContact NE-OE1 2.64Å; R1462-E1468 IonicContact NH1-OE1 2.63Å; R1462-E1468 PolarHBondContact NH1-OE1 3.44Å; R1462-E1468 IonicContact NH1-OE2 3.53Å; R1462-E1468 PolarHBondContact NH1-OE2 3.26Å; R1462-R1469 WeakPolarHBondContact CA-O 3.42Å; R1462-L1470 HydrophobicContact CG-CD2 3.75Å
1463	V	79.4	Confident	80.3	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	159.7	-175.7	-65.1	0	0	0	0	110.5	V1461 E1468 R1469 V1471 L1476 W1479	V1461-V1463 HydrophobicContact CG1-CG1 4.29Å; V1463-E1468 CarbonylContact O-C 3.56Å; V1463-R1469 HydrophobicContact CG2-CB 4.36Å; V1463-R1469 WeakPolarHBondContact CG2-O 3.47Å; V1463-R1469 PolarHBondContact N-O 3.03Å; V1463-R1469 PolarHBondContact O-N 2.71Å; V1463-V1471 HydrophobicContact CG2-CB 3.91Å; V1463-V1471 HydrophobicContact CG2-CG2 3.49Å; V1463-V1471 VanDerWaalsContact CG2-CG2 3.49Å; V1463-L1476 HydrophobicContact CG1-CD2 4.35Å; V1463-W1479 HydrophobicContact CB-CB 4.2Å; V1463-W1479 HydrophobicContact CB-CD2 3.67Å; V1463-W1479 HydrophobicContact CB-CE3 3.9Å; V1463-W1479 HydrophobicContact CB-CG 3.83Å; V1463-W1479 HydrophobicContact CB-CZ3 4.44Å; V1463-W1479 HydrophobicContact CG1-CB 3.73Å; V1463-W1479 HydrophobicContact CG1-CD2 4.21Å; V1463-W1479 HydrophobicContact CG1-CG 3.8Å; V1463-W1479 HydrophobicContact CG2-CD2 3.72Å; V1463-W1479 HydrophobicContact CG2-CE3 4.27Å; V1463-W1479 HydrophobicContact CG2-CG 3.97Å; V1463-W1479 HydrophobicContact CG2-CH2 4.43Å; V1463-W1479 HydrophobicContact CG2-CZ2 3.92Å
1464	G	73.8	Confident	79.7	Confident	9 Å²	9	42.4 Å²	42.4	9%	0.093	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160	176.6	178	0	0	0	0	0	115	K1467 C1583	G1464-K1467 WeakPolarHBondContact CA-O 3.44Å; G1464-C1583 VanDerWaalsContact C-SG 3.55Å
1465	I	72.1	Confident	79.2	Confident	55 Å²	55	45.1 Å²	45.1	28%	0.282	23%	0.234	S	C	.	.	S	Bend	trans	-125.2	-64.5	174.9	-54.7	177.4	0	0	0	108.7	W1479 E1494 T1581 S1582 C1583	I1465-W1479 HydrophobicContact CG1-CZ3 4.49Å; I1465-E1494 WeakPolarHBondContact CD1-OE2 3.38Å; I1465-T1581 HydrophobicContact CG2-CG2 3.91Å; I1465-T1581 WeakPolarHBondContact O-CB 3.12Å; I1465-S1582 PolarHBondContact O-N 3.5Å; I1465-C1583 PolarHBondContact O-N 2.88Å
1466	S	71.8	Confident	78.7	Confident	88 Å²	88	44.1 Å²	44.1	62%	0.615	23%	0.227	S	C	*	.	S	Bend	trans	-97	-63.9	176.8	47.1	0	0	0	0	111.6	S1582	S1466-S1582 WeakPolarHBondContact O-CB 3.3Å
1467	K	74.2	Confident	77.7	Confident	82 Å²	82	40.4 Å²	40.4	36%	0.357	21%	0.21	S	C	.	.	S	Bend	trans	-85.4	147.2	167	-67.2	-168.5	176.2	-158.6	0	110.7	P1435 D1437 E1438 G1464 C1583	P1435-K1467 HydrophobicContact CB-CD 4.28Å; D1437-K1467 VanDerWaalsContact OD2-CD 3.25Å; D1437-K1467 WeakPolarHBondContact OD2-CD 3.45Å; D1437-K1467 WeakPolarHBondContact OD2-CE 3.23Å; D1437-K1467 IonicContact OD2-NZ 3.51Å; D1437-K1467 PolarHBondContact OD2-NZ 3.49Å; E1438-K1467 IonicContact OE1-NZ 3.52Å; E1438-K1467 PolarHBondContact OE1-NZ 3.01Å; G1464-K1467 WeakPolarHBondContact CA-O 3.44Å; K1467-C1583 PolarHBondContact O-SG 2.79Å
1468	E	79.3	Confident	76.9	Confident	45 Å²	45	39.8 Å²	39.8	21%	0.21	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	145.1	167.4	-174	-176.5	-168.4	0	0	109.3	P1435 T1436 R1462 V1463	P1435-E1468 WeakPolarHBondContact CA-O 3.38Å; T1436-E1468 PolarHBondContact N-O 3.02Å; T1436-E1468 WeakPolarHBondContact OG1-CB 3.42Å; T1436-E1468 WeakPolarHBondContact OG1-CG 3.41Å; T1436-E1468 PolarHBondContact OG1-O 3.46Å; R1462-E1468 HydrophobicContact CB-CG 4.45Å; R1462-E1468 WeakPolarHBondContact CB-OE1 3.37Å; R1462-E1468 WeakPolarHBondContact CD-OE1 2.94Å; R1462-E1468 WeakPolarHBondContact CG-OE1 3.35Å; R1462-E1468 IonicContact CZ-OE1 3.52Å; R1462-E1468 IonicContact NE-OE1 2.64Å; R1462-E1468 IonicContact NH1-OE1 2.63Å; R1462-E1468 PolarHBondContact NH1-OE1 3.44Å; R1462-E1468 IonicContact NH1-OE2 3.53Å; R1462-E1468 PolarHBondContact NH1-OE2 3.26Å; V1463-E1468 CarbonylContact O-C 3.56Å
1469	R	82.7	Confident	76.6	Confident	57 Å²	57	38.2 Å²	38.2	22%	0.215	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	144.1	-176.3	-80.5	160.6	170.2	-95.6	-0.6	110.2	E1432 G1433 M1434 P1435 R1462 V1463	E1432-R1469 WeakPolarHBondContact O-CD 3.25Å; E1432-R1469 PolarHBondContact O-NH1 2.91Å; E1432-R1469 IonicContact OE2-NH1 3.76Å; G1433-R1469 PolarHBondContact O-NH1 3.22Å; G1433-R1469 VanDerWaalsContact O-NH1 3.1Å; M1434-R1469 CarbonylContact O-C 3.16Å; M1434-R1469 WeakPolarHBondContact O-CA 3.5Å; P1435-R1469 HydrophobicContact CB-CG 4.15Å; P1435-R1469 HydrophobicContact CG-CG 4.08Å; R1462-R1469 WeakPolarHBondContact CA-O 3.42Å; V1463-R1469 HydrophobicContact CG2-CB 4.36Å; V1463-R1469 WeakPolarHBondContact CG2-O 3.47Å; V1463-R1469 PolarHBondContact N-O 3.03Å; V1463-R1469 PolarHBondContact O-N 2.71Å
1470	L	85	Confident	75.7	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	124	171.6	-63.7	174.5	0	0	0	109.7	V1426 G1433 M1434 I1439 V1451 V1455 R1462	V1426-L1470 HydrophobicContact CG1-CB 4.31Å; V1426-L1470 VanDerWaalsContact CG1-O 3.25Å; V1426-L1470 WeakPolarHBondContact CG1-O 3.5Å; G1433-L1470 CarbonylContact C-O 3.48Å; G1433-L1470 WeakPolarHBondContact CA-O 3.13Å; M1434-L1470 PolarHBondContact N-O 3.45Å; M1434-L1470 PolarHBondContact O-N 2.96Å; I1439-L1470 HydrophobicContact CD1-CD1 3.7Å; V1451-L1470 HydrophobicContact CG1-CD1 3.55Å; V1451-L1470 HydrophobicContact CG2-CD1 4.5Å; V1455-L1470 HydrophobicContact CG2-CD2 3.74Å; R1462-L1470 HydrophobicContact CG-CD2 3.75Å
1471	V	84.5	Confident	74	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.3	-179.7	171.7	0	0	0	0	109.9	L1460 V1461 V1463 R1475	L1460-V1471 CarbonylContact C-O 3.55Å; L1460-V1471 WeakPolarHBondContact CA-O 3.35Å; V1461-V1471 PolarHBondContact N-O 2.91Å; V1461-V1471 PolarHBondContact O-N 3.03Å; V1463-V1471 HydrophobicContact CG2-CB 3.91Å; V1463-V1471 HydrophobicContact CG2-CG2 3.49Å; V1463-V1471 VanDerWaalsContact CG2-CG2 3.49Å; V1471-R1475 HydrophobicContact CG1-CB 3.96Å; V1471-R1475 WeakPolarHBondContact CG1-O 3.5Å
1472	A	83.8	Confident	72.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	146.7	179	0	0	0	0	0	112.4	F1423 D1427 L1459 L1460 G1474 R1475 L1476	F1423-A1472 HydrophobicContact CE2-CB 4.07Å; F1423-A1472 HydrophobicContact CZ-CB 4.25Å; D1427-A1472 HydrophobicContact CB-CB 4.09Å; L1459-A1472 CarbonylContact O-C 3.54Å; L1459-A1472 WeakPolarHBondContact O-CA 3.5Å; L1460-A1472 HydrophobicContact CD2-CB 3.93Å; A1472-G1474 PolarHBondContact O-N 2.98Å; A1472-G1474 VanDerWaalsContact O-N 3.15Å; A1472-R1475 HydrophobicContact CB-CG 4.32Å; A1472-R1475 CarbonylContact O-C 3.59Å; A1472-R1475 WeakPolarHBondContact O-CA 2.92Å; A1472-R1475 PolarHBondContact O-N 3.14Å; A1472-L1476 PolarHBondContact O-N 3.19Å
1473	R	77	Confident	70.2	Confident	130 Å²	130	35 Å²	35	49%	0.491	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-57.4	-32.5	-176.6	-159.8	-163.4	-176.7	107.3	-2.1	113.8	D1458 L1459 R1475 L1476	D1458-R1473 WeakPolarHBondContact O-CB 3.43Å; D1458-R1473 WeakPolarHBondContact O-CD 3.28Å; D1458-R1473 PolarHBondContact O-NH1 3.45Å; D1458-R1473 IonicContact OD2-NH1 3.11Å; L1459-R1473 PolarHBondContact O-N 3.18Å; R1473-R1475 VanDerWaalsContact C-N 3.27Å; R1473-R1475 PolarHBondContact O-N 2.93Å; R1473-L1476 HydrophobicContact CG-CD1 4.48Å; R1473-L1476 WeakPolarHBondContact O-CB 3.28Å
1474	G	71.2	Confident	67.9	Low	68 Å²	68	39.8 Å²	39.8	70%	0.701	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-70.8	-20.7	173.7	0	0	0	0	0	114	A1472	A1472-G1474 PolarHBondContact O-N 2.98Å; A1472-G1474 VanDerWaalsContact O-N 3.15Å
1475	R	74	Confident	65.9	Low	58 Å²	58	43.2 Å²	43.2	22%	0.219	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-107	25.9	179.4	-47.3	-61.9	178.8	161.4	8	111.8	D1427 G1430 F1431 V1471 A1472 R1473 P1478	D1427-R1475 WeakPolarHBondContact OD1-CG 3.33Å; D1427-R1475 IonicContact OD1-CZ 3.94Å; D1427-R1475 IonicContact OD1-NE 3.49Å; D1427-R1475 PolarHBondContact OD1-NE 3.38Å; D1427-R1475 IonicContact OD1-NH2 3.16Å; D1427-R1475 IonicContact OD2-CZ 2.72Å; D1427-R1475 IonicContact OD2-NE 2.8Å; D1427-R1475 PolarHBondContact OD2-NE 3.24Å; D1427-R1475 IonicContact OD2-NH2 3.88Å; D1427-R1475 PolarHBondContact OD2-NH2 3.32Å; G1430-R1475 WeakPolarHBondContact O-CB 3.48Å; F1431-R1475 HydrophobicContact CD1-CB 3.85Å; F1431-R1475 VanDerWaalsContact CD1-O 3.28Å; F1431-R1475 WeakPolarHBondContact CD1-O 3.3Å; F1431-R1475 HydrophobicContact CE1-CB 4.06Å; V1471-R1475 HydrophobicContact CG1-CB 3.96Å; V1471-R1475 WeakPolarHBondContact CG1-O 3.5Å; A1472-R1475 HydrophobicContact CB-CG 4.32Å; A1472-R1475 CarbonylContact O-C 3.59Å; A1472-R1475 WeakPolarHBondContact O-CA 2.92Å; A1472-R1475 PolarHBondContact O-N 3.14Å; R1473-R1475 VanDerWaalsContact C-N 3.27Å; R1473-R1475 PolarHBondContact O-N 2.93Å; R1475-P1478 WeakPolarHBondContact O-CD 3.44Å
1476	L	74.2	Confident	63.9	Low	8 Å²	8	42.3 Å²	42.3	4%	0.042	24%	0.243	C	C	.	.			trans	-90.5	-3.9	-176.8	-123.9	163.8	0	0	0	113.2	V1461 V1463 A1472 R1473 P1478 W1479 I1480 L1534	V1461-L1476 HydrophobicContact CB-CD1 3.58Å; V1461-L1476 HydrophobicContact CG1-CD1 4.08Å; V1461-L1476 HydrophobicContact CG2-CD1 3.47Å; V1461-L1476 VanDerWaalsContact CG2-CD1 3.47Å; V1463-L1476 HydrophobicContact CG1-CD2 4.35Å; A1472-L1476 PolarHBondContact O-N 3.19Å; R1473-L1476 HydrophobicContact CG-CD1 4.48Å; R1473-L1476 WeakPolarHBondContact O-CB 3.28Å; L1476-P1478 WeakPolarHBondContact O-CD 3.13Å; L1476-W1479 HydrophobicContact CD2-CB 3.85Å; L1476-W1479 PolarHBondContact O-N 3.14Å; L1476-I1480 HydrophobicContact CB-CD1 3.88Å; L1476-I1480 HydrophobicContact CB-CG1 4.05Å; L1476-I1480 HydrophobicContact CD2-CB 4.27Å; L1476-I1480 HydrophobicContact CD2-CD1 4.35Å; L1476-I1480 HydrophobicContact CD2-CG1 3.8Å; L1476-I1480 HydrophobicContact CD2-CG2 3.73Å; L1476-I1480 WeakPolarHBondContact O-CG1 3.45Å; L1476-I1480 PolarHBondContact O-N 2.97Å; L1476-L1534 HydrophobicContact CD2-CD1 4.19Å
1477	E	61.1	Low	61.9	Low	54 Å²	54	42.4 Å²	42.4	25%	0.252	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	4	165.1	-149.1	-164.6	-148.7	0	0	116.4	R1234 T1237 F1431 T1493	R1234-E1477 PolarHBondContact NE-O 3.46Å; T1237-E1477 PolarHBondContact OG1-OE2 2.66Å; F1431-E1477 HydrophobicContact CE1-CB 4.11Å; E1477-T1493 VanDerWaalsContact C-CG2 3.46Å; E1477-T1493 WeakPolarHBondContact O-CG2 3.37Å
1478	P	63.6	Low	60	Low	5 Å²	5	42.3 Å²	42.3	3%	0.032	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-16.6	159.2	-3.8	21.1	0	0	0	116.8	R1234 F1431 R1475 L1476 T1493 E1494	R1234-P1478 HydrophobicContact CG-CG 4.44Å; R1234-P1478 VanDerWaalsContact NE-CA 3.29Å; R1234-P1478 PolarHBondContact NH2-O 2.58Å; R1234-P1478 VanDerWaalsContact NH2-O 3.13Å; F1431-P1478 HydrophobicContact CB-CG 3.6Å; F1431-P1478 VanDerWaalsContact CD1-CD 3.43Å; F1431-P1478 HydrophobicContact CD1-CG 3.24Å; F1431-P1478 HydrophobicContact CE1-CG 4.12Å; F1431-P1478 HydrophobicContact CG-CG 3.77Å; R1475-P1478 WeakPolarHBondContact O-CD 3.44Å; L1476-P1478 WeakPolarHBondContact O-CD 3.13Å; P1478-T1493 VanDerWaalsContact C-CB 3.5Å; P1478-T1493 WeakPolarHBondContact O-CB 3.4Å; P1478-E1494 WeakPolarHBondContact O-CB 3.18Å; P1478-E1494 WeakPolarHBondContact O-CG 3.39Å; P1478-E1494 PolarHBondContact O-N 2.79Å
1479	W	68.2	Low	58.1	Low	29 Å²	29	44.8 Å²	44.8	11%	0.11	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139.2	13	-161.1	-35.7	90.1	0	0	0	116	F1431 V1463 I1465 L1476 E1494 Q1495	F1431-W1479 PolarHBondContact O-NE1 3.43Å; V1463-W1479 HydrophobicContact CB-CB 4.2Å; V1463-W1479 HydrophobicContact CB-CD2 3.67Å; V1463-W1479 HydrophobicContact CB-CE3 3.9Å; V1463-W1479 HydrophobicContact CB-CG 3.83Å; V1463-W1479 HydrophobicContact CB-CZ3 4.44Å; V1463-W1479 HydrophobicContact CG1-CB 3.73Å; V1463-W1479 HydrophobicContact CG1-CD2 4.21Å; V1463-W1479 HydrophobicContact CG1-CG 3.8Å; V1463-W1479 HydrophobicContact CG2-CD2 3.72Å; V1463-W1479 HydrophobicContact CG2-CE3 4.27Å; V1463-W1479 HydrophobicContact CG2-CG 3.97Å; V1463-W1479 HydrophobicContact CG2-CH2 4.43Å; V1463-W1479 HydrophobicContact CG2-CZ2 3.92Å; I1465-W1479 HydrophobicContact CG1-CZ3 4.49Å; L1476-W1479 HydrophobicContact CD2-CB 3.85Å; L1476-W1479 PolarHBondContact O-N 3.14Å; W1479-E1494 HydrophobicContact CE3-CG 4.11Å; W1479-E1494 HydrophobicContact CZ3-CG 4.49Å; W1479-Q1495 PolarHBondContact O-NE2 3.02Å; W1479-Q1495 PolarHBondContact O-OE1 3.04Å
1480	I	63.6	Low	56.2	Low	30 Å²	30	45 Å²	45	15%	0.154	26%	0.255	C	S	.	.			trans	-138.7	161	175.9	37.8	160	0	0	0	114.5	L1476 A1491 T1493 V1532 V1533 L1534	L1476-I1480 HydrophobicContact CB-CD1 3.88Å; L1476-I1480 HydrophobicContact CB-CG1 4.05Å; L1476-I1480 HydrophobicContact CD2-CB 4.27Å; L1476-I1480 HydrophobicContact CD2-CD1 4.35Å; L1476-I1480 HydrophobicContact CD2-CG1 3.8Å; L1476-I1480 HydrophobicContact CD2-CG2 3.73Å; L1476-I1480 WeakPolarHBondContact O-CG1 3.45Å; L1476-I1480 PolarHBondContact O-N 2.97Å; I1480-A1491 VanDerWaalsContact O-O 3.12Å; I1480-T1493 WeakPolarHBondContact CA-OG1 3.37Å; I1480-T1493 PolarHBondContact N-OG1 2.8Å; I1480-T1493 WeakPolarHBondContact O-CB 3.44Å; I1480-T1493 WeakPolarHBondContact O-CG2 3.29Å; I1480-T1493 PolarHBondContact O-OG1 3.16Å; I1480-V1532 HydrophobicContact CB-CB 3.93Å; I1480-V1532 HydrophobicContact CB-CG1 4.09Å; I1480-V1532 HydrophobicContact CD1-CB 3.64Å; I1480-V1532 HydrophobicContact CD1-CG1 3.83Å; I1480-V1532 HydrophobicContact CD1-CG2 3.93Å; I1480-V1532 HydrophobicContact CG1-CB 4.18Å; I1480-V1532 HydrophobicContact CG1-CG1 4.13Å; I1480-V1533 CarbonylContact C-O 3.58Å; I1480-V1533 VanDerWaalsContact CA-O 3.31Å; I1480-V1533 WeakPolarHBondContact CA-O 3.49Å; I1480-L1534 HydrophobicContact CG2-CB 3.72Å; I1480-L1534 HydrophobicContact CG2-CD1 3.78Å; I1480-L1534 HydrophobicContact CG2-CG 3.66Å
1481	L	51.1	Low	54.2	Low	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	155.4	-158.7	-64	-174.8	0	0	0	120.8	A1483 A1491 T1493 Q1495 V1496 V1532 V1533 P1535 L1541	L1481-A1483 PolarHBondContact O-N 3.39Å; L1481-A1491 CarbonylContact C-O 3.56Å; L1481-A1491 VanDerWaalsContact CA-O 3.24Å; L1481-A1491 WeakPolarHBondContact CA-O 3.28Å; L1481-T1493 WeakPolarHBondContact CD2-OG1 3.19Å; L1481-Q1495 HydrophobicContact CD1-CB 4.02Å; L1481-Q1495 HydrophobicContact CD2-CB 3.82Å; L1481-Q1495 HydrophobicContact CG-CB 3.82Å; L1481-V1496 HydrophobicContact CB-CG2 4.19Å; L1481-V1496 HydrophobicContact CD1-CB 4Å; L1481-V1496 HydrophobicContact CD1-CG2 3.6Å; L1481-V1496 HydrophobicContact CD2-CB 3.61Å; L1481-V1496 HydrophobicContact CD2-CG2 3.79Å; L1481-V1496 HydrophobicContact CG-CB 4.31Å; L1481-V1496 HydrophobicContact CG-CG2 4.05Å; L1481-V1532 CarbonylContact O-C 3.55Å; L1481-V1532 WeakPolarHBondContact O-CA 3.28Å; L1481-V1533 HydrophobicContact CB-CB 4.25Å; L1481-V1533 VanDerWaalsContact CB-O 3.27Å; L1481-V1533 WeakPolarHBondContact CB-O 3.42Å; L1481-V1533 VanDerWaalsContact CG-O 3.31Å; L1481-V1533 WeakPolarHBondContact CG-O 3.32Å; L1481-V1533 PolarHBondContact N-O 2.92Å; L1481-V1533 PolarHBondContact O-N 3.02Å; L1481-P1535 HydrophobicContact CD1-CG 3.21Å; L1481-P1535 HydrophobicContact CG-CG 4.12Å; L1481-L1541 HydrophobicContact CD1-CD2 4.11Å
1482	P	42.2	Very low	52.3	Low	1 Å²	1	47.1 Å²	47.1	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	114.8	165.1	11.8	8.8	0	0	0	107.1	T1486 F1487 A1491 I1492	P1482-T1486 VanDerWaalsContact CA-OG1 3.23Å; P1482-T1486 WeakPolarHBondContact CA-OG1 3.4Å; P1482-T1486 WeakPolarHBondContact CB-O 3.25Å; P1482-F1487 HydrophobicContact CB-CD1 4.19Å; P1482-F1487 HydrophobicContact CG-CD1 4.05Å; P1482-F1487 HydrophobicContact CG-CE1 4.35Å; P1482-A1491 HydrophobicContact CB-CB 3.6Å; P1482-A1491 VanDerWaalsContact CD-C 3.49Å; P1482-A1491 WeakPolarHBondContact CD-O 3.5Å; P1482-A1491 HydrophobicContact CG-CB 3.64Å; P1482-A1491 VanDerWaalsContact N-O 3.16Å; P1482-I1492 HydrophobicContact CG-CG1 3.91Å
1483	A	40.7	Very low	50.6	Low	11 Å²	11	47.2 Å²	47.2	9%	0.091	27%	0.269	C	S	.	.			trans	-50.5	148.8	155.6	0	0	0	0	0	108.1	L1481 G1485 T1486 F1531 V1533 L1541	L1481-A1483 PolarHBondContact O-N 3.39Å; A1483-G1485 PolarHBondContact O-N 3.13Å; A1483-T1486 PolarHBondContact N-OG1 3.05Å; A1483-T1486 WeakPolarHBondContact O-CA 3.27Å; A1483-T1486 PolarHBondContact O-N 3.12Å; A1483-T1486 PolarHBondContact O-OG1 2.76Å; A1483-F1531 HydrophobicContact CB-CB 4.14Å; A1483-F1531 PolarHBondContact N-O 2.87Å; A1483-V1533 HydrophobicContact CB-CG2 4Å; A1483-L1541 VanDerWaalsContact CA-O 3.32Å; A1483-L1541 WeakPolarHBondContact CA-O 3.5Å
1484	I	31.7	Very low	49.2	Very low	103 Å²	103	41.5 Å²	41.5	53%	0.528	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.6	-170.7	-81.8	173.4	0	0	0	114.1	F1487 L1541	I1484-F1487 HydrophobicContact CB-CE2 4.23Å; I1484-F1487 HydrophobicContact CG1-CE2 3.88Å; I1484-F1487 HydrophobicContact CG1-CZ 4.26Å; I1484-F1487 HydrophobicContact CG2-CE2 4.34Å; I1484-F1487 VanDerWaalsContact O-CD2 3.28Å; I1484-F1487 WeakPolarHBondContact O-CD2 3.4Å; I1484-L1541 HydrophobicContact CD1-CB 3.73Å; I1484-L1541 HydrophobicContact CD1-CD1 3.76Å; I1484-L1541 HydrophobicContact CD1-CG 4.4Å; I1484-L1541 HydrophobicContact CG1-CB 3.9Å; I1484-L1541 HydrophobicContact CG1-CD1 4.27Å; I1484-L1541 PolarHBondContact N-O 3.15Å
1485	G	31.9	Very low	48.1	Very low	81 Å²	81	38.5 Å²	38.5	84%	0.835	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-13.3	172.3	0	0	0	0	0	115.9	A1483	A1483-G1485 PolarHBondContact O-N 3.13Å
1486	T	30.7	Very low	46.7	Very low	37 Å²	37	36 Å²	36	23%	0.227	21%	0.208	C	C	.	.			trans	-120.4	25	-164.7	64	0	0	0	0	113.6	P1482 A1483 N1488	P1482-T1486 VanDerWaalsContact CA-OG1 3.23Å; P1482-T1486 WeakPolarHBondContact CA-OG1 3.4Å; P1482-T1486 WeakPolarHBondContact CB-O 3.25Å; A1483-T1486 PolarHBondContact N-OG1 3.05Å; A1483-T1486 WeakPolarHBondContact O-CA 3.27Å; A1483-T1486 PolarHBondContact O-N 3.12Å; A1483-T1486 PolarHBondContact O-OG1 2.76Å; T1486-N1488 PolarHBondContact O-N 3.32Å
1487	F	30.3	Very low	45.3	Very low	89 Å²	89	35.7 Å²	35.7	39%	0.39	21%	0.206	S	C	.	.			trans	-62.7	71.7	-179.6	-85.5	-62.9	0	0	0	114.3	Q1206 P1482 I1484	Q1206-F1487 PolarHBondContact NE2-O 2.67Å; P1482-F1487 HydrophobicContact CB-CD1 4.19Å; P1482-F1487 HydrophobicContact CG-CD1 4.05Å; P1482-F1487 HydrophobicContact CG-CE1 4.35Å; I1484-F1487 HydrophobicContact CB-CE2 4.23Å; I1484-F1487 HydrophobicContact CG1-CE2 3.88Å; I1484-F1487 HydrophobicContact CG1-CZ 4.26Å; I1484-F1487 HydrophobicContact CG2-CE2 4.34Å; I1484-F1487 VanDerWaalsContact O-CD2 3.28Å; I1484-F1487 WeakPolarHBondContact O-CD2 3.4Å
1488	N	33.9	Very low	44.7	Very low	80 Å²	80	35 Å²	35	43%	0.428	20%	0.203	S	C	.	.			trans	-84.4	149.6	151	-177	12.2	0	0	0	108	R1263 T1486 D1490	R1263-N1488 PolarHBondContact NH2-OD1 3.46Å; T1486-N1488 PolarHBondContact O-N 3.32Å; N1488-D1490 VanDerWaalsContact C-N 3.25Å; N1488-D1490 VanDerWaalsContact CG-OD2 3.3Å; N1488-D1490 PolarHBondContact ND2-OD2 2.63Å; N1488-D1490 PolarHBondContact O-N 3.35Å; N1488-D1490 PolarHBondContact OD1-OD2 2.82Å
1489	L	37.8	Very low	43.8	Very low	98 Å²	98	35.9 Å²	35.9	51%	0.513	21%	0.211	S	C	.	.	S	Bend	trans	-70.1	-21.9	179.7	-91.5	158.3	0	0	0	112.8	R1263 I1492	R1263-L1489 VanDerWaalsContact NH2-CB 3.3Å; L1489-I1492 HydrophobicContact CD2-CD1 3.91Å
1490	D	43.5	Very low	42.3	Very low	61 Å²	61	39.6 Å²	39.6	33%	0.326	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-36.1	179	-54.5	-36.7	0	0	0	111.9	R1263 N1488 I1492	R1263-D1490 VanDerWaalsContact CZ-CG 3.41Å; R1263-D1490 IonicContact CZ-OD1 2.69Å; R1263-D1490 IonicContact CZ-OD2 2.67Å; R1263-D1490 IonicContact NE-OD1 2.81Å; R1263-D1490 PolarHBondContact NE-OD1 2.85Å; R1263-D1490 IonicContact NH1-OD1 3.68Å; R1263-D1490 PolarHBondContact NH1-OD1 3.43Å; R1263-D1490 VanDerWaalsContact NH1-OD1 3.11Å; R1263-D1490 IonicContact NH1-OD2 3.19Å; R1263-D1490 PolarHBondContact NH1-OD2 3.49Å; R1263-D1490 VanDerWaalsContact NH2-N 3.18Å; R1263-D1490 IonicContact NH2-OD1 3.7Å; R1263-D1490 PolarHBondContact NH2-OD1 3.01Å; R1263-D1490 IonicContact NH2-OD2 2.92Å; R1263-D1490 PolarHBondContact NH2-OD2 2.63Å; N1488-D1490 VanDerWaalsContact C-N 3.25Å; N1488-D1490 VanDerWaalsContact CG-OD2 3.3Å; N1488-D1490 PolarHBondContact ND2-OD2 2.63Å; N1488-D1490 PolarHBondContact O-N 3.35Å; N1488-D1490 PolarHBondContact OD1-OD2 2.82Å; D1490-I1492 PolarHBondContact O-N 3.18Å
1491	A	44.2	Very low	41.2	Very low	20 Å²	20	39.6 Å²	39.6	17%	0.165	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-10.8	-176	0	0	0	0	0	113.3	I1480 L1481 P1482 V1532	I1480-A1491 VanDerWaalsContact O-O 3.12Å; L1481-A1491 CarbonylContact C-O 3.56Å; L1481-A1491 VanDerWaalsContact CA-O 3.24Å; L1481-A1491 WeakPolarHBondContact CA-O 3.28Å; P1482-A1491 HydrophobicContact CB-CB 3.6Å; P1482-A1491 VanDerWaalsContact CD-C 3.49Å; P1482-A1491 WeakPolarHBondContact CD-O 3.5Å; P1482-A1491 HydrophobicContact CG-CB 3.64Å; P1482-A1491 VanDerWaalsContact N-O 3.16Å; A1491-V1532 HydrophobicContact CB-CG1 4.35Å
1492	I	43.8	Very low	40.5	Very low	27 Å²	27	44.6 Å²	44.6	14%	0.138	25%	0.25	C	C	.	.			trans	-72.3	131.2	-178.8	-51.6	-176.9	0	0	0	110.2	L1226 L1230 P1482 L1489 D1490 V1496	L1226-I1492 HydrophobicContact CD2-CG2 4.33Å; L1230-I1492 HydrophobicContact CD1-CB 4.37Å; L1230-I1492 HydrophobicContact CD1-CG2 3.88Å; L1230-I1492 WeakPolarHBondContact CD1-O 3.43Å; L1230-I1492 HydrophobicContact CD2-CB 4.32Å; L1230-I1492 WeakPolarHBondContact CD2-O 3.48Å; P1482-I1492 HydrophobicContact CG-CG1 3.91Å; L1489-I1492 HydrophobicContact CD2-CD1 3.91Å; D1490-I1492 PolarHBondContact O-N 3.18Å; I1492-V1496 HydrophobicContact CG2-CB 4.25Å; I1492-V1496 HydrophobicContact CG2-CG1 4.01Å
1493	T	48.7	Very low	39.9	Very low	1 Å²	1	50 Å²	50	1%	0.006	28%	0.279	C	S	.	.			trans	-137.1	-173.4	172.3	70	0	0	0	0	113.8	E1477 P1478 I1480 L1481 Q1495 V1496 I1497	E1477-T1493 VanDerWaalsContact C-CG2 3.46Å; E1477-T1493 WeakPolarHBondContact O-CG2 3.37Å; P1478-T1493 VanDerWaalsContact C-CB 3.5Å; P1478-T1493 WeakPolarHBondContact O-CB 3.4Å; I1480-T1493 WeakPolarHBondContact CA-OG1 3.37Å; I1480-T1493 PolarHBondContact N-OG1 2.8Å; I1480-T1493 WeakPolarHBondContact O-CB 3.44Å; I1480-T1493 WeakPolarHBondContact O-CG2 3.29Å; I1480-T1493 PolarHBondContact O-OG1 3.16Å; L1481-T1493 WeakPolarHBondContact CD2-OG1 3.19Å; T1493-Q1495 PolarHBondContact O-N 2.92Å; T1493-V1496 PolarHBondContact O-N 3.38Å; T1493-I1497 WeakPolarHBondContact O-CD1 3.12Å; T1493-I1497 VanDerWaalsContact O-CG1 3.29Å; T1493-I1497 WeakPolarHBondContact O-CG1 3.05Å
1494	E	46.3	Very low	39.3	Very low	11 Å²	11	55.4 Å²	55.4	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-27.3	-37	167.1	-109.1	-75.7	92.1	0	0	114.4	R1227 I1465 P1478 W1479 I1497 N1498	R1227-E1494 VanDerWaalsContact CD-OE1 3.26Å; R1227-E1494 WeakPolarHBondContact CD-OE1 3.19Å; R1227-E1494 VanDerWaalsContact CG-OE1 3.22Å; R1227-E1494 WeakPolarHBondContact CG-OE1 3.44Å; R1227-E1494 IonicContact CZ-OE1 3.52Å; R1227-E1494 IonicContact NE-OE1 3.65Å; R1227-E1494 PolarHBondContact NE-OE1 2.85Å; R1227-E1494 IonicContact NH2-OE1 3.41Å; R1227-E1494 PolarHBondContact NH2-OE1 3.15Å; R1227-E1494 IonicContact NH2-OE2 2.7Å; I1465-E1494 WeakPolarHBondContact CD1-OE2 3.38Å; P1478-E1494 WeakPolarHBondContact O-CB 3.18Å; P1478-E1494 WeakPolarHBondContact O-CG 3.39Å; P1478-E1494 PolarHBondContact O-N 2.79Å; W1479-E1494 HydrophobicContact CE3-CG 4.11Å; W1479-E1494 HydrophobicContact CZ3-CG 4.49Å; E1494-I1497 VanDerWaalsContact O-CB 3.3Å; E1494-I1497 WeakPolarHBondContact O-CB 3.31Å; E1494-N1498 PolarHBondContact O-N 3.25Å; E1494-N1498 PolarHBondContact O-ND2 3.49Å; E1494-N1498 VanDerWaalsContact O-ND2 3.09Å; E1494-N1498 PolarHBondContact O-OD1 3.32Å; E1494-N1498 PolarHBondContact OE2-ND2 3.01Å
1495	Q	47.8	Very low	39.2	Very low	4 Å²	4	54.9 Å²	54.9	2%	0.019	32%	0.317	C	S	.	.	H	α-helix	trans	-100.9	-21.1	-156.9	-88.6	175.6	34.3	0	0	113.6	W1479 L1481 T1493 N1498 A1499 P1535 R1536	W1479-Q1495 PolarHBondContact O-NE2 3.02Å; W1479-Q1495 PolarHBondContact O-OE1 3.04Å; L1481-Q1495 HydrophobicContact CD1-CB 4.02Å; L1481-Q1495 HydrophobicContact CD2-CB 3.82Å; L1481-Q1495 HydrophobicContact CG-CB 3.82Å; T1493-Q1495 PolarHBondContact O-N 2.92Å; Q1495-N1498 CarbonylContact O-C 3.54Å; Q1495-N1498 PolarHBondContact O-N 3.21Å; Q1495-A1499 WeakPolarHBondContact O-CB 3.42Å; Q1495-A1499 PolarHBondContact O-N 2.69Å; Q1495-P1535 HydrophobicContact CB-CG 3.68Å; Q1495-P1535 HydrophobicContact CG-CG 4.37Å; Q1495-R1536 VanDerWaalsContact NE2-NH1 3.15Å
1496	V	46	Very low	39.2	Very low	7 Å²	7	56.3 Å²	56.3	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-73.3	-35.7	164.6	138.4	0	0	0	0	105.3	L1481 I1492 T1493 A1499 L1500 L1541	L1481-V1496 HydrophobicContact CB-CG2 4.19Å; L1481-V1496 HydrophobicContact CD1-CB 4Å; L1481-V1496 HydrophobicContact CD1-CG2 3.6Å; L1481-V1496 HydrophobicContact CD2-CB 3.61Å; L1481-V1496 HydrophobicContact CD2-CG2 3.79Å; L1481-V1496 HydrophobicContact CG-CB 4.31Å; L1481-V1496 HydrophobicContact CG-CG2 4.05Å; I1492-V1496 HydrophobicContact CG2-CB 4.25Å; I1492-V1496 HydrophobicContact CG2-CG1 4.01Å; T1493-V1496 PolarHBondContact O-N 3.38Å; V1496-A1499 PolarHBondContact O-N 2.79Å; V1496-L1500 HydrophobicContact CG1-CD1 3.5Å; V1496-L1500 VanDerWaalsContact CG1-CD1 3.5Å; V1496-L1500 HydrophobicContact CG1-CG 3.96Å; V1496-L1500 WeakPolarHBondContact O-CB 3.47Å; V1496-L1500 WeakPolarHBondContact O-CG 3.31Å; V1496-L1500 PolarHBondContact O-N 3.34Å; V1496-L1541 HydrophobicContact CG2-CD2 4.43Å
1497	I	44.1	Very low	39.2	Very low	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.8	-52.5	170.5	-48.6	163.6	0	0	0	107.7	P1223 L1226 R1227 L1230 T1493 E1494 A1499 Y1501	P1223-I1497 HydrophobicContact CB-CG2 3.94Å; L1226-I1497 HydrophobicContact CB-CD1 3.6Å; L1226-I1497 HydrophobicContact CB-CG1 3.75Å; L1226-I1497 HydrophobicContact CB-CG2 4.09Å; L1226-I1497 HydrophobicContact CD1-CG1 4.15Å; L1226-I1497 HydrophobicContact CD2-CD1 3.97Å; L1226-I1497 HydrophobicContact CD2-CG1 3.96Å; L1226-I1497 HydrophobicContact CG-CD1 4.28Å; L1226-I1497 HydrophobicContact CG-CG1 4.14Å; R1227-I1497 HydrophobicContact CG-CD1 4.35Å; L1230-I1497 HydrophobicContact CD1-CD1 3.63Å; T1493-I1497 WeakPolarHBondContact O-CD1 3.12Å; T1493-I1497 VanDerWaalsContact O-CG1 3.29Å; T1493-I1497 WeakPolarHBondContact O-CG1 3.05Å; E1494-I1497 VanDerWaalsContact O-CB 3.3Å; E1494-I1497 WeakPolarHBondContact O-CB 3.31Å; I1497-A1499 PolarHBondContact O-N 3.3Å; I1497-Y1501 HydrophobicContact CG2-CD2 4.3Å; I1497-Y1501 HydrophobicContact CG2-CE2 3.99Å; I1497-Y1501 VanDerWaalsContact O-CB 3.29Å; I1497-Y1501 WeakPolarHBondContact O-CB 3.48Å; I1497-Y1501 WeakPolarHBondContact O-CD2 3.17Å; I1497-Y1501 PolarHBondContact O-N 3.05Å
1498	N	48.2	Very low	39.1	Very low	39 Å²	39	59.4 Å²	59.4	21%	0.209	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-31.5	176.7	-60.4	-28.6	0	0	0	113.8	R1227 E1494 Q1495	R1227-N1498 PolarHBondContact NH2-OD1 2.98Å; E1494-N1498 PolarHBondContact O-N 3.25Å; E1494-N1498 PolarHBondContact O-ND2 3.49Å; E1494-N1498 VanDerWaalsContact O-ND2 3.09Å; E1494-N1498 PolarHBondContact O-OD1 3.32Å; E1494-N1498 PolarHBondContact OE2-ND2 3.01Å; Q1495-N1498 CarbonylContact O-C 3.54Å; Q1495-N1498 PolarHBondContact O-N 3.21Å
1499	A	45.3	Very low	39	Very low	24 Å²	24	60.8 Å²	60.8	20%	0.198	34%	0.335	C	S	.	.	H	α-helix	trans	-85.6	-30.7	-177.1	0	0	0	0	0	114.9	Q1495 V1496 I1497 Y1501 P1535 L1541	Q1495-A1499 WeakPolarHBondContact O-CB 3.42Å; Q1495-A1499 PolarHBondContact O-N 2.69Å; V1496-A1499 PolarHBondContact O-N 2.79Å; I1497-A1499 PolarHBondContact O-N 3.3Å; A1499-Y1501 PolarHBondContact O-N 2.94Å; A1499-P1535 HydrophobicContact CB-CG 4.26Å; A1499-L1541 HydrophobicContact CB-CD2 3.96Å
1500	L	37.3	Very low	38.7	Very low	107 Å²	107	58.9 Å²	58.9	56%	0.56	32%	0.324	S	S	*	.	H	α-helix	trans	-72.6	-15.2	168.9	-71.1	175.8	0	0	0	112.2	V1496	V1496-L1500 HydrophobicContact CG1-CD1 3.5Å; V1496-L1500 VanDerWaalsContact CG1-CD1 3.5Å; V1496-L1500 HydrophobicContact CG1-CG 3.96Å; V1496-L1500 WeakPolarHBondContact O-CB 3.47Å; V1496-L1500 WeakPolarHBondContact O-CG 3.31Å; V1496-L1500 PolarHBondContact O-N 3.34Å
1501	Y	40.8	Very low	38.1	Very low	31 Å²	31	59.6 Å²	59.6	12%	0.122	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	26	-177	-85.2	-108.4	0	0	0	114.1	F1221 C1222 P1223 I1497 A1499 N1503	F1221-Y1501 HydrophobicContact CB-CE1 3.84Å; F1221-Y1501 HydrophobicContact CB-CE2 4.45Å; F1221-Y1501 VanDerWaalsContact CB-OH 3.29Å; F1221-Y1501 WeakPolarHBondContact CB-OH 3.37Å; F1221-Y1501 HydrophobicContact CD1-CD2 4.36Å; F1221-Y1501 HydrophobicContact CD1-CE1 4.24Å; F1221-Y1501 AromaticContact CD1-CE2 3.32Å; F1221-Y1501 HydrophobicContact CD1-CE2 3.32Å; F1221-Y1501 AromaticContact CD1-CZ 3.27Å; F1221-Y1501 WeakPolarHBondContact CD1-OH 3.41Å; F1221-Y1501 AromaticContact CE1-CE2 3.76Å; F1221-Y1501 HydrophobicContact CE1-CE2 3.76Å; F1221-Y1501 HydrophobicContact CG-CE1 4.35Å; F1221-Y1501 HydrophobicContact CG-CE2 4.15Å; F1221-Y1501 AromaticContact CG-CZ 3.62Å; F1221-Y1501 WeakPolarHBondContact CG-OH 3.24Å; F1221-Y1501 WeakPolarHBondContact O-CE1 3.43Å; C1222-Y1501 WeakPolarHBondContact CA-OH 3.43Å; C1222-Y1501 PolarHBondContact N-OH 2.86Å; C1222-Y1501 PolarHBondContact O-OH 2.71Å; P1223-Y1501 HydrophobicContact CB-CE1 4.43Å; P1223-Y1501 HydrophobicContact CG-CD1 3.84Å; P1223-Y1501 HydrophobicContact CG-CE1 3.49Å; P1223-Y1501 VanDerWaalsContact CG-CE1 3.49Å; P1223-Y1501 VanDerWaalsContact N-OH 3.11Å; I1497-Y1501 HydrophobicContact CG2-CD2 4.3Å; I1497-Y1501 HydrophobicContact CG2-CE2 3.99Å; I1497-Y1501 VanDerWaalsContact O-CB 3.29Å; I1497-Y1501 WeakPolarHBondContact O-CB 3.48Å; I1497-Y1501 WeakPolarHBondContact O-CD2 3.17Å; I1497-Y1501 PolarHBondContact O-N 3.05Å; A1499-Y1501 PolarHBondContact O-N 2.94Å; Y1501-N1503 PolarHBondContact O-N 3.13Å
1502	R	35.8	Very low	37.4	Very low	104 Å²	104	67.6 Å²	67.6	39%	0.392	36%	0.358	S	S	.	.			trans	-71.7	83.8	152.9	-101.9	-175.8	-81.4	-144.5	-4.9	109.2	R1537	R1502-R1537 PolarHBondContact NH1-O 3.47Å; R1502-R1537 PolarHBondContact NH2-O 3.02Å
1503	N	29.4	Very low	36.6	Very low	115 Å²	115	75.4 Å²	75.4	62%	0.615	39%	0.394	S	S	*	.			trans	-61.8	153	160.9	-67.6	-20.3	0	0	0	110	Y1501	Y1501-N1503 PolarHBondContact O-N 3.13Å
1504	D	26.9	Very low	35.6	Very low	125 Å²	125	81 Å²	81	67%	0.668	43%	0.43	S	S	*	.	S	Bend	trans	39.1	144.6	140.2	-53.3	-40	0	0	0	121.9
1505	A	29.7	Very low	34.6	Very low	92 Å²	92	84.9 Å²	84.9	76%	0.76	46%	0.456	S	S	*	.			trans	73.8	163.8	-177.1	0	0	0	0	0	115.4
1506	E	32.3	Very low	33.6	Very low	111 Å²	111	96.8 Å²	96.8	52%	0.519	50%	0.501	S	S	.	.			trans	59.5	108.7	-168.3	-68.6	144.2	-135	0	0	112.4	W1552 V1649	E1506-W1552 VanDerWaalsContact OE1-CH2 3.29Å; E1506-W1552 WeakPolarHBondContact OE1-CH2 3.3Å; E1506-W1552 WeakPolarHBondContact OE2-CH2 3.48Å; E1506-W1552 WeakPolarHBondContact OE2-CZ3 3.35Å; E1506-V1649 HydrophobicContact CG-CG2 4.37Å
1507	E	30.8	Very low	32.8	Very low	131 Å²	131	103.6 Å²	103.6	61%	0.612	53%	0.53	S	S	*	.				54	131.2	53	-46.4	-155.9	158.7	0	0	111.7	E1647	E1507-E1647 CarbonylContact C-O 3.36Å
1508	G	29.1	Very low	32	Very low	60 Å²	60	113.8 Å²	113.8	62%	0.619	58%	0.575	S	S	*	*			cis	164.8	20.9	11.4	0	0	0	0	0	118.7	E1647	G1508-E1647 PolarHBondContact N-O 3.2Å
1509	E	30.3	Very low	31	Very low	109 Å²	109	117.3 Å²	117.3	51%	0.509	59%	0.592	S	S	.	*			trans	-134.9	-116.2	-178.9	-129.9	175.5	-173.9	0	0	121.5	V585 E1647	V585-E1509 HydrophobicContact CG2-CG 4.27Å; E1509-E1647 HydrophobicContact CB-CB 3.8Å; E1509-E1647 PolarHBondContact N-O 2.62Å; E1509-E1647 VanDerWaalsContact N-O 3.07Å
1510	E	32.4	Very low	30	Very low	58 Å²	58	120 Å²	120	27%	0.271	61%	0.614	S	S	.	*			trans	-78.2	164.3	-149.7	-59	-143.8	139.8	0	0	114.2	S581 E1647	S581-E1510 WeakPolarHBondContact CB-OE1 3.46Å; S581-E1510 WeakPolarHBondContact CB-OE2 3.43Å; S581-E1510 PolarHBondContact OG-OE1 3.21Å; E1510-E1647 WeakPolarHBondContact CA-OE1 3.45Å; E1510-E1647 HydrophobicContact CB-CG 4.12Å; E1510-E1647 VanDerWaalsContact CB-OE1 3.22Å; E1510-E1647 WeakPolarHBondContact CB-OE1 3.22Å
1511	K	30.3	Very low	29.6	Very low	76 Å²	76	122 Å²	122	33%	0.33	63%	0.625	S	S	.	*			cis	98.8	56.5	16.3	-69.9	-175.7	-69.5	88.4	0	117.8	S581 K584	S581-K1511 PolarHBondContact O-NZ 2.8Å; K584-K1511 HydrophobicContact CB-CD 3.78Å; K584-K1511 HydrophobicContact CD-CD 4.3Å
1512	E	30.7	Very low	28.9	Very low	188 Å²	188	127.2 Å²	127.2	88%	0.879	65%	0.651	S	S	*	*			trans	-145.7	155.8	132.9	-123.3	163.9	-143.5	0	0	114.9	P1514	E1512-P1514 WeakPolarHBondContact O-CD 3.36Å
1513	E	27	Very low	28.5	Very low	190 Å²	190	130.3 Å²	130.3	89%	0.888	67%	0.669	S	S	*	*			trans	-103.2	108.6	-178.6	-76.4	-166.6	138.9	0	0	111.5
1514	P	26.8	Very low	28.2	Very low	118 Å²	118	132 Å²	132	77%	0.766	68%	0.678	S	S	*	*			trans	-72.2	146.7	155	30.5	-31.7	0	0	0	109.6	E1512	E1512-P1514 WeakPolarHBondContact O-CD 3.36Å
1515	P	26.2	Very low	28.2	Very low	93 Å²	93	131.7 Å²	131.7	60%	0.604	68%	0.681	S	S	*	*			trans	-79.1	153.8	-154.6	30.4	-37.8	0	0	0	114.1	K1517	P1515-K1517 HydrophobicContact CB-CB 4.38Å; P1515-K1517 HydrophobicContact CB-CG 3.99Å; P1515-K1517 HydrophobicContact CG-CB 4.13Å; P1515-K1517 HydrophobicContact CG-CD 4.06Å; P1515-K1517 HydrophobicContact CG-CG 3.82Å; P1515-K1517 PolarHBondContact O-N 2.9Å
1516	R	27.3	Very low	28	Very low	254 Å²	254	132.9 Å²	132.9	96%	0.958	68%	0.678	S	S	*	*			trans	-71.5	44.4	160.3	-70.3	-174.6	173.5	-178.1	0.3	112.6	K1518	R1516-K1518 PolarHBondContact O-N 3.13Å; R1516-K1518 VanDerWaalsContact O-N 3.13Å
1517	K	28.3	Very low	27.8	Very low	151 Å²	151	134.6 Å²	134.6	66%	0.657	69%	0.691	S	S	*	*			trans	-67.6	109.3	171.7	-88.4	-170	-175.5	-178.4	0	108.8	P1515 I1519	P1515-K1517 HydrophobicContact CB-CB 4.38Å; P1515-K1517 HydrophobicContact CB-CG 3.99Å; P1515-K1517 HydrophobicContact CG-CB 4.13Å; P1515-K1517 HydrophobicContact CG-CD 4.06Å; P1515-K1517 HydrophobicContact CG-CG 3.82Å; P1515-K1517 PolarHBondContact O-N 2.9Å; K1517-I1519 HydrophobicContact CB-CD1 4.04Å; K1517-I1519 HydrophobicContact CB-CG1 4.04Å; K1517-I1519 HydrophobicContact CD-CD1 3.64Å; K1517-I1519 HydrophobicContact CD-CG1 4.03Å; K1517-I1519 HydrophobicContact CG-CD1 4.45Å; K1517-I1519 PolarHBondContact O-N 2.74Å
1518	K	27	Very low	27.7	Very low	214 Å²	214	134.4 Å²	134.4	93%	0.93	70%	0.704	S	S	*	*			trans	-69.6	74.2	152	-66.2	176.5	-177.9	171.9	0	107.9	R1516 A1520	R1516-K1518 PolarHBondContact O-N 3.13Å; R1516-K1518 VanDerWaalsContact O-N 3.13Å; K1518-A1520 PolarHBondContact O-N 3.05Å
1519	I	28	Very low	28.2	Very low	112 Å²	112	138.1 Å²	138.1	57%	0.574	71%	0.705	S	S	*	*			trans	-71.6	118.2	163.3	-78.6	155.9	0	0	0	106.3	K1517 L1521	K1517-I1519 HydrophobicContact CB-CD1 4.04Å; K1517-I1519 HydrophobicContact CB-CG1 4.04Å; K1517-I1519 HydrophobicContact CD-CD1 3.64Å; K1517-I1519 HydrophobicContact CD-CG1 4.03Å; K1517-I1519 HydrophobicContact CG-CD1 4.45Å; K1517-I1519 PolarHBondContact O-N 2.74Å; I1519-L1521 HydrophobicContact CG2-CD1 4.06Å; I1519-L1521 HydrophobicContact CG2-CG 3.75Å
1520	A	24.5	Very low	28.7	Very low	81 Å²	81	136.8 Å²	136.8	67%	0.669	71%	0.713	S	S	*	*			trans	-89.4	112.6	151.4	0	0	0	0	0	106	K1518	K1518-A1520 PolarHBondContact O-N 3.05Å
1521	L	29	Very low	29.7	Very low	148 Å²	148	140 Å²	140	78%	0.775	73%	0.726	S	S	*	*			trans	-95.4	110.9	141.4	-67.5	159.3	0	0	0	101.6	I1519	I1519-L1521 HydrophobicContact CG2-CD1 4.06Å; I1519-L1521 HydrophobicContact CG2-CG 3.75Å
1522	Q	25.9	Very low	30.9	Very low	142 Å²	142	139.8 Å²	139.8	66%	0.664	73%	0.731	S	S	*	*				47.4	100	70.2	-60.3	-169.3	-82.6	0	0	108.9
1523	E	25.6	Very low	32.5	Very low	169 Å²	169	131.4 Å²	131.4	79%	0.79	69%	0.693	S	S	*	*				57.6	64.4	80.6	-62.4	175.1	147.5	0	0	110.1
1524	N	25	Very low	34.4	Very low	150 Å²	150	124.4 Å²	124.4	80%	0.802	66%	0.661	S	S	*	*			trans	-167	123.7	134.7	-90.6	-21.9	0	0	0	107.8
1525	V	26.1	Very low	36.4	Very low	119 Å²	119	119.1 Å²	119.1	72%	0.721	63%	0.627	S	S	*	*				88	106	96.3	170.6	0	0	0	0	111.9
1526	V	26.2	Very low	38.8	Very low	116 Å²	116	115.5 Å²	115.5	70%	0.703	60%	0.601	S	S	*	*			trans	71.5	148.5	152.1	176.8	0	0	0	0	117.9
1527	D	27.6	Very low	41.2	Very low	147 Å²	147	106.2 Å²	106.2	79%	0.786	57%	0.566	S	S	*	*			trans	36.2	98.2	167.5	-56.6	-17.8	0	0	0	119.6
1528	S	28.9	Very low	44	Very low	127 Å²	127	100.2 Å²	100.2	89%	0.888	54%	0.539	S	S	*	.			trans	-96.6	93.9	164.4	-61.7	0	0	0	0	110.7
1529	E	38.7	Very low	46.3	Very low	139 Å²	139	91.6 Å²	91.6	65%	0.65	50%	0.503	S	S	*	.			trans	-61.8	143.5	176.8	-66.1	-168	123.5	0	0	112.8	F1531	E1529-F1531 HydrophobicContact CB-CD2 4.47Å; E1529-F1531 HydrophobicContact CB-CE2 3.93Å; E1529-F1531 HydrophobicContact CB-CZ 4.02Å; E1529-F1531 VanDerWaalsContact O-CD2 3.28Å; E1529-F1531 WeakPolarHBondContact O-CD2 3.3Å; E1529-F1531 PolarHBondContact O-N 2.81Å; E1529-F1531 VanDerWaalsContact O-N 3.1Å
1530	A	41.7	Very low	48.3	Very low	80 Å²	80	91 Å²	91	66%	0.661	49%	0.494	S	S	*	.			trans	-82.5	83.4	176.4	0	0	0	0	0	110.3	V1532	A1530-V1532 WeakPolarHBondContact O-CG2 3.5Å; A1530-V1532 PolarHBondContact O-N 2.98Å; A1530-V1532 VanDerWaalsContact O-N 3.17Å
1531	F	52	Low	49.9	Very low	125 Å²	125	89.4 Å²	89.4	55%	0.548	47%	0.474	S	S	.	.			trans	-60.8	115.9	-178.3	-71.5	-78.5	0	0	0	113.4	A1483 E1529	A1483-F1531 HydrophobicContact CB-CB 4.14Å; A1483-F1531 PolarHBondContact N-O 2.87Å; E1529-F1531 HydrophobicContact CB-CD2 4.47Å; E1529-F1531 HydrophobicContact CB-CE2 3.93Å; E1529-F1531 HydrophobicContact CB-CZ 4.02Å; E1529-F1531 VanDerWaalsContact O-CD2 3.28Å; E1529-F1531 WeakPolarHBondContact O-CD2 3.3Å; E1529-F1531 PolarHBondContact O-N 2.81Å; E1529-F1531 VanDerWaalsContact O-N 3.1Å
1532	V	56.3	Low	51	Low	72 Å²	72	87.6 Å²	87.6	44%	0.436	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	103.8	179.6	-114.5	0	0	0	0	111.9	I1480 L1481 A1491 A1530	I1480-V1532 HydrophobicContact CB-CB 3.93Å; I1480-V1532 HydrophobicContact CB-CG1 4.09Å; I1480-V1532 HydrophobicContact CD1-CB 3.64Å; I1480-V1532 HydrophobicContact CD1-CG1 3.83Å; I1480-V1532 HydrophobicContact CD1-CG2 3.93Å; I1480-V1532 HydrophobicContact CG1-CB 4.18Å; I1480-V1532 HydrophobicContact CG1-CG1 4.13Å; L1481-V1532 CarbonylContact O-C 3.55Å; L1481-V1532 WeakPolarHBondContact O-CA 3.28Å; A1491-V1532 HydrophobicContact CB-CG1 4.35Å; A1530-V1532 WeakPolarHBondContact O-CG2 3.5Å; A1530-V1532 PolarHBondContact O-N 2.98Å; A1530-V1532 VanDerWaalsContact O-N 3.17Å
1533	V	63.4	Low	52.6	Low	13 Å²	13	82.5 Å²	82.5	8%	0.079	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	141	-170.4	-172.4	0	0	0	0	112.1	I1480 L1481 A1483 P1535	I1480-V1533 CarbonylContact C-O 3.58Å; I1480-V1533 VanDerWaalsContact CA-O 3.31Å; I1480-V1533 WeakPolarHBondContact CA-O 3.49Å; L1481-V1533 HydrophobicContact CB-CB 4.25Å; L1481-V1533 VanDerWaalsContact CB-O 3.27Å; L1481-V1533 WeakPolarHBondContact CB-O 3.42Å; L1481-V1533 VanDerWaalsContact CG-O 3.31Å; L1481-V1533 WeakPolarHBondContact CG-O 3.32Å; L1481-V1533 PolarHBondContact N-O 2.92Å; L1481-V1533 PolarHBondContact O-N 3.02Å; A1483-V1533 HydrophobicContact CB-CG2 4Å; V1533-P1535 WeakPolarHBondContact O-CD 3.37Å
1534	L	69	Low	54.8	Low	43 Å²	43	76.4 Å²	76.4	23%	0.225	43%	0.427	C	S	.	.			trans	-105.1	61.8	-179	-148.7	159.8	0	0	0	112.3	V1461 L1476 I1480 R1536 L1539	V1461-L1534 HydrophobicContact CG1-CD1 3.8Å; L1476-L1534 HydrophobicContact CD2-CD1 4.19Å; I1480-L1534 HydrophobicContact CG2-CB 3.72Å; I1480-L1534 HydrophobicContact CG2-CD1 3.78Å; I1480-L1534 HydrophobicContact CG2-CG 3.66Å; L1534-R1536 VanDerWaalsContact CD2-CZ 3.45Å; L1534-R1536 PolarHBondContact O-N 3.45Å; L1534-L1539 VanDerWaalsContact O-CD1 3.23Å; L1534-L1539 WeakPolarHBondContact O-CD1 3.21Å
1535	P	67.3	Low	57.4	Low	6 Å²	6	73.4 Å²	73.4	4%	0.039	41%	0.409	C	S	.	.			trans	-68.5	124.9	-166.8	30.8	-38.6	0	0	0	115.2	L1481 Q1495 A1499 V1533 L1539	L1481-P1535 HydrophobicContact CD1-CG 3.21Å; L1481-P1535 HydrophobicContact CG-CG 4.12Å; Q1495-P1535 HydrophobicContact CB-CG 3.68Å; Q1495-P1535 HydrophobicContact CG-CG 4.37Å; A1499-P1535 HydrophobicContact CB-CG 4.26Å; V1533-P1535 WeakPolarHBondContact O-CD 3.37Å; P1535-L1539 HydrophobicContact CB-CB 4.01Å
1536	R	76.8	Confident	60.1	Low	18 Å²	18	69.6 Å²	69.6	7%	0.068	39%	0.385	C	S	.	.			trans	-83.8	169.7	144.9	-49.4	-56.7	-179.2	-124.1	8.8	109.2	Q1495 L1534 W1538 L1539 E1587	Q1495-R1536 VanDerWaalsContact NE2-NH1 3.15Å; L1534-R1536 VanDerWaalsContact CD2-CZ 3.45Å; L1534-R1536 PolarHBondContact O-N 3.45Å; R1536-W1538 HydrophobicContact CB-CD2 3.44Å; R1536-W1538 VanDerWaalsContact CB-CD2 3.44Å; R1536-W1538 HydrophobicContact CB-CE3 3.76Å; R1536-W1538 HydrophobicContact CB-CG 4.09Å; R1536-W1538 HydrophobicContact CB-CH2 3.66Å; R1536-W1538 HydrophobicContact CB-CZ2 3.34Å; R1536-W1538 HydrophobicContact CB-CZ3 3.85Å; R1536-W1538 HydrophobicContact CG-CD2 4.4Å; R1536-W1538 HydrophobicContact CG-CH2 4.01Å; R1536-W1538 HydrophobicContact CG-CZ2 3.45Å; R1536-W1538 VanDerWaalsContact CG-CZ2 3.45Å; R1536-W1538 PolarHBondContact O-N 3.44Å; R1536-W1538 VanDerWaalsContact O-N 3.12Å; R1536-L1539 PolarHBondContact O-N 3.32Å; R1536-E1587 WeakPolarHBondContact CD-OE2 3.33Å; R1536-E1587 WeakPolarHBondContact CG-OE2 3.01Å; R1536-E1587 IonicContact CZ-OE1 2.81Å; R1536-E1587 IonicContact CZ-OE2 2.7Å; R1536-E1587 IonicContact NE-OE1 3.83Å; R1536-E1587 PolarHBondContact NE-OE1 2.94Å; R1536-E1587 IonicContact NE-OE2 3.9Å; R1536-E1587 PolarHBondContact NE-OE2 3.07Å; R1536-E1587 IonicContact NH2-OE1 2.73Å; R1536-E1587 PolarHBondContact NH2-OE1 3.1Å
1537	R	79	Confident	63	Low	58 Å²	58	71.9 Å²	71.9	22%	0.219	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.7	179.8	-75.4	-166.8	177.4	85.3	-15	113.8	R1502 F1553 F1579	R1502-R1537 PolarHBondContact NH1-O 3.47Å; R1502-R1537 PolarHBondContact NH2-O 3.02Å; R1537-F1553 HydrophobicContact CB-CD2 4.38Å; R1537-F1553 HydrophobicContact CB-CE2 3.44Å; R1537-F1553 VanDerWaalsContact CB-CE2 3.44Å; R1537-F1553 HydrophobicContact CB-CZ 4.01Å; R1537-F1553 HydrophobicContact CG-CE2 4.41Å; R1537-F1579 PolarHBondContact NH1-O 2.87Å; R1537-F1579 PolarHBondContact NH2-O 3.47Å
1538	W	85.6	Confident	65.7	Low	25 Å²	25	66.3 Å²	66.3	10%	0.095	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	2.8	171.5	50.3	98.7	0	0	0	114.8	R1536 I1545 N1546 L1550 F1553 L1580 Q1584 E1587 L1588	R1536-W1538 HydrophobicContact CB-CD2 3.44Å; R1536-W1538 VanDerWaalsContact CB-CD2 3.44Å; R1536-W1538 HydrophobicContact CB-CE3 3.76Å; R1536-W1538 HydrophobicContact CB-CG 4.09Å; R1536-W1538 HydrophobicContact CB-CH2 3.66Å; R1536-W1538 HydrophobicContact CB-CZ2 3.34Å; R1536-W1538 HydrophobicContact CB-CZ3 3.85Å; R1536-W1538 HydrophobicContact CG-CD2 4.4Å; R1536-W1538 HydrophobicContact CG-CH2 4.01Å; R1536-W1538 HydrophobicContact CG-CZ2 3.45Å; R1536-W1538 VanDerWaalsContact CG-CZ2 3.45Å; R1536-W1538 PolarHBondContact O-N 3.44Å; R1536-W1538 VanDerWaalsContact O-N 3.12Å; W1538-I1545 CarbonylContact O-C 3.58Å; W1538-I1545 WeakPolarHBondContact O-CA 3.08Å; W1538-N1546 PolarHBondContact O-N 3.42Å; W1538-L1550 HydrophobicContact CB-CB 3.71Å; W1538-L1550 HydrophobicContact CB-CD1 4.07Å; W1538-L1550 HydrophobicContact CB-CG 4.44Å; W1538-L1550 HydrophobicContact CD2-CD1 4Å; W1538-L1550 HydrophobicContact CG-CB 4.3Å; W1538-L1550 HydrophobicContact CG-CD1 3.75Å; W1538-F1553 HydrophobicContact CE3-CD2 4.12Å; W1538-L1580 HydrophobicContact CZ3-CD2 4.32Å; W1538-Q1584 HydrophobicContact CH2-CB 4.01Å; W1538-Q1584 HydrophobicContact CH2-CG 4.03Å; W1538-Q1584 HydrophobicContact CZ3-CB 4.27Å; W1538-Q1584 HydrophobicContact CZ3-CG 4.3Å; W1538-E1587 HydrophobicContact CZ2-CB 4.45Å; W1538-E1587 WeakPolarHBondContact CZ2-OE2 3.5Å; W1538-L1588 HydrophobicContact CD2-CD2 4.31Å; W1538-L1588 HydrophobicContact CE3-CD1 4.36Å; W1538-L1588 HydrophobicContact CE3-CD2 4.17Å; W1538-L1588 HydrophobicContact CH2-CD1 3.92Å; W1538-L1588 HydrophobicContact CH2-CD2 3.65Å; W1538-L1588 HydrophobicContact CH2-CG 3.58Å; W1538-L1588 HydrophobicContact CZ2-CD2 3.78Å; W1538-L1588 HydrophobicContact CZ2-CG 4.15Å; W1538-L1588 HydrophobicContact CZ3-CD1 3.65Å; W1538-L1588 HydrophobicContact CZ3-CD2 3.86Å; W1538-L1588 HydrophobicContact CZ3-CG 3.84Å
1539	L	76	Confident	68.4	Low	33 Å²	33	61.3 Å²	61.3	17%	0.173	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-104.8	144	174.4	-77.3	164.1	0	0	0	111.8	L1534 P1535 R1536 G1543 I1545	L1534-L1539 VanDerWaalsContact O-CD1 3.23Å; L1534-L1539 WeakPolarHBondContact O-CD1 3.21Å; P1535-L1539 HydrophobicContact CB-CB 4.01Å; R1536-L1539 PolarHBondContact O-N 3.32Å; L1539-G1543 VanDerWaalsContact CD2-O 3.31Å; L1539-G1543 WeakPolarHBondContact CD2-O 3.04Å; L1539-I1545 HydrophobicContact CD2-CG1 3.73Å
1540	R	69.4	Low	70.8	Confident	100 Å²	100	55.8 Å²	55.8	38%	0.377	29%	0.291	S	S	.	.			trans	-91.8	164.1	172.4	-60.1	-167.8	-167.7	96.4	-1.7	110.8	D1542 G1543 S1544 I1545 N1546	R1540-D1542 VanDerWaalsContact CB-OD1 3.26Å; R1540-D1542 WeakPolarHBondContact CB-OD1 3.43Å; R1540-D1542 PolarHBondContact O-N 2.73Å; R1540-D1542 VanDerWaalsContact O-N 3.11Å; R1540-G1543 PolarHBondContact O-N 3.45Å; R1540-S1544 WeakPolarHBondContact CB-O 3.31Å; R1540-S1544 WeakPolarHBondContact CD-OG 3.33Å; R1540-S1544 PolarHBondContact N-O 3.46Å; R1540-S1544 PolarHBondContact NH1-OG 2.91Å; R1540-I1545 PolarHBondContact NH1-O 3.43Å; R1540-N1546 HydrophobicContact CG-CB 3.93Å; R1540-N1546 PolarHBondContact NE-OD1 3.22Å; R1540-N1546 PolarHBondContact NH2-OD1 2.89Å
1541	L	58.6	Low	73.1	Confident	47 Å²	47	54.8 Å²	54.8	25%	0.246	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	15	-179.9	-66.9	170.2	0	0	0	114.4	L1481 A1483 I1484 V1496 A1499	L1481-L1541 HydrophobicContact CD1-CD2 4.11Å; A1483-L1541 VanDerWaalsContact CA-O 3.32Å; A1483-L1541 WeakPolarHBondContact CA-O 3.5Å; I1484-L1541 HydrophobicContact CD1-CB 3.73Å; I1484-L1541 HydrophobicContact CD1-CD1 3.76Å; I1484-L1541 HydrophobicContact CD1-CG 4.4Å; I1484-L1541 HydrophobicContact CG1-CB 3.9Å; I1484-L1541 HydrophobicContact CG1-CD1 4.27Å; I1484-L1541 PolarHBondContact N-O 3.15Å; V1496-L1541 HydrophobicContact CG2-CD2 4.43Å; A1499-L1541 HydrophobicContact CB-CD2 3.96Å
1542	D	51.9	Low	74.8	Confident	110 Å²	110	51.5 Å²	51.5	59%	0.588	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	4	166.4	56.7	22.4	0	0	0	112.1	R1540 S1544	R1540-D1542 VanDerWaalsContact CB-OD1 3.26Å; R1540-D1542 WeakPolarHBondContact CB-OD1 3.43Å; R1540-D1542 PolarHBondContact O-N 2.73Å; R1540-D1542 VanDerWaalsContact O-N 3.11Å; D1542-S1544 VanDerWaalsContact C-N 3.34Å; D1542-S1544 VanDerWaalsContact OD1-CB 3.24Å; D1542-S1544 WeakPolarHBondContact OD1-CB 3.47Å; D1542-S1544 PolarHBondContact OD1-N 2.87Å; D1542-S1544 PolarHBondContact OD1-OG 3.29Å
1543	G	58.7	Low	76.4	Confident	35 Å²	35	49.2 Å²	49.2	36%	0.361	24%	0.238	S	C	.	.	S	Bend	trans	87.1	-10.9	-176	0	0	0	0	0	115.1	L1539 R1540	L1539-G1543 VanDerWaalsContact CD2-O 3.31Å; L1539-G1543 WeakPolarHBondContact CD2-O 3.04Å; R1540-G1543 PolarHBondContact O-N 3.45Å
1544	S	73.5	Confident	77.7	Confident	42 Å²	42	48.6 Å²	48.6	29%	0.294	24%	0.235	S	C	.	.			trans	-76	143.6	-178	69.2	0	0	0	0	113	R1540 D1542 N1546	R1540-S1544 WeakPolarHBondContact CB-O 3.31Å; R1540-S1544 WeakPolarHBondContact CD-OG 3.33Å; R1540-S1544 PolarHBondContact N-O 3.46Å; R1540-S1544 PolarHBondContact NH1-OG 2.91Å; D1542-S1544 VanDerWaalsContact C-N 3.34Å; D1542-S1544 VanDerWaalsContact OD1-CB 3.24Å; D1542-S1544 WeakPolarHBondContact OD1-CB 3.47Å; D1542-S1544 PolarHBondContact OD1-N 2.87Å; D1542-S1544 PolarHBondContact OD1-OG 3.29Å; S1544-N1546 PolarHBondContact O-N 3.17Å
1545	I	78.9	Confident	78.7	Confident	86 Å²	86	48 Å²	48	44%	0.441	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-72.8	124.8	174	-61.9	173.1	0	0	0	109.7	W1538 L1539 R1540 R1547 L1550	W1538-I1545 CarbonylContact O-C 3.58Å; W1538-I1545 WeakPolarHBondContact O-CA 3.08Å; L1539-I1545 HydrophobicContact CD2-CG1 3.73Å; R1540-I1545 PolarHBondContact NH1-O 3.43Å; I1545-R1547 VanDerWaalsContact C-N 3.28Å; I1545-R1547 HydrophobicContact CG2-CG 4.29Å; I1545-R1547 PolarHBondContact O-N 3.2Å; I1545-L1550 HydrophobicContact CG2-CB 4.44Å; I1545-L1550 HydrophobicContact CG2-CD2 4.2Å
1546	N	82.8	Confident	79.7	Confident	39 Å²	39	48.9 Å²	48.9	21%	0.209	24%	0.241	C	C	.	.			trans	-80.2	74.6	170.1	-162.5	25.9	0	0	0	110.1	W1538 R1540 S1544 P1548 L1549 L1550	W1538-N1546 PolarHBondContact O-N 3.42Å; R1540-N1546 HydrophobicContact CG-CB 3.93Å; R1540-N1546 PolarHBondContact NE-OD1 3.22Å; R1540-N1546 PolarHBondContact NH2-OD1 2.89Å; S1544-N1546 PolarHBondContact O-N 3.17Å; N1546-P1548 VanDerWaalsContact C-CD 3.45Å; N1546-P1548 VanDerWaalsContact C-N 3.35Å; N1546-P1548 VanDerWaalsContact O-N 3.13Å; N1546-L1549 HydrophobicContact CB-CB 4.28Å; N1546-L1549 WeakPolarHBondContact ND2-CD1 3.3Å; N1546-L1549 WeakPolarHBondContact O-CA 3.5Å; N1546-L1549 WeakPolarHBondContact O-CB 3.38Å; N1546-L1549 PolarHBondContact O-N 3.32Å; N1546-L1550 PolarHBondContact O-N 2.88Å; N1546-L1550 VanDerWaalsContact O-N 3.11Å
1547	R	86.7	Confident	80.4	Confident	164 Å²	164	48 Å²	48	62%	0.619	24%	0.237	S	C	*	.	H	α-helix	trans	-43.3	-45.6	-173	-66.8	-175.6	179.9	-163.7	-0.4	115.2	I1545 L1549 L1550 R1551 I1643	I1545-R1547 VanDerWaalsContact C-N 3.28Å; I1545-R1547 HydrophobicContact CG2-CG 4.29Å; I1545-R1547 PolarHBondContact O-N 3.2Å; R1547-L1549 PolarHBondContact O-N 2.99Å; R1547-L1550 PolarHBondContact O-N 3.17Å; R1547-R1551 PolarHBondContact O-N 2.98Å; R1547-I1643 HydrophobicContact CB-CD1 4.07Å; R1547-I1643 HydrophobicContact CB-CG1 4.26Å; R1547-I1643 HydrophobicContact CB-CG2 3.86Å; R1547-I1643 HydrophobicContact CG-CD1 4.38Å
1548	P	85.2	Confident	81.1	Confident	30 Å²	30	45.6 Å²	45.6	20%	0.195	23%	0.228	C	C	.	.	H	α-helix	trans	-55.1	-37.2	175.1	-30.5	38.8	0	0	0	114.6	N1546 W1552 P1644 P1646	N1546-P1548 VanDerWaalsContact C-CD 3.45Å; N1546-P1548 VanDerWaalsContact C-N 3.35Å; N1546-P1548 VanDerWaalsContact O-N 3.13Å; P1548-W1552 PolarHBondContact O-N 2.76Å; P1548-P1644 WeakPolarHBondContact CA-O 3.5Å; P1548-P1644 WeakPolarHBondContact CB-O 3.42Å; P1548-P1644 WeakPolarHBondContact CG-O 3.23Å; P1548-P1646 HydrophobicContact CB-CG 4.23Å; P1548-P1646 WeakPolarHBondContact O-CD 3.03Å
1549	L	85.1	Confident	81.3	Confident	23 Å²	23	47.3 Å²	47.3	12%	0.12	24%	0.242	C	C	.	.	H	α-helix	trans	-89.7	-16.9	-175	-132.5	162	0	0	0	111.8	N1546 R1547 W1552 F1553 P1646	N1546-L1549 HydrophobicContact CB-CB 4.28Å; N1546-L1549 WeakPolarHBondContact ND2-CD1 3.3Å; N1546-L1549 WeakPolarHBondContact O-CA 3.5Å; N1546-L1549 WeakPolarHBondContact O-CB 3.38Å; N1546-L1549 PolarHBondContact O-N 3.32Å; R1547-L1549 PolarHBondContact O-N 2.99Å; L1549-W1552 HydrophobicContact CD2-CE3 3.94Å; L1549-W1552 HydrophobicContact CD2-CZ3 4.26Å; L1549-W1552 HydrophobicContact CG-CE3 4.34Å; L1549-F1553 HydrophobicContact CD2-CD2 3.94Å; L1549-F1553 HydrophobicContact CD2-CE2 3.22Å; L1549-F1553 HydrophobicContact CD2-CZ 3.75Å; L1549-F1553 WeakPolarHBondContact O-CD2 3.24Å; L1549-P1646 HydrophobicContact CB-CG 4.44Å; L1549-P1646 HydrophobicContact CG-CG 4.13Å
1550	L	89.3	Confident	81.9	Confident	23 Å²	23	49.8 Å²	49.8	12%	0.12	25%	0.249	C	C	.	.	H	α-helix	trans	-70.2	-53.8	160.7	179	56.8	0	0	0	109.8	W1538 I1545 N1546 R1547 W1552 F1553 C1554 L1588 F1640	W1538-L1550 HydrophobicContact CB-CB 3.71Å; W1538-L1550 HydrophobicContact CB-CD1 4.07Å; W1538-L1550 HydrophobicContact CB-CG 4.44Å; W1538-L1550 HydrophobicContact CD2-CD1 4Å; W1538-L1550 HydrophobicContact CG-CB 4.3Å; W1538-L1550 HydrophobicContact CG-CD1 3.75Å; I1545-L1550 HydrophobicContact CG2-CB 4.44Å; I1545-L1550 HydrophobicContact CG2-CD2 4.2Å; N1546-L1550 PolarHBondContact O-N 2.88Å; N1546-L1550 VanDerWaalsContact O-N 3.11Å; R1547-L1550 PolarHBondContact O-N 3.17Å; L1550-W1552 VanDerWaalsContact C-N 3.31Å; L1550-W1552 PolarHBondContact O-N 2.97Å; L1550-F1553 PolarHBondContact O-N 2.85Å; L1550-C1554 PolarHBondContact O-N 2.71Å; L1550-C1554 PolarHBondContact O-SG 3.33Å; L1550-L1588 HydrophobicContact CD1-CD2 3.62Å; L1550-F1640 HydrophobicContact CD2-CE1 4.37Å; L1550-F1640 HydrophobicContact CG-CE1 4.11Å; L1550-F1640 HydrophobicContact CG-CZ 4.23Å
1551	R	89.2	Confident	83	Confident	58 Å²	58	45 Å²	45	22%	0.219	23%	0.231	C	C	.	.	H	α-helix	trans	-47.5	-54.8	178.5	177.2	-174.8	163.1	140.5	12	110.6	R1547 F1553 C1554 E1555 F1640 I1643 L1645	R1547-R1551 PolarHBondContact O-N 2.98Å; R1551-F1553 PolarHBondContact O-N 2.64Å; R1551-C1554 WeakPolarHBondContact O-CB 3.25Å; R1551-C1554 PolarHBondContact O-N 2.95Å; R1551-C1554 VanDerWaalsContact O-N 3.17Å; R1551-E1555 WeakPolarHBondContact CG-OE2 3.46Å; R1551-E1555 IonicContact CZ-OE1 2.63Å; R1551-E1555 IonicContact CZ-OE2 2.84Å; R1551-E1555 IonicContact NE-OE1 2.69Å; R1551-E1555 IonicContact NE-OE2 2.78Å; R1551-E1555 PolarHBondContact NE-OE2 2.76Å; R1551-E1555 IonicContact NH2-OE1 2.63Å; R1551-E1555 PolarHBondContact NH2-OE1 2.68Å; R1551-E1555 IonicContact NH2-OE2 2.8Å; R1551-E1555 PolarHBondContact NH2-OE2 2.84Å; R1551-E1555 VanDerWaalsContact NH2-OE2 3.16Å; R1551-E1555 VanDerWaalsContact O-CB 3.29Å; R1551-E1555 WeakPolarHBondContact O-CB 3.19Å; R1551-E1555 PolarHBondContact O-N 3.38Å; R1551-F1640 HydrophobicContact CB-CD1 3.55Å; R1551-F1640 HydrophobicContact CB-CE1 3.82Å; R1551-F1640 HydrophobicContact CB-CG 4.05Å; R1551-F1640 HydrophobicContact CG-CB 4.01Å; R1551-F1640 HydrophobicContact CG-CD1 3.87Å; R1551-F1640 HydrophobicContact CG-CD2 4.4Å; R1551-F1640 HydrophobicContact CG-CE1 4.46Å; R1551-F1640 HydrophobicContact CG-CG 3.83Å; R1551-I1643 HydrophobicContact CB-CG2 4.12Å; R1551-I1643 VanDerWaalsContact CD-O 3.25Å; R1551-I1643 WeakPolarHBondContact CD-O 3.33Å; R1551-I1643 PolarHBondContact NH1-O 3.24Å; R1551-L1645 HydrophobicContact CG-CD2 4.29Å
1552	W	88.5	Confident	84.5	Confident	56 Å²	56	45.9 Å²	45.9	21%	0.212	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-44	-176.8	176.9	43.7	0	0	0	114.6	E1506 P1548 L1549 L1550 E1555 G1556 L1645 P1646 V1649	E1506-W1552 VanDerWaalsContact OE1-CH2 3.29Å; E1506-W1552 WeakPolarHBondContact OE1-CH2 3.3Å; E1506-W1552 WeakPolarHBondContact OE2-CH2 3.48Å; E1506-W1552 WeakPolarHBondContact OE2-CZ3 3.35Å; P1548-W1552 PolarHBondContact O-N 2.76Å; L1549-W1552 HydrophobicContact CD2-CE3 3.94Å; L1549-W1552 HydrophobicContact CD2-CZ3 4.26Å; L1549-W1552 HydrophobicContact CG-CE3 4.34Å; L1550-W1552 VanDerWaalsContact C-N 3.31Å; L1550-W1552 PolarHBondContact O-N 2.97Å; W1552-E1555 PolarHBondContact O-N 2.86Å; W1552-G1556 PolarHBondContact O-N 2.95Å; W1552-L1645 HydrophobicContact CB-CD2 3.79Å; W1552-L1645 HydrophobicContact CG-CD2 4.35Å; W1552-P1646 HydrophobicContact CB-CG 4.06Å; W1552-P1646 HydrophobicContact CE3-CG 4.34Å; W1552-P1646 HydrophobicContact CG-CG 4.47Å; W1552-V1649 HydrophobicContact CD2-CG1 4.14Å; W1552-V1649 HydrophobicContact CD2-CG2 4.18Å; W1552-V1649 HydrophobicContact CE3-CG2 4.42Å; W1552-V1649 HydrophobicContact CG-CG1 4.06Å; W1552-V1649 HydrophobicContact CH2-CG2 4.43Å; W1552-V1649 HydrophobicContact CZ2-CG1 4.3Å; W1552-V1649 HydrophobicContact CZ2-CG2 4.21Å; W1552-V1649 VanDerWaalsContact NE1-CG1 3.29Å
1553	F	89.9	Confident	86.3	Confident	24 Å²	24	44.7 Å²	44.7	11%	0.105	23%	0.232	C	C	.	.	H	α-helix	trans	-69.6	-37.6	177	-69.7	-53.6	0	0	0	112.5	R1537 W1538 L1549 L1550 R1551 I1557 L1580 L1588	R1537-F1553 HydrophobicContact CB-CD2 4.38Å; R1537-F1553 HydrophobicContact CB-CE2 3.44Å; R1537-F1553 VanDerWaalsContact CB-CE2 3.44Å; R1537-F1553 HydrophobicContact CB-CZ 4.01Å; R1537-F1553 HydrophobicContact CG-CE2 4.41Å; W1538-F1553 HydrophobicContact CE3-CD2 4.12Å; L1549-F1553 HydrophobicContact CD2-CD2 3.94Å; L1549-F1553 HydrophobicContact CD2-CE2 3.22Å; L1549-F1553 HydrophobicContact CD2-CZ 3.75Å; L1549-F1553 WeakPolarHBondContact O-CD2 3.24Å; L1550-F1553 PolarHBondContact O-N 2.85Å; R1551-F1553 PolarHBondContact O-N 2.64Å; F1553-I1557 WeakPolarHBondContact O-CG1 3.24Å; F1553-I1557 PolarHBondContact O-N 2.82Å; F1553-I1557 VanDerWaalsContact O-N 3.11Å; F1553-L1580 HydrophobicContact CB-CD1 4.38Å; F1553-L1580 HydrophobicContact CD1-CD1 3.98Å; F1553-L1580 HydrophobicContact CD1-CD2 4.06Å; F1553-L1580 HydrophobicContact CD1-CG 4.21Å; F1553-L1580 HydrophobicContact CD2-CD2 4.23Å; F1553-L1580 HydrophobicContact CE1-CD2 4.03Å; F1553-L1580 HydrophobicContact CE1-CG 4.33Å; F1553-L1580 HydrophobicContact CE2-CD2 4.2Å; F1553-L1580 HydrophobicContact CG-CD1 4.24Å; F1553-L1580 HydrophobicContact CG-CD2 4.18Å; F1553-L1580 HydrophobicContact CZ-CD2 4.12Å; F1553-L1588 HydrophobicContact CB-CD1 3.61Å; F1553-L1588 HydrophobicContact CG-CD1 4.49Å
1554	C	91.3	Very high	87.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-44.5	172.3	-66.8	0	0	0	0	111.1	L1550 R1551 I1557 F1558 L1592 F1636 F1640	L1550-C1554 PolarHBondContact O-N 2.71Å; L1550-C1554 PolarHBondContact O-SG 3.33Å; R1551-C1554 WeakPolarHBondContact O-CB 3.25Å; R1551-C1554 PolarHBondContact O-N 2.95Å; R1551-C1554 VanDerWaalsContact O-N 3.17Å; C1554-I1557 PolarHBondContact O-N 3.41Å; C1554-F1558 WeakPolarHBondContact O-CB 3.29Å; C1554-F1558 PolarHBondContact O-N 2.85Å; C1554-L1592 HydrophobicContact CB-CD2 4.39Å; C1554-F1636 HydrophobicContact CB-CE2 3.8Å; C1554-F1636 HydrophobicContact CB-CZ 4.03Å; C1554-F1640 HydrophobicContact CB-CE2 3.74Å; C1554-F1640 HydrophobicContact CB-CZ 3.82Å
1555	E	89.3	Confident	88.6	Confident	31 Å²	31	48.5 Å²	48.5	15%	0.145	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-40.5	-177.8	-158.6	158.2	178.9	0	0	111.1	R1551 W1552 T1559 F1636 L1645	R1551-E1555 WeakPolarHBondContact CG-OE2 3.46Å; R1551-E1555 IonicContact CZ-OE1 2.63Å; R1551-E1555 IonicContact CZ-OE2 2.84Å; R1551-E1555 IonicContact NE-OE1 2.69Å; R1551-E1555 IonicContact NE-OE2 2.78Å; R1551-E1555 PolarHBondContact NE-OE2 2.76Å; R1551-E1555 IonicContact NH2-OE1 2.63Å; R1551-E1555 PolarHBondContact NH2-OE1 2.68Å; R1551-E1555 IonicContact NH2-OE2 2.8Å; R1551-E1555 PolarHBondContact NH2-OE2 2.84Å; R1551-E1555 VanDerWaalsContact NH2-OE2 3.16Å; R1551-E1555 VanDerWaalsContact O-CB 3.29Å; R1551-E1555 WeakPolarHBondContact O-CB 3.19Å; R1551-E1555 PolarHBondContact O-N 3.38Å; W1552-E1555 PolarHBondContact O-N 2.86Å; E1555-T1559 VanDerWaalsContact O-CB 3.23Å; E1555-T1559 WeakPolarHBondContact O-CB 3.42Å; E1555-T1559 PolarHBondContact O-N 3.37Å; E1555-T1559 PolarHBondContact O-OG1 2.55Å; E1555-F1636 VanDerWaalsContact CA-CZ 3.45Å; E1555-F1636 HydrophobicContact CB-CE1 4.14Å; E1555-F1636 HydrophobicContact CB-CZ 3.67Å; E1555-F1636 HydrophobicContact CG-CE1 4.02Å; E1555-F1636 HydrophobicContact CG-CZ 4.05Å; E1555-L1645 WeakPolarHBondContact OE2-CD2 3.45Å
1556	G	89.2	Confident	89	Confident	24 Å²	24	45.7 Å²	45.7	25%	0.247	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-51.8	173.3	0	0	0	0	0	113.4	W1552 R1560 Y1576	W1552-G1556 PolarHBondContact O-N 2.95Å; G1556-R1560 PolarHBondContact O-N 3.17Å; G1556-R1560 VanDerWaalsContact O-N 3.11Å; G1556-Y1576 PolarHBondContact O-OH 2.92Å
1557	I	90.9	Very high	89.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.8	-44.6	179.3	-67.8	169.1	0	0	0	110.8	F1553 C1554 R1560 I1561 Y1576 L1580 V1585 L1588 L1589 L1592	F1553-I1557 WeakPolarHBondContact O-CG1 3.24Å; F1553-I1557 PolarHBondContact O-N 2.82Å; F1553-I1557 VanDerWaalsContact O-N 3.11Å; C1554-I1557 PolarHBondContact O-N 3.41Å; I1557-R1560 WeakPolarHBondContact O-CB 3.43Å; I1557-R1560 PolarHBondContact O-N 2.99Å; I1557-R1560 VanDerWaalsContact O-N 3.12Å; I1557-I1561 HydrophobicContact CG2-CD1 4.14Å; I1557-I1561 PolarHBondContact O-N 3.26Å; I1557-I1561 VanDerWaalsContact O-N 3.11Å; I1557-Y1576 HydrophobicContact CB-CE2 4.37Å; I1557-Y1576 HydrophobicContact CG1-CD2 3.99Å; I1557-Y1576 HydrophobicContact CG1-CE2 3.65Å; I1557-L1580 HydrophobicContact CD1-CD1 3.99Å; I1557-V1585 HydrophobicContact CD1-CG1 4.37Å; I1557-L1588 HydrophobicContact CD1-CB 3.79Å; I1557-L1588 HydrophobicContact CD1-CD1 3.62Å; I1557-L1588 HydrophobicContact CD1-CG 4.37Å; I1557-L1589 HydrophobicContact CG2-CD2 3.64Å; I1557-L1589 HydrophobicContact CG2-CG 4.32Å; I1557-L1592 HydrophobicContact CG2-CD1 4.19Å
1558	F	92.5	Very high	89.5	Confident	7 Å²	7	38.8 Å²	38.8	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-44.6	-179.9	179.2	-126.9	0	0	0	111.9	C1554 R1560 I1561 L1562 L1592 C1597 I1598 C1632 V1633 F1636	C1554-F1558 WeakPolarHBondContact O-CB 3.29Å; C1554-F1558 PolarHBondContact O-N 2.85Å; F1558-R1560 PolarHBondContact O-N 3.26Å; F1558-I1561 PolarHBondContact O-N 3.07Å; F1558-I1561 VanDerWaalsContact O-N 3.11Å; F1558-L1562 HydrophobicContact CD1-CD1 4Å; F1558-L1562 HydrophobicContact CD2-CG 4.43Å; F1558-L1562 HydrophobicContact CE1-CD1 3.65Å; F1558-L1562 HydrophobicContact CE1-CG 4.41Å; F1558-L1562 HydrophobicContact CE2-CD1 4.19Å; F1558-L1562 HydrophobicContact CE2-CD2 4.3Å; F1558-L1562 HydrophobicContact CE2-CG 4.07Å; F1558-L1562 HydrophobicContact CG-CD1 4.43Å; F1558-L1562 HydrophobicContact CZ-CD1 3.73Å; F1558-L1562 HydrophobicContact CZ-CD2 4.18Å; F1558-L1562 HydrophobicContact CZ-CG 4.05Å; F1558-L1562 WeakPolarHBondContact O-CG 3.48Å; F1558-L1562 PolarHBondContact O-N 3.07Å; F1558-L1592 HydrophobicContact CB-CD1 4.1Å; F1558-L1592 HydrophobicContact CB-CD2 4.44Å; F1558-C1597 HydrophobicContact CD2-CB 4.48Å; F1558-C1597 HydrophobicContact CE2-CB 4.13Å; F1558-I1598 HydrophobicContact CD2-CG2 3.96Å; F1558-I1598 HydrophobicContact CE2-CG2 4.17Å; F1558-C1632 HydrophobicContact CE2-CB 3.7Å; F1558-C1632 HydrophobicContact CZ-CB 3.58Å; F1558-V1633 HydrophobicContact CE1-CG2 4.41Å; F1558-V1633 HydrophobicContact CZ-CG2 4.29Å; F1558-F1636 HydrophobicContact CB-CD2 4.1Å; F1558-F1636 HydrophobicContact CB-CE2 3.92Å; F1558-F1636 HydrophobicContact CD1-CB 4.08Å; F1558-F1636 HydrophobicContact CD1-CD1 4.31Å; F1558-F1636 AromaticContact CD1-CD2 3.34Å; F1558-F1636 HydrophobicContact CD1-CD2 3.34Å; F1558-F1636 AromaticContact CD1-CE2 3.82Å; F1558-F1636 HydrophobicContact CD1-CE2 3.82Å; F1558-F1636 AromaticContact CD1-CG 3.64Å; F1558-F1636 HydrophobicContact CD1-CG 3.64Å; F1558-F1636 HydrophobicContact CE1-CB 3.67Å; F1558-F1636 AromaticContact CE1-CD2 3.87Å; F1558-F1636 HydrophobicContact CE1-CD2 3.87Å; F1558-F1636 AromaticContact CE1-CG 3.76Å; F1558-F1636 HydrophobicContact CE1-CG 3.76Å; F1558-F1636 AromaticContact CG-CD2 3.77Å; F1558-F1636 HydrophobicContact CG-CD2 3.77Å; F1558-F1636 HydrophobicContact CG-CE2 4.09Å; F1558-F1636 HydrophobicContact CG-CG 4.48Å; F1558-F1636 HydrophobicContact CZ-CB 4.27Å
1559	T	90	Very high	89.8	Confident	61 Å²	61	38.5 Å²	38.5	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-61.2	-30.7	173.8	-55.9	0	0	0	0	112	E1555 T1563	E1555-T1559 VanDerWaalsContact O-CB 3.23Å; E1555-T1559 WeakPolarHBondContact O-CB 3.42Å; E1555-T1559 PolarHBondContact O-N 3.37Å; E1555-T1559 PolarHBondContact O-OG1 2.55Å; T1559-T1563 WeakPolarHBondContact O-CB 3.36Å; T1559-T1563 WeakPolarHBondContact O-CG2 3.28Å; T1559-T1563 PolarHBondContact O-N 2.92Å; T1559-T1563 PolarHBondContact O-OG1 3.43Å
1560	R	90	Very high	89.8	Confident	86 Å²	86	41 Å²	41	33%	0.325	23%	0.226	S	C	.	.	H	α-helix	trans	-71.9	-33.5	175.1	-166.7	54.7	167.9	162.6	1	113.4	G1556 I1557 F1558 T1563 L1564 L1572 Y1576	G1556-R1560 PolarHBondContact O-N 3.17Å; G1556-R1560 VanDerWaalsContact O-N 3.11Å; I1557-R1560 WeakPolarHBondContact O-CB 3.43Å; I1557-R1560 PolarHBondContact O-N 2.99Å; I1557-R1560 VanDerWaalsContact O-N 3.12Å; F1558-R1560 PolarHBondContact O-N 3.26Å; R1560-T1563 WeakPolarHBondContact CA-OG1 3.13Å; R1560-T1563 PolarHBondContact O-OG1 3.4Å; R1560-L1564 VanDerWaalsContact CZ-CD1 3.41Å; R1560-L1564 PolarHBondContact O-N 3Å; R1560-L1572 HydrophobicContact CB-CD2 4.22Å; R1560-L1572 HydrophobicContact CG-CD2 3.86Å; R1560-Y1576 VanDerWaalsContact CB-OH 3.28Å; R1560-Y1576 WeakPolarHBondContact CB-OH 3.49Å
1561	I	91.8	Very high	89.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-74.7	-36.3	173.5	-65.1	164.3	0	0	0	111	I1557 F1558 T1563 L1564 P1565 V1567 L1572 L1589 I1598 Y1626	I1557-I1561 HydrophobicContact CG2-CD1 4.14Å; I1557-I1561 PolarHBondContact O-N 3.26Å; I1557-I1561 VanDerWaalsContact O-N 3.11Å; F1558-I1561 PolarHBondContact O-N 3.07Å; F1558-I1561 VanDerWaalsContact O-N 3.11Å; I1561-T1563 VanDerWaalsContact C-N 3.34Å; I1561-L1564 CarbonylContact O-C 3.52Å; I1561-L1564 PolarHBondContact O-N 2.94Å; I1561-P1565 WeakPolarHBondContact O-CA 3.45Å; I1561-P1565 VanDerWaalsContact O-N 3.1Å; I1561-V1567 HydrophobicContact CG1-CG1 3.95Å; I1561-L1572 HydrophobicContact CD1-CD1 4.08Å; I1561-L1572 HydrophobicContact CG1-CD1 3.99Å; I1561-L1572 HydrophobicContact CG1-CD2 4.32Å; I1561-L1589 HydrophobicContact CD1-CD2 3.59Å; I1561-I1598 HydrophobicContact CD1-CD1 3.71Å; I1561-I1598 HydrophobicContact CD1-CG2 4.07Å; I1561-I1598 HydrophobicContact CG2-CG2 4.08Å; I1561-Y1626 HydrophobicContact CD1-CG 4.47Å
1562	L	91	Very high	89.9	Confident	64 Å²	64	40.9 Å²	40.9	34%	0.335	23%	0.23	S	C	.	.	H	α-helix	trans	-63.8	-37.7	172.2	-73.5	171.2	0	0	0	112.6	F1558 P1628 V1633	F1558-L1562 HydrophobicContact CD1-CD1 4Å; F1558-L1562 HydrophobicContact CD2-CG 4.43Å; F1558-L1562 HydrophobicContact CE1-CD1 3.65Å; F1558-L1562 HydrophobicContact CE1-CG 4.41Å; F1558-L1562 HydrophobicContact CE2-CD1 4.19Å; F1558-L1562 HydrophobicContact CE2-CD2 4.3Å; F1558-L1562 HydrophobicContact CE2-CG 4.07Å; F1558-L1562 HydrophobicContact CG-CD1 4.43Å; F1558-L1562 HydrophobicContact CZ-CD1 3.73Å; F1558-L1562 HydrophobicContact CZ-CD2 4.18Å; F1558-L1562 HydrophobicContact CZ-CG 4.05Å; F1558-L1562 WeakPolarHBondContact O-CG 3.48Å; F1558-L1562 PolarHBondContact O-N 3.07Å; L1562-P1628 HydrophobicContact CD2-CB 3.74Å; L1562-P1628 HydrophobicContact CD2-CG 4.23Å; L1562-V1633 HydrophobicContact CD1-CG2 4.35Å
1563	T	89.7	Confident	89.8	Confident	86 Å²	86	38.7 Å²	38.7	53%	0.528	22%	0.223	S	C	.	.	H	α-helix	trans	-84.3	-18.1	179.1	48.9	0	0	0	0	114.1	T1559 R1560 I1561	T1559-T1563 WeakPolarHBondContact O-CB 3.36Å; T1559-T1563 WeakPolarHBondContact O-CG2 3.28Å; T1559-T1563 PolarHBondContact O-N 2.92Å; T1559-T1563 PolarHBondContact O-OG1 3.43Å; R1560-T1563 WeakPolarHBondContact CA-OG1 3.13Å; R1560-T1563 PolarHBondContact O-OG1 3.4Å; I1561-T1563 VanDerWaalsContact C-N 3.34Å
1564	L	89	Confident	89.6	Confident	75 Å²	75	42.7 Å²	42.7	39%	0.393	25%	0.245	S	C	.	.	S	Bend	trans	-137.2	76.3	172.3	-63.7	174.3	0	0	0	110.4	R1560 I1561 G1566 V1567	R1560-L1564 VanDerWaalsContact CZ-CD1 3.41Å; R1560-L1564 PolarHBondContact O-N 3Å; I1561-L1564 CarbonylContact O-C 3.52Å; I1561-L1564 PolarHBondContact O-N 2.94Å; L1564-G1566 PolarHBondContact O-N 3.01Å; L1564-V1567 HydrophobicContact CB-CB 3.96Å; L1564-V1567 WeakPolarHBondContact O-CB 3.28Å; L1564-V1567 VanDerWaalsContact O-CG1 3.23Å; L1564-V1567 WeakPolarHBondContact O-CG1 3.29Å; L1564-V1567 PolarHBondContact O-N 2.92Å; L1564-V1567 VanDerWaalsContact O-N 3.08Å
1565	P	89.8	Confident	89.5	Confident	81 Å²	81	47.2 Å²	47.2	53%	0.526	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	134	172.6	-24.5	35.5	0	0	0	110.8	I1561 V1567 M1627 P1628	I1561-P1565 WeakPolarHBondContact O-CA 3.45Å; I1561-P1565 VanDerWaalsContact O-N 3.1Å; P1565-V1567 VanDerWaalsContact C-N 3.34Å; P1565-M1627 HydrophobicContact CB-SD 4.17Å; P1565-P1628 HydrophobicContact CB-CG 4.49Å; P1565-P1628 HydrophobicContact CG-CG 4.4Å
1566	G	87.6	Confident	89.5	Confident	28 Å²	28	47.3 Å²	47.3	29%	0.289	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	9.4	-175.2	0	0	0	0	0	114.5	L1564 S1625 Y1626 M1627	L1564-G1566 PolarHBondContact O-N 3.01Å; G1566-S1625 VanDerWaalsContact O-CB 3.29Å; G1566-S1625 WeakPolarHBondContact O-CB 3.21Å; G1566-Y1626 WeakPolarHBondContact CA-O 3.43Å; G1566-Y1626 PolarHBondContact N-O 3.11Å; G1566-M1627 PolarHBondContact N-SD 2.91Å; G1566-M1627 VanDerWaalsContact N-SD 3.4Å
1567	V	91.5	Very high	89	Confident	16 Å²	16	50.1 Å²	50.1	10%	0.097	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	137.7	173.2	62.5	0	0	0	0	111.5	I1561 L1564 P1565 D1571 L1572 S1625 Y1626	I1561-V1567 HydrophobicContact CG1-CG1 3.95Å; L1564-V1567 HydrophobicContact CB-CB 3.96Å; L1564-V1567 WeakPolarHBondContact O-CB 3.28Å; L1564-V1567 VanDerWaalsContact O-CG1 3.23Å; L1564-V1567 WeakPolarHBondContact O-CG1 3.29Å; L1564-V1567 PolarHBondContact O-N 2.92Å; L1564-V1567 VanDerWaalsContact O-N 3.08Å; P1565-V1567 VanDerWaalsContact C-N 3.34Å; V1567-D1571 HydrophobicContact CG2-CB 4.05Å; V1567-L1572 HydrophobicContact CG1-CD1 3.91Å; V1567-L1572 HydrophobicContact CG1-CD2 3.9Å; V1567-L1572 HydrophobicContact CG1-CG 3.89Å; V1567-L1572 HydrophobicContact CG2-CD2 4.19Å; V1567-L1572 HydrophobicContact CG2-CG 4.05Å; V1567-S1625 WeakPolarHBondContact O-CA 3.42Å; V1567-Y1626 PolarHBondContact O-N 2.94Å
1568	L	90.1	Very high	88.2	Confident	42 Å²	42	54.2 Å²	54.2	22%	0.22	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	146.5	-178.4	-59.2	179.9	0	0	0	111.9	T1570 D1571 L1572 C1623 V1624	L1568-T1570 WeakPolarHBondContact CB-OG1 3.39Å; L1568-T1570 PolarHBondContact O-N 2.98Å; L1568-D1571 HydrophobicContact CB-CB 4.3Å; L1568-D1571 PolarHBondContact O-N 3.49Å; L1568-L1572 PolarHBondContact O-N 3.21Å; L1568-C1623 HydrophobicContact CD2-CB 4.16Å; L1568-V1624 CarbonylContact C-O 3.5Å; L1568-V1624 WeakPolarHBondContact CA-O 3.45Å
1569	E	89.6	Confident	87.6	Confident	23 Å²	23	60 Å²	60	11%	0.107	33%	0.334	C	S	.	.	H	α-helix	trans	-57.1	-37.6	173.3	-168.2	176.1	100.5	0	0	111.6	D1571 C1573 K1586 L1589 V1624 Y1626	E1569-D1571 VanDerWaalsContact C-N 3.29Å; E1569-D1571 PolarHBondContact O-N 3.09Å; E1569-C1573 WeakPolarHBondContact O-CB 3.46Å; E1569-C1573 PolarHBondContact O-N 3.29Å; E1569-C1573 PolarHBondContact O-SG 3.41Å; E1569-K1586 WeakPolarHBondContact OE1-CE 3.48Å; E1569-K1586 IonicContact OE1-NZ 3.38Å; E1569-K1586 PolarHBondContact OE1-NZ 2.92Å; E1569-L1589 HydrophobicContact CG-CD1 4.32Å; E1569-V1624 HydrophobicContact CB-CB 3.92Å; E1569-V1624 HydrophobicContact CB-CG1 4.24Å; E1569-V1624 PolarHBondContact N-O 2.86Å; E1569-Y1626 HydrophobicContact CB-CD2 4.48Å; E1569-Y1626 HydrophobicContact CB-CE2 3.84Å; E1569-Y1626 HydrophobicContact CG-CE2 3.9Å; E1569-Y1626 PolarHBondContact OE2-OH 3.06Å
1570	T	86.9	Confident	87.3	Confident	77 Å²	77	57.1 Å²	57.1	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-58.5	-41.9	173.1	50.2	0	0	0	0	111.8	L1568 C1573 N1574	L1568-T1570 WeakPolarHBondContact CB-OG1 3.39Å; L1568-T1570 PolarHBondContact O-N 2.98Å; T1570-C1573 PolarHBondContact O-N 3.3Å; T1570-N1574 VanDerWaalsContact O-CB 3.24Å; T1570-N1574 WeakPolarHBondContact O-CB 3.24Å; T1570-N1574 PolarHBondContact O-N 3.5Å; T1570-N1574 PolarHBondContact O-ND2 3.13Å; T1570-N1574 VanDerWaalsContact O-ND2 3.07Å
1571	D	88.7	Confident	86.9	Confident	77 Å²	77	54.4 Å²	54.4	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-77.8	-35.5	-173.8	-61.3	-13.3	0	0	0	111	V1567 L1568 E1569 H1575	V1567-D1571 HydrophobicContact CG2-CB 4.05Å; L1568-D1571 HydrophobicContact CB-CB 4.3Å; L1568-D1571 PolarHBondContact O-N 3.49Å; E1569-D1571 VanDerWaalsContact C-N 3.29Å; E1569-D1571 PolarHBondContact O-N 3.09Å; D1571-H1575 WeakPolarHBondContact O-CB 3.29Å; D1571-H1575 PolarHBondContact O-N 3.23Å
1572	L	90.6	Very high	86.6	Confident	1 Å²	1	56 Å²	56	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-49.3	167.9	-68.5	173	0	0	0	111.3	R1560 I1561 V1567 L1568 N1574 H1575 Y1576 V1585 L1589 Y1626	R1560-L1572 HydrophobicContact CB-CD2 4.22Å; R1560-L1572 HydrophobicContact CG-CD2 3.86Å; I1561-L1572 HydrophobicContact CD1-CD1 4.08Å; I1561-L1572 HydrophobicContact CG1-CD1 3.99Å; I1561-L1572 HydrophobicContact CG1-CD2 4.32Å; V1567-L1572 HydrophobicContact CG1-CD1 3.91Å; V1567-L1572 HydrophobicContact CG1-CD2 3.9Å; V1567-L1572 HydrophobicContact CG1-CG 3.89Å; V1567-L1572 HydrophobicContact CG2-CD2 4.19Å; V1567-L1572 HydrophobicContact CG2-CG 4.05Å; L1568-L1572 PolarHBondContact O-N 3.21Å; L1572-N1574 VanDerWaalsContact C-N 3.33Å; L1572-N1574 PolarHBondContact O-N 3.02Å; L1572-H1575 PolarHBondContact O-N 3.14Å; L1572-Y1576 HydrophobicContact CD2-CE2 4.31Å; L1572-Y1576 VanDerWaalsContact O-CD2 3.25Å; L1572-Y1576 WeakPolarHBondContact O-CD2 3.04Å; L1572-Y1576 PolarHBondContact O-N 3.07Å; L1572-Y1576 VanDerWaalsContact O-N 3.11Å; L1572-V1585 HydrophobicContact CB-CG1 4.31Å; L1572-L1589 HydrophobicContact CD1-CD1 4.07Å; L1572-L1589 HydrophobicContact CD1-CD2 3.88Å; L1572-Y1626 HydrophobicContact CD1-CD2 4.04Å
1573	C	87.8	Confident	86.2	Confident	10 Å²	10	53.2 Å²	53.2	7%	0.068	31%	0.307	C	S	.	.	H	α-helix	trans	-60	-42	176.9	-73.5	0	0	0	0	112.2	E1569 T1570 C1577	E1569-C1573 WeakPolarHBondContact O-CB 3.46Å; E1569-C1573 PolarHBondContact O-N 3.29Å; E1569-C1573 PolarHBondContact O-SG 3.41Å; T1570-C1573 PolarHBondContact O-N 3.3Å; C1573-C1577 VanDerWaalsContact O-CB 3.32Å; C1573-C1577 WeakPolarHBondContact O-CB 3.08Å; C1573-C1577 PolarHBondContact O-N 2.76Å; C1573-C1577 VanDerWaalsContact O-N 3.14Å
1574	N	85.6	Confident	86.1	Confident	108 Å²	108	49.6 Å²	49.6	58%	0.578	28%	0.284	S	S	*	.	H	α-helix	trans	-67.9	-40.6	176.8	-72.8	-27.8	0	0	0	112.1	T1570 L1572 Y1576 C1577	T1570-N1574 VanDerWaalsContact O-CB 3.24Å; T1570-N1574 WeakPolarHBondContact O-CB 3.24Å; T1570-N1574 PolarHBondContact O-N 3.5Å; T1570-N1574 PolarHBondContact O-ND2 3.13Å; T1570-N1574 VanDerWaalsContact O-ND2 3.07Å; L1572-N1574 VanDerWaalsContact C-N 3.33Å; L1572-N1574 PolarHBondContact O-N 3.02Å; N1574-Y1576 PolarHBondContact O-N 3.26Å; N1574-C1577 PolarHBondContact O-N 3.37Å; N1574-C1577 PolarHBondContact O-SG 3.19Å
1575	H	88.6	Confident	86.1	Confident	95 Å²	95	46 Å²	46	44%	0.44	27%	0.265	S	S	.	.	H	α-helix	trans	-64.7	-39.8	-179.7	-175.4	64.1	0	0	0	112.4	D1571 L1572	D1571-H1575 WeakPolarHBondContact O-CB 3.29Å; D1571-H1575 PolarHBondContact O-N 3.23Å; L1572-H1575 PolarHBondContact O-N 3.14Å
1576	Y	88	Confident	86.1	Confident	32 Å²	32	45.9 Å²	45.9	13%	0.125	26%	0.256	C	S	.	.	H	α-helix	trans	-91.1	-0.2	179.1	-64.4	-69	0	0	0	114.5	G1556 I1557 R1560 L1572 N1574 S1578 F1579 L1580	G1556-Y1576 PolarHBondContact O-OH 2.92Å; I1557-Y1576 HydrophobicContact CB-CE2 4.37Å; I1557-Y1576 HydrophobicContact CG1-CD2 3.99Å; I1557-Y1576 HydrophobicContact CG1-CE2 3.65Å; R1560-Y1576 VanDerWaalsContact CB-OH 3.28Å; R1560-Y1576 WeakPolarHBondContact CB-OH 3.49Å; L1572-Y1576 HydrophobicContact CD2-CE2 4.31Å; L1572-Y1576 VanDerWaalsContact O-CD2 3.25Å; L1572-Y1576 WeakPolarHBondContact O-CD2 3.04Å; L1572-Y1576 PolarHBondContact O-N 3.07Å; L1572-Y1576 VanDerWaalsContact O-N 3.11Å; N1574-Y1576 PolarHBondContact O-N 3.26Å; Y1576-S1578 VanDerWaalsContact C-N 3.27Å; Y1576-S1578 PolarHBondContact O-N 3Å; Y1576-S1578 VanDerWaalsContact O-N 3.15Å; Y1576-F1579 CarbonylContact O-C 3.55Å; Y1576-F1579 WeakPolarHBondContact O-CA 3.38Å; Y1576-F1579 PolarHBondContact O-N 2.84Å; Y1576-L1580 PolarHBondContact O-N 2.8Å
1577	C	79.7	Confident	86.1	Confident	83 Å²	83	47.3 Å²	47.3	56%	0.561	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.2	-168.9	78.6	0	0	0	0	115.2	C1573 N1574 F1579 L1580	C1573-C1577 VanDerWaalsContact O-CB 3.32Å; C1573-C1577 WeakPolarHBondContact O-CB 3.08Å; C1573-C1577 PolarHBondContact O-N 2.76Å; C1573-C1577 VanDerWaalsContact O-N 3.14Å; N1574-C1577 PolarHBondContact O-N 3.37Å; N1574-C1577 PolarHBondContact O-SG 3.19Å; C1577-F1579 PolarHBondContact O-N 2.84Å; C1577-L1580 WeakPolarHBondContact CA-O 3.16Å
1578	S	74.6	Confident	86.1	Confident	86 Å²	86	46.7 Å²	46.7	60%	0.601	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.5	171.9	45.6	0	0	0	0	112.4	Y1576	Y1576-S1578 VanDerWaalsContact C-N 3.27Å; Y1576-S1578 PolarHBondContact O-N 3Å; Y1576-S1578 VanDerWaalsContact O-N 3.15Å
1579	F	79.6	Confident	86.2	Confident	129 Å²	129	44.7 Å²	44.7	57%	0.566	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-85.9	179.3	-42.4	-71.8	0	0	0	109.5	R1537 Y1576 C1577	R1537-F1579 PolarHBondContact NH1-O 2.87Å; R1537-F1579 PolarHBondContact NH2-O 3.47Å; Y1576-F1579 CarbonylContact O-C 3.55Å; Y1576-F1579 WeakPolarHBondContact O-CA 3.38Å; Y1576-F1579 PolarHBondContact O-N 2.84Å; C1577-F1579 PolarHBondContact O-N 2.84Å
1580	L	83.6	Confident	86.2	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.257	C	S	.	.	S	Bend	trans	-75.1	146.7	-175.3	-62.4	173.6	0	0	0	111.8	W1538 F1553 I1557 Y1576 C1577 Q1584 V1585 L1588	W1538-L1580 HydrophobicContact CZ3-CD2 4.32Å; F1553-L1580 HydrophobicContact CB-CD1 4.38Å; F1553-L1580 HydrophobicContact CD1-CD1 3.98Å; F1553-L1580 HydrophobicContact CD1-CD2 4.06Å; F1553-L1580 HydrophobicContact CD1-CG 4.21Å; F1553-L1580 HydrophobicContact CD2-CD2 4.23Å; F1553-L1580 HydrophobicContact CE1-CD2 4.03Å; F1553-L1580 HydrophobicContact CE1-CG 4.33Å; F1553-L1580 HydrophobicContact CE2-CD2 4.2Å; F1553-L1580 HydrophobicContact CG-CD1 4.24Å; F1553-L1580 HydrophobicContact CG-CD2 4.18Å; F1553-L1580 HydrophobicContact CZ-CD2 4.12Å; I1557-L1580 HydrophobicContact CD1-CD1 3.99Å; Y1576-L1580 PolarHBondContact O-N 2.8Å; C1577-L1580 WeakPolarHBondContact CA-O 3.16Å; L1580-Q1584 HydrophobicContact CB-CB 4.19Å; L1580-Q1584 HydrophobicContact CD2-CB 4.24Å; L1580-V1585 HydrophobicContact CB-CG2 3.71Å; L1580-V1585 HydrophobicContact CD1-CG2 4.18Å; L1580-L1588 HydrophobicContact CD1-CD1 3.91Å
1581	T	82.1	Confident	86.4	Confident	29 Å²	29	48 Å²	48	18%	0.178	25%	0.248	C	C	.	.			trans	-76.8	153.9	168.9	60.8	0	0	0	0	109.8	I1465 C1583 Q1584 V1585	I1465-T1581 HydrophobicContact CG2-CG2 3.91Å; I1465-T1581 WeakPolarHBondContact O-CB 3.12Å; T1581-C1583 PolarHBondContact O-N 3.39Å; T1581-Q1584 WeakPolarHBondContact O-CA 3.36Å; T1581-Q1584 WeakPolarHBondContact O-CB 3.43Å; T1581-Q1584 PolarHBondContact O-N 2.89Å; T1581-Q1584 WeakPolarHBondContact OG1-CG 3.44Å; T1581-Q1584 PolarHBondContact OG1-N 3.44Å; T1581-V1585 PolarHBondContact O-N 3.16Å
1582	S	83.8	Confident	86.5	Confident	32 Å²	32	44.3 Å²	44.3	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-55.4	-39.4	-178	-48.3	0	0	0	0	112.4	I1465 S1466 Q1584 V1585 K1586	I1465-S1582 PolarHBondContact O-N 3.5Å; S1466-S1582 WeakPolarHBondContact O-CB 3.3Å; S1582-Q1584 PolarHBondContact O-N 2.58Å; S1582-V1585 PolarHBondContact O-N 2.96Å; S1582-K1586 WeakPolarHBondContact O-CG 3.47Å; S1582-K1586 PolarHBondContact O-N 3.29Å
1583	C	83.5	Confident	86.6	Confident	7 Å²	7	46.4 Å²	46.4	5%	0.047	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-37.1	173.1	-63.4	0	0	0	0	113.2	G1464 I1465 K1467 T1581 V1585 K1586 E1587	G1464-C1583 VanDerWaalsContact C-SG 3.55Å; I1465-C1583 PolarHBondContact O-N 2.88Å; K1467-C1583 PolarHBondContact O-SG 2.79Å; T1581-C1583 PolarHBondContact O-N 3.39Å; C1583-V1585 VanDerWaalsContact C-N 3.33Å; C1583-K1586 PolarHBondContact O-N 3.4Å; C1583-E1587 WeakPolarHBondContact O-CB 3.03Å; C1583-E1587 WeakPolarHBondContact O-CG 3.34Å; C1583-E1587 PolarHBondContact O-N 2.97Å
1584	Q	87.3	Confident	86.6	Confident	9 Å²	9	51.4 Å²	51.4	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-35.2	172.8	-79	169.8	12.7	0	0	112	W1538 L1580 T1581 S1582 L1588	W1538-Q1584 HydrophobicContact CH2-CB 4.01Å; W1538-Q1584 HydrophobicContact CH2-CG 4.03Å; W1538-Q1584 HydrophobicContact CZ3-CB 4.27Å; W1538-Q1584 HydrophobicContact CZ3-CG 4.3Å; L1580-Q1584 HydrophobicContact CB-CB 4.19Å; L1580-Q1584 HydrophobicContact CD2-CB 4.24Å; T1581-Q1584 WeakPolarHBondContact O-CA 3.36Å; T1581-Q1584 WeakPolarHBondContact O-CB 3.43Å; T1581-Q1584 PolarHBondContact O-N 2.89Å; T1581-Q1584 WeakPolarHBondContact OG1-CG 3.44Å; T1581-Q1584 PolarHBondContact OG1-N 3.44Å; S1582-Q1584 PolarHBondContact O-N 2.58Å; Q1584-L1588 VanDerWaalsContact O-CG 3.29Å; Q1584-L1588 WeakPolarHBondContact O-CG 3.36Å; Q1584-L1588 PolarHBondContact O-N 3.42Å
1585	V	89.7	Confident	86.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68	-47.5	174.3	-179.3	0	0	0	0	110	I1557 L1572 L1580 T1581 S1582 C1583 E1587 L1588 L1589	I1557-V1585 HydrophobicContact CD1-CG1 4.37Å; L1572-V1585 HydrophobicContact CB-CG1 4.31Å; L1580-V1585 HydrophobicContact CB-CG2 3.71Å; L1580-V1585 HydrophobicContact CD1-CG2 4.18Å; T1581-V1585 PolarHBondContact O-N 3.16Å; S1582-V1585 PolarHBondContact O-N 2.96Å; C1583-V1585 VanDerWaalsContact C-N 3.33Å; V1585-E1587 VanDerWaalsContact C-N 3.35Å; V1585-E1587 PolarHBondContact O-N 3.25Å; V1585-L1588 PolarHBondContact O-N 3.44Å; V1585-L1589 HydrophobicContact CG1-CD1 3.81Å; V1585-L1589 HydrophobicContact CG1-CG 4.29Å; V1585-L1589 WeakPolarHBondContact O-CB 3.32Å; V1585-L1589 VanDerWaalsContact O-CG 3.28Å; V1585-L1589 WeakPolarHBondContact O-CG 3.21Å; V1585-L1589 PolarHBondContact O-N 3.16Å
1586	K	88.4	Confident	86.8	Confident	78 Å²	78	44.6 Å²	44.6	34%	0.339	24%	0.241	S	C	.	.	H	α-helix	trans	-59.9	-39	176	-67.9	-169.3	-169.8	-131.8	0	113.2	E1569 S1582 C1583 L1589 K1590	E1569-K1586 WeakPolarHBondContact OE1-CE 3.48Å; E1569-K1586 IonicContact OE1-NZ 3.38Å; E1569-K1586 PolarHBondContact OE1-NZ 2.92Å; S1582-K1586 WeakPolarHBondContact O-CG 3.47Å; S1582-K1586 PolarHBondContact O-N 3.29Å; C1583-K1586 PolarHBondContact O-N 3.4Å; K1586-L1589 PolarHBondContact O-N 3.35Å; K1586-K1590 WeakPolarHBondContact O-CB 3.22Å; K1586-K1590 PolarHBondContact O-N 2.87Å
1587	E	87.8	Confident	86.8	Confident	58 Å²	58	43.1 Å²	43.1	27%	0.271	24%	0.235	S	C	.	.	H	α-helix	trans	-62.6	-42.6	174.2	-79.7	174.9	-178.9	0	0	112.8	R1536 W1538 C1583 V1585 K1590 F1591	R1536-E1587 WeakPolarHBondContact CD-OE2 3.33Å; R1536-E1587 WeakPolarHBondContact CG-OE2 3.01Å; R1536-E1587 IonicContact CZ-OE1 2.81Å; R1536-E1587 IonicContact CZ-OE2 2.7Å; R1536-E1587 IonicContact NE-OE1 3.83Å; R1536-E1587 PolarHBondContact NE-OE1 2.94Å; R1536-E1587 IonicContact NE-OE2 3.9Å; R1536-E1587 PolarHBondContact NE-OE2 3.07Å; R1536-E1587 IonicContact NH2-OE1 2.73Å; R1536-E1587 PolarHBondContact NH2-OE1 3.1Å; W1538-E1587 HydrophobicContact CZ2-CB 4.45Å; W1538-E1587 WeakPolarHBondContact CZ2-OE2 3.5Å; C1583-E1587 WeakPolarHBondContact O-CB 3.03Å; C1583-E1587 WeakPolarHBondContact O-CG 3.34Å; C1583-E1587 PolarHBondContact O-N 2.97Å; V1585-E1587 VanDerWaalsContact C-N 3.35Å; V1585-E1587 PolarHBondContact O-N 3.25Å; E1587-K1590 PolarHBondContact O-N 2.75Å; E1587-F1591 WeakPolarHBondContact O-CB 3.5Å; E1587-F1591 PolarHBondContact O-N 3.44Å
1588	L	91.6	Very high	87.4	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-72.5	-33.8	178	-65	175.5	0	0	0	111.9	W1538 L1550 F1553 I1557 L1580 Q1584 V1585 F1591 L1592	W1538-L1588 HydrophobicContact CD2-CD2 4.31Å; W1538-L1588 HydrophobicContact CE3-CD1 4.36Å; W1538-L1588 HydrophobicContact CE3-CD2 4.17Å; W1538-L1588 HydrophobicContact CH2-CD1 3.92Å; W1538-L1588 HydrophobicContact CH2-CD2 3.65Å; W1538-L1588 HydrophobicContact CH2-CG 3.58Å; W1538-L1588 HydrophobicContact CZ2-CD2 3.78Å; W1538-L1588 HydrophobicContact CZ2-CG 4.15Å; W1538-L1588 HydrophobicContact CZ3-CD1 3.65Å; W1538-L1588 HydrophobicContact CZ3-CD2 3.86Å; W1538-L1588 HydrophobicContact CZ3-CG 3.84Å; L1550-L1588 HydrophobicContact CD1-CD2 3.62Å; F1553-L1588 HydrophobicContact CB-CD1 3.61Å; F1553-L1588 HydrophobicContact CG-CD1 4.49Å; I1557-L1588 HydrophobicContact CD1-CB 3.79Å; I1557-L1588 HydrophobicContact CD1-CD1 3.62Å; I1557-L1588 HydrophobicContact CD1-CG 4.37Å; L1580-L1588 HydrophobicContact CD1-CD1 3.91Å; Q1584-L1588 VanDerWaalsContact O-CG 3.29Å; Q1584-L1588 WeakPolarHBondContact O-CG 3.36Å; Q1584-L1588 PolarHBondContact O-N 3.42Å; V1585-L1588 PolarHBondContact O-N 3.44Å; L1588-F1591 PolarHBondContact O-N 3.38Å; L1588-L1592 WeakPolarHBondContact O-CB 3.39Å; L1588-L1592 VanDerWaalsContact O-CG 3.28Å; L1588-L1592 WeakPolarHBondContact O-CG 3.38Å; L1588-L1592 PolarHBondContact O-N 2.84Å
1589	L	92.5	Very high	88.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-44.9	171.2	-70.6	169.3	0	0	0	111.5	I1557 I1561 E1569 L1572 V1585 K1586 L1592 T1593 I1598 Y1626	I1557-L1589 HydrophobicContact CG2-CD2 3.64Å; I1557-L1589 HydrophobicContact CG2-CG 4.32Å; I1561-L1589 HydrophobicContact CD1-CD2 3.59Å; E1569-L1589 HydrophobicContact CG-CD1 4.32Å; L1572-L1589 HydrophobicContact CD1-CD1 4.07Å; L1572-L1589 HydrophobicContact CD1-CD2 3.88Å; V1585-L1589 HydrophobicContact CG1-CD1 3.81Å; V1585-L1589 HydrophobicContact CG1-CG 4.29Å; V1585-L1589 WeakPolarHBondContact O-CB 3.32Å; V1585-L1589 VanDerWaalsContact O-CG 3.28Å; V1585-L1589 WeakPolarHBondContact O-CG 3.21Å; V1585-L1589 PolarHBondContact O-N 3.16Å; K1586-L1589 PolarHBondContact O-N 3.35Å; L1589-L1592 PolarHBondContact O-N 3.49Å; L1589-T1593 WeakPolarHBondContact O-CB 3.35Å; L1589-T1593 PolarHBondContact O-N 3.38Å; L1589-T1593 PolarHBondContact O-OG1 3.34Å; L1589-I1598 HydrophobicContact CB-CD1 4.5Å; L1589-I1598 HydrophobicContact CD2-CD1 3.7Å; L1589-Y1626 HydrophobicContact CB-CE1 4.17Å; L1589-Y1626 HydrophobicContact CD1-CD2 4.27Å; L1589-Y1626 HydrophobicContact CD1-CE2 3.75Å; L1589-Y1626 HydrophobicContact CD2-CD1 4.35Å; L1589-Y1626 HydrophobicContact CD2-CD2 4.32Å; L1589-Y1626 HydrophobicContact CD2-CE1 4.42Å; L1589-Y1626 HydrophobicContact CD2-CE2 4.43Å; L1589-Y1626 HydrophobicContact CD2-CG 4.28Å
1590	K	89.2	Confident	88.7	Confident	102 Å²	102	40.9 Å²	40.9	44%	0.443	20%	0.203	S	C	.	.	H	α-helix	trans	-59.8	-48.4	172.9	-171.8	-178.2	175.7	-173.5	0	110.3	K1586 E1587 L1592 T1593 D1594	K1586-K1590 WeakPolarHBondContact O-CB 3.22Å; K1586-K1590 PolarHBondContact O-N 2.87Å; E1587-K1590 PolarHBondContact O-N 2.75Å; K1590-L1592 VanDerWaalsContact C-N 3.31Å; K1590-L1592 PolarHBondContact O-N 2.92Å; K1590-T1593 CarbonylContact O-C 3.45Å; K1590-T1593 WeakPolarHBondContact O-CA 3.44Å; K1590-T1593 WeakPolarHBondContact O-CB 3.49Å; K1590-T1593 PolarHBondContact O-N 2.9Å; K1590-D1594 WeakPolarHBondContact CE-OD1 3.43Å; K1590-D1594 VanDerWaalsContact CE-OD2 3.24Å; K1590-D1594 WeakPolarHBondContact CE-OD2 3.43Å; K1590-D1594 WeakPolarHBondContact O-CB 3.19Å; K1590-D1594 VanDerWaalsContact O-CG 3.23Å; K1590-D1594 PolarHBondContact O-N 3.09Å
1591	F	90.7	Very high	88.9	Confident	67 Å²	67	43.7 Å²	43.7	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-55.3	-42.7	175.8	174.6	-98.1	0	0	0	113	E1587 L1588 T1593 V1595 V1639 F1640	E1587-F1591 WeakPolarHBondContact O-CB 3.5Å; E1587-F1591 PolarHBondContact O-N 3.44Å; L1588-F1591 PolarHBondContact O-N 3.38Å; F1591-T1593 VanDerWaalsContact C-N 3.3Å; F1591-T1593 PolarHBondContact O-N 3.32Å; F1591-V1595 HydrophobicContact CE1-CG2 4.29Å; F1591-V1595 HydrophobicContact CE2-CG2 4.15Å; F1591-V1595 HydrophobicContact CZ-CG2 4.04Å; F1591-V1595 WeakPolarHBondContact O-CB 2.95Å; F1591-V1595 VanDerWaalsContact O-CG2 3.24Å; F1591-V1595 WeakPolarHBondContact O-CG2 3.38Å; F1591-V1595 PolarHBondContact O-N 3.39Å; F1591-V1639 HydrophobicContact CE1-CG1 4.32Å; F1591-V1639 HydrophobicContact CZ-CG1 3.8Å; F1591-F1640 HydrophobicContact CE1-CE2 4.11Å; F1591-F1640 AromaticContact CE1-CZ 3.77Å; F1591-F1640 HydrophobicContact CE1-CZ 3.77Å; F1591-F1640 HydrophobicContact CZ-CZ 4.23Å
1592	L	92.3	Very high	89.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-69.4	-25.7	175.4	-71.4	169.5	0	0	0	113.4	C1554 I1557 F1558 L1588 L1589 K1590 G1596 C1597 I1598 F1636	C1554-L1592 HydrophobicContact CB-CD2 4.39Å; I1557-L1592 HydrophobicContact CG2-CD1 4.19Å; F1558-L1592 HydrophobicContact CB-CD1 4.1Å; F1558-L1592 HydrophobicContact CB-CD2 4.44Å; L1588-L1592 WeakPolarHBondContact O-CB 3.39Å; L1588-L1592 VanDerWaalsContact O-CG 3.28Å; L1588-L1592 WeakPolarHBondContact O-CG 3.38Å; L1588-L1592 PolarHBondContact O-N 2.84Å; L1589-L1592 PolarHBondContact O-N 3.49Å; K1590-L1592 VanDerWaalsContact C-N 3.31Å; K1590-L1592 PolarHBondContact O-N 2.92Å; L1592-G1596 PolarHBondContact O-N 2.91Å; L1592-C1597 HydrophobicContact CD2-CB 4.33Å; L1592-C1597 WeakPolarHBondContact O-CB 3.33Å; L1592-C1597 PolarHBondContact O-N 3.43Å; L1592-I1598 HydrophobicContact CB-CD1 3.65Å; L1592-I1598 HydrophobicContact CB-CG1 3.84Å; L1592-I1598 HydrophobicContact CD1-CD1 4.42Å; L1592-I1598 PolarHBondContact O-N 2.79Å; L1592-F1636 HydrophobicContact CD2-CD2 3.78Å; L1592-F1636 HydrophobicContact CD2-CE2 3.85Å
1593	T	91.8	Very high	89.1	Confident	45 Å²	45	47.2 Å²	47.2	28%	0.276	24%	0.241	S	C	.	.	H	α-helix	trans	-79.4	-43.6	174.9	-49.5	0	0	0	0	110.9	L1589 K1590 F1591 V1595 G1596	L1589-T1593 WeakPolarHBondContact O-CB 3.35Å; L1589-T1593 PolarHBondContact O-N 3.38Å; L1589-T1593 PolarHBondContact O-OG1 3.34Å; K1590-T1593 CarbonylContact O-C 3.45Å; K1590-T1593 WeakPolarHBondContact O-CA 3.44Å; K1590-T1593 WeakPolarHBondContact O-CB 3.49Å; K1590-T1593 PolarHBondContact O-N 2.9Å; F1591-T1593 VanDerWaalsContact C-N 3.3Å; F1591-T1593 PolarHBondContact O-N 3.32Å; T1593-V1595 VanDerWaalsContact C-N 3.3Å; T1593-V1595 PolarHBondContact O-N 3.23Å; T1593-G1596 VanDerWaalsContact O-CA 3.29Å; T1593-G1596 WeakPolarHBondContact O-CA 3.37Å; T1593-G1596 PolarHBondContact O-N 3.41Å
1594	D	87.8	Confident	89	Confident	114 Å²	114	51.4 Å²	51.4	61%	0.61	27%	0.266	S	S	*	.	H	α-helix	trans	-64.5	-33.5	176.6	-65.1	-12	0	0	0	111.6	K1590	K1590-D1594 WeakPolarHBondContact CE-OD1 3.43Å; K1590-D1594 VanDerWaalsContact CE-OD2 3.24Å; K1590-D1594 WeakPolarHBondContact CE-OD2 3.43Å; K1590-D1594 WeakPolarHBondContact O-CB 3.19Å; K1590-D1594 VanDerWaalsContact O-CG 3.23Å; K1590-D1594 PolarHBondContact O-N 3.09Å
1595	V	88.3	Confident	88.6	Confident	40 Å²	40	56.6 Å²	56.6	24%	0.242	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.3	169.1	169	0	0	0	0	112.2	F1591 T1593 C1597 V1639	F1591-V1595 HydrophobicContact CE1-CG2 4.29Å; F1591-V1595 HydrophobicContact CE2-CG2 4.15Å; F1591-V1595 HydrophobicContact CZ-CG2 4.04Å; F1591-V1595 WeakPolarHBondContact O-CB 2.95Å; F1591-V1595 VanDerWaalsContact O-CG2 3.24Å; F1591-V1595 WeakPolarHBondContact O-CG2 3.38Å; F1591-V1595 PolarHBondContact O-N 3.39Å; T1593-V1595 VanDerWaalsContact C-N 3.3Å; T1593-V1595 PolarHBondContact O-N 3.23Å; V1595-C1597 VanDerWaalsContact CG1-SG 3.56Å; V1595-V1639 HydrophobicContact CG1-CB 4.38Å; V1595-V1639 HydrophobicContact CG1-CG2 3.58Å; V1595-V1639 HydrophobicContact CG2-CG1 4.38Å; V1595-V1639 HydrophobicContact CG2-CG2 4.11Å
1596	G	89.5	Confident	88.1	Confident	21 Å²	21	64.3 Å²	64.3	22%	0.216	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	25.8	-179.2	0	0	0	0	0	114.2	L1592 T1593 T1629 K1635	L1592-G1596 PolarHBondContact O-N 2.91Å; T1593-G1596 VanDerWaalsContact O-CA 3.29Å; T1593-G1596 WeakPolarHBondContact O-CA 3.37Å; T1593-G1596 PolarHBondContact O-N 3.41Å; G1596-T1629 WeakPolarHBondContact O-CG2 3.19Å; G1596-T1629 PolarHBondContact O-OG1 2.82Å; G1596-K1635 WeakPolarHBondContact O-CD 3.34Å; G1596-K1635 WeakPolarHBondContact O-CE 3.39Å; G1596-K1635 PolarHBondContact O-NZ 2.94Å
1597	C	89	Confident	87.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	-79.7	-33.1	172.3	-69.3	0	0	0	0	112.3	F1558 L1592 V1595 T1629 C1632 F1636	F1558-C1597 HydrophobicContact CD2-CB 4.48Å; F1558-C1597 HydrophobicContact CE2-CB 4.13Å; L1592-C1597 HydrophobicContact CD2-CB 4.33Å; L1592-C1597 WeakPolarHBondContact O-CB 3.33Å; L1592-C1597 PolarHBondContact O-N 3.43Å; V1595-C1597 VanDerWaalsContact CG1-SG 3.56Å; C1597-T1629 PolarHBondContact O-N 3.21Å; C1597-T1629 PolarHBondContact O-OG1 3.07Å; C1597-C1632 HydrophobicContact CB-CB 4.5Å; C1597-C1632 WeakPolarHBondContact O-CB 3.42Å; C1597-C1632 PolarHBondContact SG-O 3.01Å; C1597-F1636 PolarHBondContact SG-N 3.44Å; C1597-F1636 VanDerWaalsContact SG-N 3.35Å
1598	I	92.6	Very high	86.8	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.015	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.6	-179.8	66.1	-178.4	0	0	0	111	F1558 I1561 L1589 L1592 Y1626 M1627	F1558-I1598 HydrophobicContact CD2-CG2 3.96Å; F1558-I1598 HydrophobicContact CE2-CG2 4.17Å; I1561-I1598 HydrophobicContact CD1-CD1 3.71Å; I1561-I1598 HydrophobicContact CD1-CG2 4.07Å; I1561-I1598 HydrophobicContact CG2-CG2 4.08Å; L1589-I1598 HydrophobicContact CB-CD1 4.5Å; L1589-I1598 HydrophobicContact CD2-CD1 3.7Å; L1592-I1598 HydrophobicContact CB-CD1 3.65Å; L1592-I1598 HydrophobicContact CB-CG1 3.84Å; L1592-I1598 HydrophobicContact CD1-CD1 4.42Å; L1592-I1598 PolarHBondContact O-N 2.79Å; I1598-Y1626 HydrophobicContact CD1-CD1 3.59Å; I1598-Y1626 HydrophobicContact CD1-CE1 4.13Å; I1598-Y1626 HydrophobicContact CD1-CG 4.31Å; I1598-Y1626 HydrophobicContact CG1-CD1 4.13Å; I1598-M1627 CarbonylContact C-O 3.58Å; I1598-M1627 VanDerWaalsContact CA-O 3.25Å; I1598-M1627 WeakPolarHBondContact CA-O 3.29Å; I1598-M1627 WeakPolarHBondContact CB-O 3.5Å
1599	E	91.2	Very high	85.3	Confident	118 Å²	118	73.3 Å²	73.3	55%	0.551	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	146.8	169.9	-84.6	158.4	-147	0	0	110	Y1626 M1627 T1629	E1599-Y1626 WeakPolarHBondContact O-CA 3.24Å; E1599-M1627 HydrophobicContact CB-CB 4.46Å; E1599-M1627 PolarHBondContact N-O 3.14Å; E1599-M1627 PolarHBondContact O-N 3.24Å; E1599-T1629 HydrophobicContact CG-CG2 3.87Å; E1599-T1629 WeakPolarHBondContact OE1-CG2 3.49Å
1600	R	90.1	Very high	84.6	Confident	130 Å²	130	80.8 Å²	80.8	49%	0.491	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	105.4	178.6	-179.4	-175.1	171.4	-89.6	2.4	109.6	V1624 Y1626	R1600-V1624 HydrophobicContact CG-CG1 3.51Å; R1600-Y1626 HydrophobicContact CB-CD1 4.18Å; R1600-Y1626 HydrophobicContact CB-CE1 3.76Å; R1600-Y1626 HydrophobicContact CG-CE1 3.85Å
1601	T	88.2	Confident	83.5	Confident	61 Å²	61	80.3 Å²	80.3	37%	0.374	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	147.8	171.4	19.6	0	0	0	0	111.2	V1624 S1625	T1601-V1624 WeakPolarHBondContact O-CA 3.3Å; T1601-S1625 WeakPolarHBondContact CB-OG 3.49Å; T1601-S1625 PolarHBondContact N-O 3.19Å; T1601-S1625 PolarHBondContact O-N 3.26Å; T1601-S1625 PolarHBondContact OG1-O 3.27Å; T1601-S1625 PolarHBondContact OG1-OG 3.44Å
1602	V	86.3	Confident	82	Confident	66 Å²	66	84.8 Å²	84.8	40%	0.4	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.2	169.8	-174.7	0	0	0	0	108.1	E1622 C1623	V1602-E1622 HydrophobicContact CG1-CB 4.39Å; V1602-E1622 HydrophobicContact CG1-CG 4.24Å; V1602-C1623 WeakPolarHBondContact CA-O 3.33Å
1603	T	82.2	Confident	80.3	Confident	69 Å²	69	93.9 Å²	93.9	42%	0.423	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131	178.2	46.6	0	0	0	0	110.6	C1623	T1603-C1623 PolarHBondContact N-O 2.9Å; T1603-C1623 PolarHBondContact O-N 2.87Å
1604	V	81.9	Confident	79.2	Confident	95 Å²	95	93.6 Å²	93.6	58%	0.576	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	127.3	176.1	-172.6	0	0	0	0	108.9	P1620 E1622	V1604-P1620 HydrophobicContact CG1-CB 3.63Å; V1604-E1622 HydrophobicContact CG2-CG 3.84Å
1605	Y	80.2	Confident	78.6	Confident	117 Å²	117	91.6 Å²	91.6	46%	0.459	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	153.1	169.2	76.2	-98.9	0	0	0	112.7	P1607 V1621 C1623	Y1605-P1607 HydrophobicContact CE2-CB 4.02Å; Y1605-V1621 PolarHBondContact N-O 3.46Å; Y1605-V1621 PolarHBondContact O-N 3.5Å; Y1605-C1623 HydrophobicContact CD1-CB 4.44Å; Y1605-C1623 HydrophobicContact CE1-CB 4.06Å; Y1605-C1623 WeakPolarHBondContact CE1-SG 3.32Å
1606	R	79.1	Confident	78	Confident	163 Å²	163	92.7 Å²	92.7	62%	0.615	47%	0.472	S	S	*	.			trans	-95.2	113	174.6	-70.8	-179.8	-175.9	162.3	1.7	109.7	K1608 L1617 P1620	R1606-K1608 PolarHBondContact O-N 3.19Å; R1606-L1617 HydrophobicContact CB-CD2 4.03Å; R1606-P1620 HydrophobicContact CG-CB 4.11Å
1607	P	69.9	Low	77.3	Confident	43 Å²	43	97 Å²	97	28%	0.279	49%	0.489	S	S	.	.			trans	-69.2	132.1	-178.8	28.2	-32.1	0	0	0	110.3	Y1605 K1609 G1618 E1619 V1621	Y1605-P1607 HydrophobicContact CE2-CB 4.02Å; P1607-K1609 PolarHBondContact O-N 2.82Å; P1607-G1618 PolarHBondContact O-N 3.15Å; P1607-E1619 WeakPolarHBondContact CD-O 3.41Å; P1607-V1621 HydrophobicContact CG-CG2 3.97Å
1608	K	79	Confident	76.3	Confident	134 Å²	134	98.1 Å²	98.1	58%	0.583	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	111.6	174.1	-74.8	179.5	179.1	179.6	0	109.9	R1606 F1610 L1617	R1606-K1608 PolarHBondContact O-N 3.19Å; K1608-F1610 HydrophobicContact CB-CD2 4.45Å; K1608-F1610 HydrophobicContact CB-CE2 3.7Å; K1608-F1610 HydrophobicContact CB-CZ 3.82Å; K1608-F1610 HydrophobicContact CD-CZ 4.25Å; K1608-F1610 WeakPolarHBondContact O-CD2 3.43Å; K1608-F1610 WeakPolarHBondContact O-CE2 3.42Å; K1608-L1617 HydrophobicContact CG-CD2 3.75Å
1609	K	59.3	Low	75.5	Confident	151 Å²	151	106 Å²	106	66%	0.657	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	120.3	166.3	-85.2	-178.8	176.5	172.7	0	108.6	P1607 C1615 S1616	P1607-K1609 PolarHBondContact O-N 2.82Å; K1609-C1615 CarbonylContact O-C 3.56Å; K1609-C1615 WeakPolarHBondContact O-CA 3.38Å; K1609-S1616 PolarHBondContact N-O 3.48Å; K1609-S1616 PolarHBondContact O-N 2.83Å
1610	F	77.6	Confident	74.9	Confident	157 Å²	157	104 Å²	104	69%	0.689	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.9	171.4	-59.3	-89.4	0	0	0	109.1	K1608 C1615	K1608-F1610 HydrophobicContact CB-CD2 4.45Å; K1608-F1610 HydrophobicContact CB-CE2 3.7Å; K1608-F1610 HydrophobicContact CB-CZ 3.82Å; K1608-F1610 HydrophobicContact CD-CZ 4.25Å; K1608-F1610 WeakPolarHBondContact O-CD2 3.43Å; K1608-F1610 WeakPolarHBondContact O-CE2 3.42Å; F1610-C1615 HydrophobicContact CD1-CB 4.04Å; F1610-C1615 HydrophobicContact CE1-CB 4.15Å; F1610-C1615 VanDerWaalsContact CE1-SG 3.54Å
1611	T	66.3	Low	74	Confident	91 Å²	91	100.8 Å²	100.8	56%	0.558	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	170.9	160.8	71.5	0	0	0	0	108.3	F1613 G1614	T1611-F1613 PolarHBondContact O-N 2.55Å; T1611-F1613 PolarHBondContact OG1-N 2.83Å; T1611-G1614 PolarHBondContact N-O 2.83Å; T1611-G1614 PolarHBondContact O-N 2.86Å; T1611-G1614 PolarHBondContact OG1-N 2.89Å; T1611-G1614 PolarHBondContact OG1-O 2.73Å
1612	L	58.7	Low	73.6	Confident	162 Å²	162	104.8 Å²	104.8	85%	0.848	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-6.5	176.2	-149	113.4	0	0	0	113.5
1613	F	58.4	Low	73.4	Confident	192 Å²	192	102.4 Å²	102.4	84%	0.842	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.8	9.1	-174.2	-54	-69.1	0	0	0	113.7	T1611	T1611-F1613 PolarHBondContact O-N 2.55Å; T1611-F1613 PolarHBondContact OG1-N 2.83Å
1614	G	68.3	Low	73.6	Confident	39 Å²	39	100.2 Å²	100.2	40%	0.402	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.4	176.8	179.6	0	0	0	0	0	115.7	T1611	T1611-G1614 PolarHBondContact N-O 2.83Å; T1611-G1614 PolarHBondContact O-N 2.86Å; T1611-G1614 PolarHBondContact OG1-N 2.89Å; T1611-G1614 PolarHBondContact OG1-O 2.73Å
1615	C	74	Confident	74	Confident	71 Å²	71	96.3 Å²	96.3	48%	0.48	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	123.1	176.6	-172.8	0	0	0	0	109.8	K1609 F1610	K1609-C1615 CarbonylContact O-C 3.56Å; K1609-C1615 WeakPolarHBondContact O-CA 3.38Å; F1610-C1615 HydrophobicContact CD1-CB 4.04Å; F1610-C1615 HydrophobicContact CE1-CB 4.15Å; F1610-C1615 VanDerWaalsContact CE1-SG 3.54Å
1616	S	75.5	Confident	74.6	Confident	64 Å²	64	91.1 Å²	91.1	45%	0.448	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.7	172.5	55	0	0	0	0	110.9	K1609	K1609-S1616 PolarHBondContact N-O 3.48Å; K1609-S1616 PolarHBondContact O-N 2.83Å
1617	L	75.1	Confident	75.2	Confident	111 Å²	111	87.2 Å²	87.2	58%	0.581	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.2	171.4	-75.1	162.6	0	0	0	108.7	R1606 K1608	R1606-L1617 HydrophobicContact CB-CD2 4.03Å; K1608-L1617 HydrophobicContact CG-CD2 3.75Å
1618	G	68.1	Low	76.2	Confident	23 Å²	23	87 Å²	87	24%	0.237	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-76.8	171.2	167	0	0	0	0	0	112.3	P1607	P1607-G1618 PolarHBondContact O-N 3.15Å
1619	E	76.3	Confident	76.8	Confident	169 Å²	169	81.2 Å²	81.2	79%	0.79	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-56.7	149.1	173.3	-66.3	170.7	159.8	0	0	111.3	P1607 V1621	P1607-E1619 WeakPolarHBondContact CD-O 3.41Å; E1619-V1621 PolarHBondContact O-N 2.88Å
1620	P	77.6	Confident	78	Confident	75 Å²	75	82.6 Å²	82.6	49%	0.487	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-60.1	125.3	177.1	25.9	-33.4	0	0	0	110.7	V1604 R1606	V1604-P1620 HydrophobicContact CG1-CB 3.63Å; R1606-P1620 HydrophobicContact CG-CB 4.11Å
1621	V	72.7	Confident	78.5	Confident	63 Å²	63	79.8 Å²	79.8	38%	0.382	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.8	175.4	-179.4	0	0	0	0	108.1	Y1605 P1607 E1619	Y1605-V1621 PolarHBondContact N-O 3.46Å; Y1605-V1621 PolarHBondContact O-N 3.5Å; P1607-V1621 HydrophobicContact CG-CG2 3.97Å; E1619-V1621 PolarHBondContact O-N 2.88Å
1622	E	79.8	Confident	79.5	Confident	146 Å²	146	75.8 Å²	75.8	68%	0.682	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	131	166.2	-85.3	176.1	-154.8	0	0	110.5	V1602 V1604	V1602-E1622 HydrophobicContact CG1-CB 4.39Å; V1602-E1622 HydrophobicContact CG1-CG 4.24Å; V1604-E1622 HydrophobicContact CG2-CG 3.84Å
1623	C	81.1	Confident	80.9	Confident	16 Å²	16	72.3 Å²	72.3	11%	0.108	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.5	175.6	-74.6	0	0	0	0	110.4	L1568 V1602 T1603 Y1605	L1568-C1623 HydrophobicContact CD2-CB 4.16Å; V1602-C1623 WeakPolarHBondContact CA-O 3.33Å; T1603-C1623 PolarHBondContact N-O 2.9Å; T1603-C1623 PolarHBondContact O-N 2.87Å; Y1605-C1623 HydrophobicContact CD1-CB 4.44Å; Y1605-C1623 HydrophobicContact CE1-CB 4.06Å; Y1605-C1623 WeakPolarHBondContact CE1-SG 3.32Å
1624	V	87.6	Confident	82.3	Confident	23 Å²	23	67.3 Å²	67.3	14%	0.139	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.3	178.3	-176.9	0	0	0	0	108.3	L1568 E1569 R1600 T1601 Y1626	L1568-V1624 CarbonylContact C-O 3.5Å; L1568-V1624 WeakPolarHBondContact CA-O 3.45Å; E1569-V1624 HydrophobicContact CB-CB 3.92Å; E1569-V1624 HydrophobicContact CB-CG1 4.24Å; E1569-V1624 PolarHBondContact N-O 2.86Å; R1600-V1624 HydrophobicContact CG-CG1 3.51Å; T1601-V1624 WeakPolarHBondContact O-CA 3.3Å; V1624-Y1626 HydrophobicContact CG1-CD2 4.47Å; V1624-Y1626 HydrophobicContact CG1-CE2 3.76Å
1625	S	90.5	Very high	83.2	Confident	12 Å²	12	68.8 Å²	68.8	8%	0.084	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	151.9	173.2	59.9	0	0	0	0	111.2	G1566 V1567 T1601	G1566-S1625 VanDerWaalsContact O-CB 3.29Å; G1566-S1625 WeakPolarHBondContact O-CB 3.21Å; V1567-S1625 WeakPolarHBondContact O-CA 3.42Å; T1601-S1625 WeakPolarHBondContact CB-OG 3.49Å; T1601-S1625 PolarHBondContact N-O 3.19Å; T1601-S1625 PolarHBondContact O-N 3.26Å; T1601-S1625 PolarHBondContact OG1-O 3.27Å; T1601-S1625 PolarHBondContact OG1-OG 3.44Å
1626	Y	92.7	Very high	84	Confident	8 Å²	8	66 Å²	66	3%	0.031	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.6	179.2	-70.3	-88	0	0	0	112	I1561 G1566 V1567 E1569 L1572 L1589 I1598 E1599 R1600 V1624	I1561-Y1626 HydrophobicContact CD1-CG 4.47Å; G1566-Y1626 WeakPolarHBondContact CA-O 3.43Å; G1566-Y1626 PolarHBondContact N-O 3.11Å; V1567-Y1626 PolarHBondContact O-N 2.94Å; E1569-Y1626 HydrophobicContact CB-CD2 4.48Å; E1569-Y1626 HydrophobicContact CB-CE2 3.84Å; E1569-Y1626 HydrophobicContact CG-CE2 3.9Å; E1569-Y1626 PolarHBondContact OE2-OH 3.06Å; L1572-Y1626 HydrophobicContact CD1-CD2 4.04Å; L1589-Y1626 HydrophobicContact CB-CE1 4.17Å; L1589-Y1626 HydrophobicContact CD1-CD2 4.27Å; L1589-Y1626 HydrophobicContact CD1-CE2 3.75Å; L1589-Y1626 HydrophobicContact CD2-CD1 4.35Å; L1589-Y1626 HydrophobicContact CD2-CD2 4.32Å; L1589-Y1626 HydrophobicContact CD2-CE1 4.42Å; L1589-Y1626 HydrophobicContact CD2-CE2 4.43Å; L1589-Y1626 HydrophobicContact CD2-CG 4.28Å; I1598-Y1626 HydrophobicContact CD1-CD1 3.59Å; I1598-Y1626 HydrophobicContact CD1-CE1 4.13Å; I1598-Y1626 HydrophobicContact CD1-CG 4.31Å; I1598-Y1626 HydrophobicContact CG1-CD1 4.13Å; E1599-Y1626 WeakPolarHBondContact O-CA 3.24Å; R1600-Y1626 HydrophobicContact CB-CD1 4.18Å; R1600-Y1626 HydrophobicContact CB-CE1 3.76Å; R1600-Y1626 HydrophobicContact CG-CE1 3.85Å; V1624-Y1626 HydrophobicContact CG1-CD2 4.47Å; V1624-Y1626 HydrophobicContact CG1-CE2 3.76Å
1627	M	90.8	Very high	84.5	Confident	82 Å²	82	65.8 Å²	65.8	40%	0.404	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.1	-180	-66.4	-79.7	-95	0	0	109.3	P1565 G1566 I1598 E1599	P1565-M1627 HydrophobicContact CB-SD 4.17Å; G1566-M1627 PolarHBondContact N-SD 2.91Å; G1566-M1627 VanDerWaalsContact N-SD 3.4Å; I1598-M1627 CarbonylContact C-O 3.58Å; I1598-M1627 VanDerWaalsContact CA-O 3.25Å; I1598-M1627 WeakPolarHBondContact CA-O 3.29Å; I1598-M1627 WeakPolarHBondContact CB-O 3.5Å; E1599-M1627 HydrophobicContact CB-CB 4.46Å; E1599-M1627 PolarHBondContact N-O 3.14Å; E1599-M1627 PolarHBondContact O-N 3.24Å
1628	P	91.5	Very high	85.1	Confident	37 Å²	37	64.8 Å²	64.8	24%	0.24	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	135.5	171.5	30.7	-31.8	0	0	0	110.8	L1562 P1565 C1632	L1562-P1628 HydrophobicContact CD2-CB 3.74Å; L1562-P1628 HydrophobicContact CD2-CG 4.23Å; P1565-P1628 HydrophobicContact CB-CG 4.49Å; P1565-P1628 HydrophobicContact CG-CG 4.4Å; P1628-C1632 HydrophobicContact CB-CB 4.33Å
1629	T	90.5	Very high	86	Confident	13 Å²	13	66.5 Å²	66.5	8%	0.08	37%	0.37	C	S	.	.			trans	-70.6	160.7	172.7	67	0	0	0	0	111.5	G1596 C1597 E1599 D1631 C1632	G1596-T1629 WeakPolarHBondContact O-CG2 3.19Å; G1596-T1629 PolarHBondContact O-OG1 2.82Å; C1597-T1629 PolarHBondContact O-N 3.21Å; C1597-T1629 PolarHBondContact O-OG1 3.07Å; E1599-T1629 HydrophobicContact CG-CG2 3.87Å; E1599-T1629 WeakPolarHBondContact OE1-CG2 3.49Å; T1629-D1631 PolarHBondContact O-N 3.21Å; T1629-C1632 WeakPolarHBondContact O-CB 3.29Å; T1629-C1632 PolarHBondContact O-N 3.05Å; T1629-C1632 VanDerWaalsContact O-N 3.1Å; T1629-C1632 PolarHBondContact O-SG 3.21Å; T1629-C1632 WeakPolarHBondContact OG1-CA 3.47Å; T1629-C1632 PolarHBondContact OG1-N 3.49Å
1630	L	86.1	Confident	86.5	Confident	181 Å²	181	58.8 Å²	58.8	95%	0.948	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-49.7	177.5	-73.4	162.7	0	0	0	112.7	C1632	L1630-C1632 VanDerWaalsContact C-N 3.29Å; L1630-C1632 PolarHBondContact O-N 2.79Å
1631	D	86.7	Confident	86.8	Confident	97 Å²	97	62.7 Å²	62.7	52%	0.519	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	24.1	179.6	-61.1	-58.3	0	0	0	113.8	T1629 V1633 T1634 K1635	T1629-D1631 PolarHBondContact O-N 3.21Å; D1631-V1633 PolarHBondContact O-N 2.83Å; D1631-T1634 PolarHBondContact O-N 3.15Å; D1631-T1634 PolarHBondContact O-OG1 3.35Å; D1631-K1635 HydrophobicContact CB-CD 4.32Å; D1631-K1635 HydrophobicContact CB-CG 4.43Å; D1631-K1635 WeakPolarHBondContact O-CB 3.2Å; D1631-K1635 VanDerWaalsContact O-CG 3.32Å; D1631-K1635 WeakPolarHBondContact O-CG 3.46Å; D1631-K1635 PolarHBondContact O-N 2.94Å; D1631-K1635 VanDerWaalsContact O-N 3.1Å
1632	C	88.6	Confident	87.2	Confident	8 Å²	8	63.4 Å²	63.4	5%	0.054	37%	0.366	C	S	.	.	H	α-helix	trans	-61	-42	-170.1	59.2	0	0	0	0	114	F1558 C1597 P1628 T1629 L1630 F1636	F1558-C1632 HydrophobicContact CE2-CB 3.7Å; F1558-C1632 HydrophobicContact CZ-CB 3.58Å; C1597-C1632 HydrophobicContact CB-CB 4.5Å; C1597-C1632 WeakPolarHBondContact O-CB 3.42Å; C1597-C1632 PolarHBondContact SG-O 3.01Å; P1628-C1632 HydrophobicContact CB-CB 4.33Å; T1629-C1632 WeakPolarHBondContact O-CB 3.29Å; T1629-C1632 PolarHBondContact O-N 3.05Å; T1629-C1632 VanDerWaalsContact O-N 3.1Å; T1629-C1632 PolarHBondContact O-SG 3.21Å; T1629-C1632 WeakPolarHBondContact OG1-CA 3.47Å; T1629-C1632 PolarHBondContact OG1-N 3.49Å; L1630-C1632 VanDerWaalsContact C-N 3.29Å; L1630-C1632 PolarHBondContact O-N 2.79Å; C1632-F1636 WeakPolarHBondContact O-CB 3.19Å; C1632-F1636 PolarHBondContact O-N 2.91Å
1633	V	87.3	Confident	87.2	Confident	89 Å²	89	57.6 Å²	57.6	54%	0.539	34%	0.339	S	S	.	.	H	α-helix	trans	-72.3	-37.7	-175.9	-177.4	0	0	0	0	111.5	F1558 L1562 D1631 A1637	F1558-V1633 HydrophobicContact CE1-CG2 4.41Å; F1558-V1633 HydrophobicContact CZ-CG2 4.29Å; L1562-V1633 HydrophobicContact CD1-CG2 4.35Å; D1631-V1633 PolarHBondContact O-N 2.83Å; V1633-A1637 WeakPolarHBondContact O-CB 3.42Å; V1633-A1637 PolarHBondContact O-N 3.2Å
1634	T	86.7	Confident	86.9	Confident	86 Å²	86	61.1 Å²	61.1	53%	0.528	36%	0.362	S	S	.	.	H	α-helix	trans	-69.8	-45.2	178	48.7	0	0	0	0	110.9	D1631 F1636 A1637 T1638	D1631-T1634 PolarHBondContact O-N 3.15Å; D1631-T1634 PolarHBondContact O-OG1 3.35Å; T1634-F1636 PolarHBondContact O-N 3.29Å; T1634-A1637 PolarHBondContact O-N 3.4Å; T1634-T1638 WeakPolarHBondContact O-CG2 3.37Å; T1634-T1638 PolarHBondContact O-N 3.08Å; T1634-T1638 PolarHBondContact O-OG1 3.41Å
1635	K	88.6	Confident	86.2	Confident	70 Å²	70	62.2 Å²	62.2	30%	0.304	37%	0.367	S	S	.	.	H	α-helix	trans	-58.1	-46.5	172.6	-68.7	169.7	-177.3	164.7	0	111.9	G1596 D1631 A1637 T1638 V1639	G1596-K1635 WeakPolarHBondContact O-CD 3.34Å; G1596-K1635 WeakPolarHBondContact O-CE 3.39Å; G1596-K1635 PolarHBondContact O-NZ 2.94Å; D1631-K1635 HydrophobicContact CB-CD 4.32Å; D1631-K1635 HydrophobicContact CB-CG 4.43Å; D1631-K1635 WeakPolarHBondContact O-CB 3.2Å; D1631-K1635 VanDerWaalsContact O-CG 3.32Å; D1631-K1635 WeakPolarHBondContact O-CG 3.46Å; D1631-K1635 PolarHBondContact O-N 2.94Å; D1631-K1635 VanDerWaalsContact O-N 3.1Å; K1635-A1637 VanDerWaalsContact C-N 3.34Å; K1635-A1637 PolarHBondContact O-N 3.01Å; K1635-T1638 PolarHBondContact O-N 2.94Å; K1635-T1638 PolarHBondContact O-OG1 2.97Å; K1635-V1639 PolarHBondContact O-N 2.89Å
1636	F	90.7	Very high	85.1	Confident	14 Å²	14	62.9 Å²	62.9	6%	0.061	37%	0.371	C	S	.	.	H	α-helix	trans	-59.6	-44.1	176.9	-171.7	-79.9	0	0	0	111.9	C1554 E1555 F1558 L1592 C1597 C1632 T1634 V1639 F1640	C1554-F1636 HydrophobicContact CB-CE2 3.8Å; C1554-F1636 HydrophobicContact CB-CZ 4.03Å; E1555-F1636 VanDerWaalsContact CA-CZ 3.45Å; E1555-F1636 HydrophobicContact CB-CE1 4.14Å; E1555-F1636 HydrophobicContact CB-CZ 3.67Å; E1555-F1636 HydrophobicContact CG-CE1 4.02Å; E1555-F1636 HydrophobicContact CG-CZ 4.05Å; F1558-F1636 HydrophobicContact CB-CD2 4.1Å; F1558-F1636 HydrophobicContact CB-CE2 3.92Å; F1558-F1636 HydrophobicContact CD1-CB 4.08Å; F1558-F1636 HydrophobicContact CD1-CD1 4.31Å; F1558-F1636 AromaticContact CD1-CD2 3.34Å; F1558-F1636 HydrophobicContact CD1-CD2 3.34Å; F1558-F1636 AromaticContact CD1-CE2 3.82Å; F1558-F1636 HydrophobicContact CD1-CE2 3.82Å; F1558-F1636 AromaticContact CD1-CG 3.64Å; F1558-F1636 HydrophobicContact CD1-CG 3.64Å; F1558-F1636 HydrophobicContact CE1-CB 3.67Å; F1558-F1636 AromaticContact CE1-CD2 3.87Å; F1558-F1636 HydrophobicContact CE1-CD2 3.87Å; F1558-F1636 AromaticContact CE1-CG 3.76Å; F1558-F1636 HydrophobicContact CE1-CG 3.76Å; F1558-F1636 AromaticContact CG-CD2 3.77Å; F1558-F1636 HydrophobicContact CG-CD2 3.77Å; F1558-F1636 HydrophobicContact CG-CE2 4.09Å; F1558-F1636 HydrophobicContact CG-CG 4.48Å; F1558-F1636 HydrophobicContact CZ-CB 4.27Å; L1592-F1636 HydrophobicContact CD2-CD2 3.78Å; L1592-F1636 HydrophobicContact CD2-CE2 3.85Å; C1597-F1636 PolarHBondContact SG-N 3.44Å; C1597-F1636 VanDerWaalsContact SG-N 3.35Å; C1632-F1636 WeakPolarHBondContact O-CB 3.19Å; C1632-F1636 PolarHBondContact O-N 2.91Å; T1634-F1636 PolarHBondContact O-N 3.29Å; F1636-V1639 PolarHBondContact O-N 2.65Å; F1636-F1640 HydrophobicContact CD1-CD2 4.09Å; F1636-F1640 HydrophobicContact CD2-CD2 4.41Å; F1636-F1640 HydrophobicContact CD2-CE2 4.41Å; F1636-F1640 AromaticContact CE1-CD2 3.63Å; F1636-F1640 HydrophobicContact CE1-CD2 3.63Å; F1636-F1640 HydrophobicContact CE1-CE2 4.26Å; F1636-F1640 HydrophobicContact CE1-CG 4.48Å; F1636-F1640 HydrophobicContact CE2-CD2 4.01Å; F1636-F1640 AromaticContact CE2-CE2 3.83Å; F1636-F1640 HydrophobicContact CE2-CE2 3.83Å; F1636-F1640 HydrophobicContact CG-CD2 4.43Å; F1636-F1640 AromaticContact CZ-CD2 3.56Å; F1636-F1640 HydrophobicContact CZ-CD2 3.56Å; F1636-F1640 AromaticContact CZ-CE2 3.7Å; F1636-F1640 HydrophobicContact CZ-CE2 3.7Å; F1636-F1640 PolarHBondContact O-N 2.98Å
1637	A	86.2	Confident	83.3	Confident	58 Å²	58	67.5 Å²	67.5	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-63.4	-42.1	179.7	0	0	0	0	0	112.6	V1633 T1634 K1635 F1640 E1641	V1633-A1637 WeakPolarHBondContact O-CB 3.42Å; V1633-A1637 PolarHBondContact O-N 3.2Å; T1634-A1637 PolarHBondContact O-N 3.4Å; K1635-A1637 VanDerWaalsContact C-N 3.34Å; K1635-A1637 PolarHBondContact O-N 3.01Å; A1637-F1640 CarbonylContact O-C 3.46Å; A1637-F1640 PolarHBondContact O-N 2.95Å; A1637-E1641 PolarHBondContact O-N 3.36Å
1638	T	87.5	Confident	81.6	Confident	91 Å²	91	64.8 Å²	64.8	56%	0.558	39%	0.386	S	S	*	.	H	α-helix	trans	-66.2	-40.6	178	58.3	0	0	0	0	112.9	T1634 K1635 F1640 E1641	T1634-T1638 WeakPolarHBondContact O-CG2 3.37Å; T1634-T1638 PolarHBondContact O-N 3.08Å; T1634-T1638 PolarHBondContact O-OG1 3.41Å; K1635-T1638 PolarHBondContact O-N 2.94Å; K1635-T1638 PolarHBondContact O-OG1 2.97Å; T1638-F1640 VanDerWaalsContact C-N 3.29Å; T1638-F1640 PolarHBondContact O-N 3.37Å; T1638-E1641 WeakPolarHBondContact O-CB 3.44Å; T1638-E1641 PolarHBondContact O-N 2.86Å
1639	V	85.8	Confident	79.6	Confident	59 Å²	59	64 Å²	64	36%	0.358	38%	0.38	S	S	.	.	H	α-helix	trans	-67.4	-28.4	179	167.9	0	0	0	0	113.2	F1591 V1595 K1635 F1636	F1591-V1639 HydrophobicContact CE1-CG1 4.32Å; F1591-V1639 HydrophobicContact CZ-CG1 3.8Å; V1595-V1639 HydrophobicContact CG1-CB 4.38Å; V1595-V1639 HydrophobicContact CG1-CG2 3.58Å; V1595-V1639 HydrophobicContact CG2-CG1 4.38Å; V1595-V1639 HydrophobicContact CG2-CG2 4.11Å; K1635-V1639 PolarHBondContact O-N 2.89Å; F1636-V1639 PolarHBondContact O-N 2.65Å
1640	F	87.6	Confident	77.4	Confident	7 Å²	7	70.9 Å²	70.9	3%	0.031	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	18	177.1	-68	-66.4	0	0	0	114.4	L1550 R1551 C1554 F1591 F1636 A1637 T1638 G1642 I1643	L1550-F1640 HydrophobicContact CD2-CE1 4.37Å; L1550-F1640 HydrophobicContact CG-CE1 4.11Å; L1550-F1640 HydrophobicContact CG-CZ 4.23Å; R1551-F1640 HydrophobicContact CB-CD1 3.55Å; R1551-F1640 HydrophobicContact CB-CE1 3.82Å; R1551-F1640 HydrophobicContact CB-CG 4.05Å; R1551-F1640 HydrophobicContact CG-CB 4.01Å; R1551-F1640 HydrophobicContact CG-CD1 3.87Å; R1551-F1640 HydrophobicContact CG-CD2 4.4Å; R1551-F1640 HydrophobicContact CG-CE1 4.46Å; R1551-F1640 HydrophobicContact CG-CG 3.83Å; C1554-F1640 HydrophobicContact CB-CE2 3.74Å; C1554-F1640 HydrophobicContact CB-CZ 3.82Å; F1591-F1640 HydrophobicContact CE1-CE2 4.11Å; F1591-F1640 AromaticContact CE1-CZ 3.77Å; F1591-F1640 HydrophobicContact CE1-CZ 3.77Å; F1591-F1640 HydrophobicContact CZ-CZ 4.23Å; F1636-F1640 HydrophobicContact CD1-CD2 4.09Å; F1636-F1640 HydrophobicContact CD2-CD2 4.41Å; F1636-F1640 HydrophobicContact CD2-CE2 4.41Å; F1636-F1640 AromaticContact CE1-CD2 3.63Å; F1636-F1640 HydrophobicContact CE1-CD2 3.63Å; F1636-F1640 HydrophobicContact CE1-CE2 4.26Å; F1636-F1640 HydrophobicContact CE1-CG 4.48Å; F1636-F1640 HydrophobicContact CE2-CD2 4.01Å; F1636-F1640 AromaticContact CE2-CE2 3.83Å; F1636-F1640 HydrophobicContact CE2-CE2 3.83Å; F1636-F1640 HydrophobicContact CG-CD2 4.43Å; F1636-F1640 AromaticContact CZ-CD2 3.56Å; F1636-F1640 HydrophobicContact CZ-CD2 3.56Å; F1636-F1640 AromaticContact CZ-CE2 3.7Å; F1636-F1640 HydrophobicContact CZ-CE2 3.7Å; F1636-F1640 PolarHBondContact O-N 2.98Å; A1637-F1640 CarbonylContact O-C 3.46Å; A1637-F1640 PolarHBondContact O-N 2.95Å; T1638-F1640 VanDerWaalsContact C-N 3.29Å; T1638-F1640 PolarHBondContact O-N 3.37Å; F1640-G1642 PolarHBondContact O-N 2.95Å; F1640-I1643 HydrophobicContact CD1-CD1 4.06Å; F1640-I1643 PolarHBondContact O-N 3.43Å
1641	E	83.7	Confident	75	Confident	156 Å²	156	68.4 Å²	68.4	73%	0.729	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	136.4	179.2	-167.5	174.7	179.7	0	0	111.6	A1637 T1638 I1643	A1637-E1641 PolarHBondContact O-N 3.36Å; T1638-E1641 WeakPolarHBondContact O-CB 3.44Å; T1638-E1641 PolarHBondContact O-N 2.86Å; E1641-I1643 PolarHBondContact O-N 3.49Å
1642	G	80.7	Confident	74.5	Confident	79 Å²	79	67 Å²	67	81%	0.814	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	-2	-177.9	0	0	0	0	0	115.9	F1640 P1644	F1640-G1642 PolarHBondContact O-N 2.95Å; G1642-P1644 WeakPolarHBondContact O-CD 3.48Å
1643	I	80.9	Confident	73.7	Confident	23 Å²	23	70.1 Å²	70.1	12%	0.118	42%	0.421	C	S	.	.			trans	-92.9	111.2	177.5	-64	165.7	0	0	0	109	R1547 R1551 F1640 E1641	R1547-I1643 HydrophobicContact CB-CD1 4.07Å; R1547-I1643 HydrophobicContact CB-CG1 4.26Å; R1547-I1643 HydrophobicContact CB-CG2 3.86Å; R1547-I1643 HydrophobicContact CG-CD1 4.38Å; R1551-I1643 HydrophobicContact CB-CG2 4.12Å; R1551-I1643 VanDerWaalsContact CD-O 3.25Å; R1551-I1643 WeakPolarHBondContact CD-O 3.33Å; R1551-I1643 PolarHBondContact NH1-O 3.24Å; F1640-I1643 HydrophobicContact CD1-CD1 4.06Å; F1640-I1643 PolarHBondContact O-N 3.43Å; E1641-I1643 PolarHBondContact O-N 3.49Å
1644	P	75.3	Confident	73	Confident	90 Å²	90	69 Å²	69	58%	0.584	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-70.8	157.4	174.5	31.1	-35.3	0	0	0	111	P1548 G1642	P1548-P1644 WeakPolarHBondContact CA-O 3.5Å; P1548-P1644 WeakPolarHBondContact CB-O 3.42Å; P1548-P1644 WeakPolarHBondContact CG-O 3.23Å; G1642-P1644 WeakPolarHBondContact O-CD 3.48Å
1645	L	72.3	Confident	72.1	Confident	47 Å²	47	68 Å²	68	25%	0.246	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-70.5	164.2	168.3	-79.2	162.4	0	0	0	111.5	R1551 W1552 E1555 E1647 V1651	R1551-L1645 HydrophobicContact CG-CD2 4.29Å; W1552-L1645 HydrophobicContact CB-CD2 3.79Å; W1552-L1645 HydrophobicContact CG-CD2 4.35Å; E1555-L1645 WeakPolarHBondContact OE2-CD2 3.45Å; L1645-E1647 PolarHBondContact O-N 2.88Å; L1645-V1651 HydrophobicContact CD1-CG2 3.65Å; L1645-V1651 HydrophobicContact CD2-CG2 4.12Å
1646	P	66.1	Low	71.1	Confident	25 Å²	25	67.9 Å²	67.9	16%	0.162	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-62.6	132	175.5	-17.5	31.6	0	0	0	110.9	P1548 L1549 W1552 G1648 V1649	P1548-P1646 HydrophobicContact CB-CG 4.23Å; P1548-P1646 WeakPolarHBondContact O-CD 3.03Å; L1549-P1646 HydrophobicContact CB-CG 4.44Å; L1549-P1646 HydrophobicContact CG-CG 4.13Å; W1552-P1646 HydrophobicContact CB-CG 4.06Å; W1552-P1646 HydrophobicContact CE3-CG 4.34Å; W1552-P1646 HydrophobicContact CG-CG 4.47Å; P1646-G1648 PolarHBondContact O-N 2.98Å; P1646-V1649 HydrophobicContact CB-CB 4.49Å; P1646-V1649 HydrophobicContact CB-CG2 3.84Å; P1646-V1649 HydrophobicContact CG-CG2 4.08Å; P1646-V1649 WeakPolarHBondContact O-CB 3.45Å; P1646-V1649 PolarHBondContact O-N 2.8Å
1647	E	56.3	Low	69.8	Low	106 Å²	106	71.5 Å²	71.5	50%	0.495	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	99.2	-174.8	-67.6	161.9	149.2	0	0	112	E1507 G1508 E1509 E1510 L1645	E1507-E1647 CarbonylContact C-O 3.36Å; G1508-E1647 PolarHBondContact N-O 3.2Å; E1509-E1647 HydrophobicContact CB-CB 3.8Å; E1509-E1647 PolarHBondContact N-O 2.62Å; E1509-E1647 VanDerWaalsContact N-O 3.07Å; E1510-E1647 WeakPolarHBondContact CA-OE1 3.45Å; E1510-E1647 HydrophobicContact CB-CG 4.12Å; E1510-E1647 VanDerWaalsContact CB-OE1 3.22Å; E1510-E1647 WeakPolarHBondContact CB-OE1 3.22Å; L1645-E1647 PolarHBondContact O-N 2.88Å
1648	G	55.2	Low	68.6	Low	24 Å²	24	72.4 Å²	72.4	25%	0.247	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	116.3	-5.9	-177.4	0	0	0	0	0	115.3	P1646 N1650	P1646-G1648 PolarHBondContact O-N 2.98Å; G1648-N1650 PolarHBondContact O-N 3.42Å
1649	V	48.4	Very low	67.2	Low	20 Å²	20	71 Å²	71	12%	0.121	43%	0.426	C	S	.	.			trans	-79.3	113.8	167.1	171.3	0	0	0	0	109	E1506 W1552 P1646 V1651	E1506-V1649 HydrophobicContact CG-CG2 4.37Å; W1552-V1649 HydrophobicContact CD2-CG1 4.14Å; W1552-V1649 HydrophobicContact CD2-CG2 4.18Å; W1552-V1649 HydrophobicContact CE3-CG2 4.42Å; W1552-V1649 HydrophobicContact CG-CG1 4.06Å; W1552-V1649 HydrophobicContact CH2-CG2 4.43Å; W1552-V1649 HydrophobicContact CZ2-CG1 4.3Å; W1552-V1649 HydrophobicContact CZ2-CG2 4.21Å; W1552-V1649 VanDerWaalsContact NE1-CG1 3.29Å; P1646-V1649 HydrophobicContact CB-CB 4.49Å; P1646-V1649 HydrophobicContact CB-CG2 3.84Å; P1646-V1649 HydrophobicContact CG-CG2 4.08Å; P1646-V1649 WeakPolarHBondContact O-CB 3.45Å; P1646-V1649 PolarHBondContact O-N 2.8Å; V1649-V1651 HydrophobicContact CG1-CG2 4.06Å
1650	N	43.9	Very low	65.6	Low	158 Å²	158	72 Å²	72	85%	0.845	43%	0.431	S	S	*	.			trans	-82.3	136.2	153.2	-75.8	-60.9	0	0	0	108.1	G1648	G1648-N1650 PolarHBondContact O-N 3.42Å
1651	V	37.2	Very low	63.6	Low	129 Å²	129	77.9 Å²	77.9	78%	0.782	47%	0.468	S	S	*	.			trans	-97.6	0	168.9	176.8	0	0	0	0	108.2	L1645 V1649	L1645-V1651 HydrophobicContact CD1-CG2 3.65Å; L1645-V1651 HydrophobicContact CD2-CG2 4.12Å; V1649-V1651 HydrophobicContact CG1-CG2 4.06Å

Retrieved 1,651 of 1,651 residues in 1167.8 ms (Link to these results)

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