A0A087XE00_POEFO Loading...

Tudor domain containing 7 b

AlphaFold DB , UniProt , Accession A0A087XE00, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,113 aa.

						>A0A087XE00_POEFO|A0A087XE00
MTEVELVKRTLHAIVQANRGGVSLSRLQSDYKELTGDQIPHREMGHVQVEALLASTSSVRMERGGSGEMVYFSAGAKEAAHTAKVVARQRSSKRTGRHHLVNTQMRVKPAVPLVLNAKPQTSLRQPNHRGRGRGAGAGRGAGHGDFRQTRDLRDVLSEARSGVHPYRLSSQHKAYKRGNLPAERPDKRMILPTRFQKEMQAHLSRNPQQTGPPVNLNESFGPGRGNPYNPQQVQSRIREILAKYSNGFWVSKLPQIYRELYKQDLPSEAIKDLEAWTHICIVEKTCGSNSSELLLYPATELSNSPSPSQTGNNSTSSPAEVSRVQKRPHINPLARSSSPAALSPDLKQRLEELLMKYSSGLWAHALPKLFQDTYKIKLPGYVLENLELLSDICTINYPMSDNPQRAILYRRSSVGGEDENCNRRSSSASEEELSVRTEMGRSLSNHEVPTLQIPKEEYPSVLVMEATNTNSVILRYIGEGYSVAQDSMEDEMREFYGSDKSQQAPLSSTSSGQFVAARAEEEEEILRAQICEVMSDKVKVYYVDHGFSEVISKSKVLELHEKFFKLPFQATKCKLAGLEPFCQEPAVLKTFEAMASGRILLAEILERGPVPLVVLYDTSQDDDVNINAACMKSLQDKTLASPLQVNSAYMNVTVSSVCSDGTIYCQLPSRGLAKLNEILEKIENYFHTQVTSEFLVSRPFCGKQCLARYKGKWSRVEITNLHGSRVLDILFVDVGVQASVEVFELREIPPLFLRDLVSIPPQAVKCCLADLAVSVGSWSSDAVQWLREKVLNTPDCSMKVAKMDETKHCVCVHLFTDKNFHDPARSLNHQMAQSDLFKQQPDVFLISHSPTKVSTNPFSSKTSSSSSDSTGGSPTSASVPAKPHPRRTQSGPKGGGHAASTSPPGAPSSPPALLQLPPLLELPQIGHNMDVYVSVACHPGHFVLQPWRDMYKLVVLMGEMILSYSKTEEKPFKVEKNQIYAAKIENNWHRVLVKGVLTNGLVSVYELDYGKHELVSCSQLRTLSKKFRQLPFQGIHAQLAGVKQRLWSEEASIVFRNHVEKKPLVAQLEAMQDADNPWDRKLSVFLVDTSHEEHDVWIHDIMAEFADEQSNEL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.1	Very low	75	Confident	160 Å²	160	80.5 Å²	80.5	79%	0.788	40%	0.395	S	S	*	.				0	119	0	-153.4	-178.5	-53.1	0	0	105.4	E5 R9	M1-E5 WeakPolarHBondContact CA-OE2 3.43Å; M1-E5 HydrophobicContact CG-CB 4.11Å; M1-E5 WeakPolarHBondContact CG-OE2 3.36Å; M1-R9 VanDerWaalsContact SD-CZ 3.58Å; M1-R9 PolarHBondContact SD-NH1 3.29Å; M1-R9 VanDerWaalsContact SD-NH1 3.36Å
2	T	66.6	Low	75.5	Confident	84 Å²	84	77.7 Å²	77.7	52%	0.515	38%	0.38	S	S	.	.			trans	-76.3	153.1	-178.7	52.1	0	0	0	0	109.8	V4 E5 L6	T2-V4 PolarHBondContact O-N 2.73Å; T2-E5 WeakPolarHBondContact O-CB 3.35Å; T2-E5 PolarHBondContact O-N 3.23Å; T2-E5 PolarHBondContact OG1-N 3.03Å; T2-L6 PolarHBondContact O-N 3.03Å
3	E	70.4	Confident	75.7	Confident	159 Å²	159	75.4 Å²	75.4	74%	0.743	38%	0.382	S	S	*	.	H	α-helix	trans	-53	-38.2	174.4	-168.2	163.2	-151.5	0	0	111.3	E5 L6 V7	E3-E5 PolarHBondContact O-N 2.72Å; E3-L6 WeakPolarHBondContact O-CB 3.42Å; E3-L6 PolarHBondContact O-N 3.4Å; E3-L6 VanDerWaalsContact O-N 3.08Å; E3-V7 WeakPolarHBondContact O-CG2 3.42Å; E3-V7 PolarHBondContact O-N 2.98Å
4	V	73.7	Confident	76.2	Confident	69 Å²	69	70.8 Å²	70.8	42%	0.418	36%	0.358	S	S	.	.	H	α-helix	trans	-53	-43.5	170.6	-178	0	0	0	0	113.6	T2 K8 M44	T2-V4 PolarHBondContact O-N 2.73Å; V4-K8 WeakPolarHBondContact O-CG 3.38Å; V4-K8 PolarHBondContact O-N 2.72Å; V4-M44 HydrophobicContact CB-CE 4.18Å; V4-M44 HydrophobicContact CB-SD 4.05Å; V4-M44 HydrophobicContact CG1-CE 3.65Å; V4-M44 HydrophobicContact CG1-SD 4.04Å; V4-M44 HydrophobicContact CG2-SD 3.87Å
5	E	75.1	Confident	76.6	Confident	85 Å²	85	66.1 Å²	66.1	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-70.8	-35.3	176.7	-75.9	-172.7	134.2	0	0	112.1	M1 T2 E3 K8 R9	M1-E5 WeakPolarHBondContact CA-OE2 3.43Å; M1-E5 HydrophobicContact CG-CB 4.11Å; M1-E5 WeakPolarHBondContact CG-OE2 3.36Å; T2-E5 WeakPolarHBondContact O-CB 3.35Å; T2-E5 PolarHBondContact O-N 3.23Å; T2-E5 PolarHBondContact OG1-N 3.03Å; E3-E5 PolarHBondContact O-N 2.72Å; E5-K8 PolarHBondContact O-N 3.33Å; E5-R9 WeakPolarHBondContact O-CB 3.32Å; E5-R9 VanDerWaalsContact O-CG 3.28Å; E5-R9 WeakPolarHBondContact O-CG 3.47Å; E5-R9 PolarHBondContact O-N 3.47Å
6	L	79.3	Confident	76.7	Confident	102 Å²	102	68.8 Å²	68.8	53%	0.534	35%	0.346	S	S	.	.	H	α-helix	trans	-65.4	-48.8	178.6	-174.4	63.3	0	0	0	110.5	T2 E3 K8 R9 T10	T2-L6 PolarHBondContact O-N 3.03Å; E3-L6 WeakPolarHBondContact O-CB 3.42Å; E3-L6 PolarHBondContact O-N 3.4Å; E3-L6 VanDerWaalsContact O-N 3.08Å; L6-K8 VanDerWaalsContact C-N 3.31Å; L6-K8 PolarHBondContact O-N 3.35Å; L6-R9 PolarHBondContact O-N 2.8Å; L6-T10 PolarHBondContact O-N 2.81Å; L6-T10 PolarHBondContact O-OG1 3.13Å; L6-T10 VanDerWaalsContact O-OG1 3.11Å
7	V	82.6	Confident	76.5	Confident	6 Å²	6	69.6 Å²	69.6	4%	0.036	37%	0.366	C	S	.	.	H	α-helix	trans	-53.5	-48.6	174.1	176.8	0	0	0	0	110.6	E3 R9 T10 L11 Y31 P40 M44 L52	E3-V7 WeakPolarHBondContact O-CG2 3.42Å; E3-V7 PolarHBondContact O-N 2.98Å; V7-R9 PolarHBondContact O-N 2.68Å; V7-T10 PolarHBondContact O-N 3.02Å; V7-L11 HydrophobicContact CG1-CD1 3.92Å; V7-L11 VanDerWaalsContact O-CG 3.3Å; V7-L11 WeakPolarHBondContact O-CG 3.18Å; V7-L11 PolarHBondContact O-N 3.28Å; V7-Y31 HydrophobicContact CG1-CE2 4.31Å; V7-P40 HydrophobicContact CG1-CG 4.33Å; V7-P40 HydrophobicContact CG2-CG 3.84Å; V7-M44 HydrophobicContact CB-CE 3.97Å; V7-M44 HydrophobicContact CB-SD 4.35Å; V7-M44 HydrophobicContact CG1-CE 3.96Å; V7-M44 HydrophobicContact CG1-SD 4.5Å; V7-M44 HydrophobicContact CG2-SD 4.28Å; V7-L52 HydrophobicContact CG1-CD2 4.37Å
8	K	80.8	Confident	76.2	Confident	66 Å²	66	68.1 Å²	68.1	29%	0.287	36%	0.358	S	S	.	.	H	α-helix	trans	-64.6	-39.4	179.5	-73.7	-175.8	176.5	-168.4	0	113.1	V4 E5 L6 H12 M44 T56	V4-K8 WeakPolarHBondContact O-CG 3.38Å; V4-K8 PolarHBondContact O-N 2.72Å; E5-K8 PolarHBondContact O-N 3.33Å; L6-K8 VanDerWaalsContact C-N 3.31Å; L6-K8 PolarHBondContact O-N 3.35Å; K8-H12 WeakPolarHBondContact O-CB 3.22Å; K8-H12 PolarHBondContact O-N 3.34Å; K8-M44 HydrophobicContact CG-CE 4.35Å; K8-T56 HydrophobicContact CB-CG2 4.46Å; K8-T56 HydrophobicContact CD-CG2 4.38Å; K8-T56 HydrophobicContact CG-CG2 4.28Å
9	R	80.1	Confident	75.7	Confident	134 Å²	134	74.7 Å²	74.7	51%	0.506	38%	0.377	S	S	.	.	H	α-helix	trans	-67	-41.5	175.6	-73.8	176	-164.8	-161.6	6.7	112.1	M1 E5 L6 V7 H12 A13	M1-R9 VanDerWaalsContact SD-CZ 3.58Å; M1-R9 PolarHBondContact SD-NH1 3.29Å; M1-R9 VanDerWaalsContact SD-NH1 3.36Å; E5-R9 WeakPolarHBondContact O-CB 3.32Å; E5-R9 VanDerWaalsContact O-CG 3.28Å; E5-R9 WeakPolarHBondContact O-CG 3.47Å; E5-R9 PolarHBondContact O-N 3.47Å; L6-R9 PolarHBondContact O-N 2.8Å; V7-R9 PolarHBondContact O-N 2.68Å; R9-H12 PolarHBondContact O-N 2.94Å; R9-A13 WeakPolarHBondContact O-CB 3.45Å; R9-A13 PolarHBondContact O-N 2.88Å
10	T	82.9	Confident	75.4	Confident	20 Å²	20	74.4 Å²	74.4	12%	0.123	39%	0.394	C	S	.	.	H	α-helix	trans	-64.4	-46.2	177.3	-61.3	0	0	0	0	111.3	L6 V7 H12 A13 I14 Y31 L34 T35	L6-T10 PolarHBondContact O-N 2.81Å; L6-T10 PolarHBondContact O-OG1 3.13Å; L6-T10 VanDerWaalsContact O-OG1 3.11Å; V7-T10 PolarHBondContact O-N 3.02Å; T10-H12 VanDerWaalsContact C-N 3.33Å; T10-H12 PolarHBondContact O-N 3.4Å; T10-A13 PolarHBondContact O-N 3.16Å; T10-I14 HydrophobicContact CG2-CD1 3.9Å; T10-I14 WeakPolarHBondContact O-CD1 3.26Å; T10-I14 WeakPolarHBondContact O-CG1 3.49Å; T10-I14 PolarHBondContact O-N 3Å; T10-Y31 HydrophobicContact CG2-CD2 3.71Å; T10-Y31 HydrophobicContact CG2-CE2 3.62Å; T10-L34 HydrophobicContact CG2-CD2 3.73Å; T10-T35 HydrophobicContact CG2-CG2 3.9Å
11	L	84.8	Confident	75.5	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-59.5	-43.5	173.4	-69.4	170	0	0	0	111.8	V7 A13 V15 L27 Y31 I39 L52 L53	V7-L11 HydrophobicContact CG1-CD1 3.92Å; V7-L11 VanDerWaalsContact O-CG 3.3Å; V7-L11 WeakPolarHBondContact O-CG 3.18Å; V7-L11 PolarHBondContact O-N 3.28Å; L11-A13 PolarHBondContact O-N 2.91Å; L11-V15 WeakPolarHBondContact O-CB 3.49Å; L11-V15 VanDerWaalsContact O-CG2 3.27Å; L11-V15 WeakPolarHBondContact O-CG2 3.48Å; L11-V15 PolarHBondContact O-N 3.41Å; L11-V15 VanDerWaalsContact O-N 3.11Å; L11-L27 HydrophobicContact CD2-CD1 4.12Å; L11-L27 HydrophobicContact CD2-CG 4.29Å; L11-Y31 HydrophobicContact CD2-CD2 3.54Å; L11-Y31 HydrophobicContact CD2-CE2 4.07Å; L11-Y31 HydrophobicContact CD2-CG 4.33Å; L11-Y31 HydrophobicContact CG-CD2 3.94Å; L11-Y31 HydrophobicContact CG-CE2 4Å; L11-I39 HydrophobicContact CD1-CG2 4.27Å; L11-I39 HydrophobicContact CD2-CD1 3.52Å; L11-I39 HydrophobicContact CD2-CG1 4.04Å; L11-I39 HydrophobicContact CD2-CG2 4.4Å; L11-L52 HydrophobicContact CD1-CD2 4.12Å; L11-L53 HydrophobicContact CD1-CD2 4.12Å; L11-L53 HydrophobicContact CD2-CD2 4.41Å
12	H	80.3	Confident	77.2	Confident	47 Å²	47	64.2 Å²	64.2	22%	0.218	35%	0.347	C	S	.	.	H	α-helix	trans	-60.8	-44.3	174.9	-176.4	-102	0	0	0	112.2	K8 R9 T10 V15 Q16 S58 S73	K8-H12 WeakPolarHBondContact O-CB 3.22Å; K8-H12 PolarHBondContact O-N 3.34Å; R9-H12 PolarHBondContact O-N 2.94Å; T10-H12 VanDerWaalsContact C-N 3.33Å; T10-H12 PolarHBondContact O-N 3.4Å; H12-V15 PolarHBondContact O-N 2.63Å; H12-Q16 PolarHBondContact CE1-OE1 3.44Å; H12-Q16 PolarHBondContact ND1-OE1 3.02Å; H12-Q16 WeakPolarHBondContact O-CB 3.36Å; H12-Q16 PolarHBondContact O-N 2.76Å; H12-S58 WeakPolarHBondContact CD2-CB 3.23Å; H12-S58 PolarHBondContact CD2-O 3.1Å; H12-S73 PolarHBondContact NE2-OG 3.49Å
13	A	79.1	Confident	78.3	Confident	48 Å²	48	61.4 Å²	61.4	40%	0.397	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-44.3	-179.9	0	0	0	0	0	112.7	R9 T10 L11 V15 Q16 A17	R9-A13 WeakPolarHBondContact O-CB 3.45Å; R9-A13 PolarHBondContact O-N 2.88Å; T10-A13 PolarHBondContact O-N 3.16Å; L11-A13 PolarHBondContact O-N 2.91Å; A13-V15 VanDerWaalsContact C-N 3.35Å; A13-V15 PolarHBondContact O-N 2.9Å; A13-Q16 PolarHBondContact O-N 2.84Å; A13-A17 WeakPolarHBondContact O-CB 3.48Å; A13-A17 PolarHBondContact O-N 3.4Å
14	I	82.4	Confident	79.1	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.056	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-44	177.5	-66.1	159.1	0	0	0	110.9	T10 N18 L27 D30 Y31	T10-I14 HydrophobicContact CG2-CD1 3.9Å; T10-I14 WeakPolarHBondContact O-CD1 3.26Å; T10-I14 WeakPolarHBondContact O-CG1 3.49Å; T10-I14 PolarHBondContact O-N 3Å; I14-N18 PolarHBondContact O-N 3.03Å; I14-N18 PolarHBondContact O-ND2 3.3Å; I14-L27 HydrophobicContact CB-CD1 4.13Å; I14-L27 HydrophobicContact CG2-CD1 3.61Å; I14-D30 HydrophobicContact CG2-CB 3.59Å; I14-Y31 VanDerWaalsContact CD1-CA 3.5Å; I14-Y31 HydrophobicContact CD1-CD2 3.94Å; I14-Y31 HydrophobicContact CD1-CG 4.31Å
15	V	81.9	Confident	79.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-72.3	-32.2	179.3	175.4	0	0	0	0	111.6	L11 H12 A13 N18 V22 L27 V59	L11-V15 WeakPolarHBondContact O-CB 3.49Å; L11-V15 VanDerWaalsContact O-CG2 3.27Å; L11-V15 WeakPolarHBondContact O-CG2 3.48Å; L11-V15 PolarHBondContact O-N 3.41Å; L11-V15 VanDerWaalsContact O-N 3.11Å; H12-V15 PolarHBondContact O-N 2.63Å; A13-V15 VanDerWaalsContact C-N 3.35Å; A13-V15 PolarHBondContact O-N 2.9Å; V15-N18 CarbonylContact O-C 3.48Å; V15-N18 PolarHBondContact O-N 3.44Å; V15-V22 HydrophobicContact CG2-CG2 4.47Å; V15-L27 HydrophobicContact CG2-CD1 3.66Å; V15-L27 HydrophobicContact CG2-CD2 4.09Å; V15-V59 HydrophobicContact CG1-CG1 4.5Å
16	Q	78.2	Confident	80.1	Confident	110 Å²	110	58.9 Å²	58.9	51%	0.514	32%	0.32	S	S	.	.	H	α-helix	trans	-71.8	-36.3	175.4	-174.8	177.6	11.6	0	0	112.5	H12 A13 N18	H12-Q16 PolarHBondContact CE1-OE1 3.44Å; H12-Q16 PolarHBondContact ND1-OE1 3.02Å; H12-Q16 WeakPolarHBondContact O-CB 3.36Å; H12-Q16 PolarHBondContact O-N 2.76Å; A13-Q16 PolarHBondContact O-N 2.84Å; Q16-N18 PolarHBondContact O-N 3.49Å
17	A	73	Confident	80.5	Confident	83 Å²	83	54 Å²	54	69%	0.686	29%	0.294	S	S	*	.	H	α-helix	trans	-62.9	-33.2	172.8	0	0	0	0	0	111.9	A13 R19	A13-A17 WeakPolarHBondContact O-CB 3.48Å; A13-A17 PolarHBondContact O-N 3.4Å; A17-R19 PolarHBondContact O-N 2.99Å
18	N	71	Confident	80.8	Confident	41 Å²	41	55.5 Å²	55.5	22%	0.219	30%	0.301	C	S	.	.			trans	-101.6	69.1	-177.7	-72	-74	0	0	0	112.3	I14 V15 Q16 G20 G21 V22	I14-N18 PolarHBondContact O-N 3.03Å; I14-N18 PolarHBondContact O-ND2 3.3Å; V15-N18 CarbonylContact O-C 3.48Å; V15-N18 PolarHBondContact O-N 3.44Å; Q16-N18 PolarHBondContact O-N 3.49Å; N18-G20 PolarHBondContact O-N 2.99Å; N18-G21 PolarHBondContact O-N 3.12Å; N18-V22 HydrophobicContact CB-CG2 3.31Å
19	R	67.3	Low	81	Confident	194 Å²	194	55.6 Å²	55.6	73%	0.732	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-24.1	-178.2	-64.9	-170.8	179.5	-158.4	-0.8	115.9	A17 G21	A17-R19 PolarHBondContact O-N 2.99Å; R19-G21 PolarHBondContact O-N 3.45Å
20	G	69.3	Low	81.3	Confident	69 Å²	69	50.8 Å²	50.8	71%	0.711	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	0.9	176.3	0	0	0	0	0	115	N18 F72	N18-G20 PolarHBondContact O-N 2.99Å; G20-F72 VanDerWaalsContact C-CE1 3.49Å; G20-F72 WeakPolarHBondContact O-CE1 3.23Å
21	G	77.4	Confident	81.6	Confident	19 Å²	19	50.5 Å²	50.5	20%	0.196	29%	0.291	C	S	.	.			trans	89.2	154.3	-174.1	0	0	0	0	0	112.9	N18 R19 Y71 F72	N18-G21 PolarHBondContact O-N 3.12Å; R19-G21 PolarHBondContact O-N 3.45Å; G21-Y71 CarbonylContact C-O 3.49Å; G21-Y71 VanDerWaalsContact CA-O 3.28Å; G21-Y71 WeakPolarHBondContact CA-O 3.41Å; G21-F72 VanDerWaalsContact CA-CD1 3.48Å; G21-F72 VanDerWaalsContact CA-CE1 3.49Å
22	V	85.3	Confident	81.7	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.7	-178.9	-163	0	0	0	0	109.1	V15 N18 R26 L27 V70 Y71	V15-V22 HydrophobicContact CG2-CG2 4.47Å; N18-V22 HydrophobicContact CB-CG2 3.31Å; V22-R26 HydrophobicContact CG1-CB 3.77Å; V22-R26 HydrophobicContact CG1-CG 3.8Å; V22-L27 HydrophobicContact CB-CB 4.43Å; V22-L27 HydrophobicContact CG1-CB 3.82Å; V22-V70 CarbonylContact O-C 3.6Å; V22-V70 WeakPolarHBondContact O-CA 3.38Å; V22-Y71 PolarHBondContact N-O 3.02Å; V22-Y71 WeakPolarHBondContact O-CD2 3.37Å; V22-Y71 PolarHBondContact O-N 3.21Å
23	S	88.8	Confident	81.9	Confident	26 Å²	26	61.4 Å²	61.4	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	160	168	61.1	0	0	0	0	110.9	S25 R26 L27 E68	S23-S25 VanDerWaalsContact C-N 3.29Å; S23-S25 PolarHBondContact O-N 2.91Å; S23-S25 PolarHBondContact OG-OG 2.88Å; S23-S25 VanDerWaalsContact OG-OG 3.09Å; S23-R26 PolarHBondContact O-N 2.91Å; S23-R26 WeakPolarHBondContact OG-CB 3.27Å; S23-R26 PolarHBondContact OG-N 3.48Å; S23-L27 WeakPolarHBondContact O-CB 3.4Å; S23-L27 PolarHBondContact O-N 2.72Å; S23-E68 WeakPolarHBondContact CB-OE1 3.4Å
24	L	86.9	Confident	81.9	Confident	43 Å²	43	64.8 Å²	64.8	23%	0.225	35%	0.351	C	S	.	.	H	α-helix	trans	-58.6	-42.1	178.2	-171.4	67.6	0	0	0	112.4	R26 L27 Q28 V49 E50 L53 Y71	L24-R26 VanDerWaalsContact C-N 3.34Å; L24-R26 PolarHBondContact O-N 3.1Å; L24-L27 PolarHBondContact O-N 3.13Å; L24-Q28 WeakPolarHBondContact O-CB 3.17Å; L24-Q28 PolarHBondContact O-N 3.13Å; L24-V49 HydrophobicContact CD1-CB 4.11Å; L24-V49 HydrophobicContact CD1-CG1 3.76Å; L24-E50 HydrophobicContact CD1-CG 4.27Å; L24-E50 HydrophobicContact CD2-CG 3.8Å; L24-E50 VanDerWaalsContact CD2-OE1 3.28Å; L24-E50 WeakPolarHBondContact CD2-OE1 3.48Å; L24-L53 HydrophobicContact CD1-CD1 3.86Å; L24-Y71 HydrophobicContact CB-CE2 3.84Å; L24-Y71 HydrophobicContact CD1-CE2 3.96Å
25	S	83.7	Confident	82	Confident	83 Å²	83	66.9 Å²	66.9	58%	0.58	36%	0.364	S	S	*	.	H	α-helix	trans	-61.3	-41.9	179.6	50.7	0	0	0	0	112.2	S23 S29	S23-S25 VanDerWaalsContact C-N 3.29Å; S23-S25 PolarHBondContact O-N 2.91Å; S23-S25 PolarHBondContact OG-OG 2.88Å; S23-S25 VanDerWaalsContact OG-OG 3.09Å; S25-S29 PolarHBondContact O-N 2.91Å; S25-S29 VanDerWaalsContact O-N 3.17Å
26	R	86.5	Confident	81.9	Confident	134 Å²	134	69.1 Å²	69.1	51%	0.506	39%	0.387	S	S	.	.	H	α-helix	trans	-72	-42	176.1	-175.5	172.7	-176.9	158.5	4.2	111.9	V22 S23 L24 Q28 S29 D30	V22-R26 HydrophobicContact CG1-CB 3.77Å; V22-R26 HydrophobicContact CG1-CG 3.8Å; S23-R26 PolarHBondContact O-N 2.91Å; S23-R26 WeakPolarHBondContact OG-CB 3.27Å; S23-R26 PolarHBondContact OG-N 3.48Å; L24-R26 VanDerWaalsContact C-N 3.34Å; L24-R26 PolarHBondContact O-N 3.1Å; R26-Q28 VanDerWaalsContact C-N 3.28Å; R26-Q28 PolarHBondContact O-N 3.44Å; R26-S29 WeakPolarHBondContact O-CB 3.15Å; R26-S29 PolarHBondContact O-N 3.44Å; R26-D30 WeakPolarHBondContact CG-OD1 3.38Å; R26-D30 IonicContact NE-OD2 2.76Å; R26-D30 WeakPolarHBondContact O-CB 3.37Å; R26-D30 VanDerWaalsContact O-CG 3.27Å; R26-D30 PolarHBondContact O-N 2.65Å
27	L	88	Confident	82.2	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-60.4	-38.5	177	-177.2	55.8	0	0	0	112	L11 I14 V15 V22 S23 L24 Y31 I39 L53 Y71	L11-L27 HydrophobicContact CD2-CD1 4.12Å; L11-L27 HydrophobicContact CD2-CG 4.29Å; I14-L27 HydrophobicContact CB-CD1 4.13Å; I14-L27 HydrophobicContact CG2-CD1 3.61Å; V15-L27 HydrophobicContact CG2-CD1 3.66Å; V15-L27 HydrophobicContact CG2-CD2 4.09Å; V22-L27 HydrophobicContact CB-CB 4.43Å; V22-L27 HydrophobicContact CG1-CB 3.82Å; S23-L27 WeakPolarHBondContact O-CB 3.4Å; S23-L27 PolarHBondContact O-N 2.72Å; L24-L27 PolarHBondContact O-N 3.13Å; L27-Y31 VanDerWaalsContact O-CB 3.24Å; L27-Y31 WeakPolarHBondContact O-CB 3.39Å; L27-Y31 PolarHBondContact O-N 3.43Å; L27-I39 HydrophobicContact CG-CD1 4.27Å; L27-L53 HydrophobicContact CD2-CD1 3.56Å; L27-L53 HydrophobicContact CD2-CD2 3.86Å; L27-L53 HydrophobicContact CD2-CG 4.4Å; L27-Y71 HydrophobicContact CD2-CD2 4.4Å; L27-Y71 HydrophobicContact CD2-CG 4.22Å
28	Q	88.7	Confident	83	Confident	36 Å²	36	71.6 Å²	71.6	17%	0.168	39%	0.388	C	S	.	.	H	α-helix	trans	-65.1	-39.9	172.8	-168.6	75.9	11.6	0	0	112.2	L24 R26 K32 I39	L24-Q28 WeakPolarHBondContact O-CB 3.17Å; L24-Q28 PolarHBondContact O-N 3.13Å; R26-Q28 VanDerWaalsContact C-N 3.28Å; R26-Q28 PolarHBondContact O-N 3.44Å; Q28-K32 WeakPolarHBondContact O-CB 3.49Å; Q28-K32 PolarHBondContact O-N 3Å; Q28-I39 VanDerWaalsContact OE1-CD1 3.28Å
29	S	85.7	Confident	83.9	Confident	68 Å²	68	69.8 Å²	69.8	48%	0.476	38%	0.379	S	S	.	.	H	α-helix	trans	-67.8	-53.6	177.7	-169.5	0	0	0	0	111.7	S25 R26 Y31 K32 E33	S25-S29 PolarHBondContact O-N 2.91Å; S25-S29 VanDerWaalsContact O-N 3.17Å; R26-S29 WeakPolarHBondContact O-CB 3.15Å; R26-S29 PolarHBondContact O-N 3.44Å; S29-Y31 VanDerWaalsContact C-N 3.28Å; S29-Y31 PolarHBondContact O-N 3.3Å; S29-K32 PolarHBondContact O-N 2.91Å; S29-K32 VanDerWaalsContact O-N 3.08Å; S29-E33 PolarHBondContact O-N 2.87Å
30	D	86.6	Confident	84.9	Confident	33 Å²	33	61.8 Å²	61.8	18%	0.176	35%	0.352	C	S	.	.	H	α-helix	trans	-60.3	-37.6	-178.9	-64.9	10.9	0	0	0	110.7	I14 R26 E33 L34	I14-D30 HydrophobicContact CG2-CB 3.59Å; R26-D30 WeakPolarHBondContact CG-OD1 3.38Å; R26-D30 IonicContact NE-OD2 2.76Å; R26-D30 WeakPolarHBondContact O-CB 3.37Å; R26-D30 VanDerWaalsContact O-CG 3.27Å; R26-D30 PolarHBondContact O-N 2.65Å; D30-E33 PolarHBondContact O-N 3.48Å; D30-L34 WeakPolarHBondContact O-CB 3.49Å; D30-L34 PolarHBondContact O-N 2.81Å
31	Y	88.8	Confident	85.7	Confident	15 Å²	15	60.3 Å²	60.3	6%	0.059	33%	0.326	C	S	.	.	H	α-helix	trans	-66.3	-41.2	174.5	-173.3	-81.8	0	0	0	112.6	V7 T10 L11 I14 L27 S29 L34 T35 D37 I39	V7-Y31 HydrophobicContact CG1-CE2 4.31Å; T10-Y31 HydrophobicContact CG2-CD2 3.71Å; T10-Y31 HydrophobicContact CG2-CE2 3.62Å; L11-Y31 HydrophobicContact CD2-CD2 3.54Å; L11-Y31 HydrophobicContact CD2-CE2 4.07Å; L11-Y31 HydrophobicContact CD2-CG 4.33Å; L11-Y31 HydrophobicContact CG-CD2 3.94Å; L11-Y31 HydrophobicContact CG-CE2 4Å; I14-Y31 VanDerWaalsContact CD1-CA 3.5Å; I14-Y31 HydrophobicContact CD1-CD2 3.94Å; I14-Y31 HydrophobicContact CD1-CG 4.31Å; L27-Y31 VanDerWaalsContact O-CB 3.24Å; L27-Y31 WeakPolarHBondContact O-CB 3.39Å; L27-Y31 PolarHBondContact O-N 3.43Å; S29-Y31 VanDerWaalsContact C-N 3.28Å; S29-Y31 PolarHBondContact O-N 3.3Å; Y31-L34 PolarHBondContact O-N 2.91Å; Y31-T35 HydrophobicContact CD1-CG2 4.33Å; Y31-T35 WeakPolarHBondContact CD1-OG1 3.36Å; Y31-T35 HydrophobicContact CE1-CG2 3.93Å; Y31-T35 VanDerWaalsContact CE1-OG1 3.25Å; Y31-T35 WeakPolarHBondContact CE1-OG1 3.38Å; Y31-T35 HydrophobicContact CE2-CG2 4.31Å; Y31-T35 WeakPolarHBondContact O-CB 3.31Å; Y31-T35 PolarHBondContact O-N 2.84Å; Y31-T35 PolarHBondContact O-OG1 2.8Å; Y31-D37 WeakPolarHBondContact CD1-O 3.47Å; Y31-I39 HydrophobicContact CD1-CB 4.4Å; Y31-I39 HydrophobicContact CD1-CG1 3.61Å; Y31-I39 HydrophobicContact CD2-CG1 4Å; Y31-I39 HydrophobicContact CE1-CG1 4.26Å; Y31-I39 HydrophobicContact CG-CD1 4.25Å; Y31-I39 HydrophobicContact CG-CG1 3.49Å; Y31-I39 VanDerWaalsContact CG-CG1 3.49Å
32	K	87.1	Confident	86	Confident	112 Å²	112	68.7 Å²	68.7	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-68.6	-36.4	177.2	-168.9	-171.9	174.2	-170.9	0	112.3	Q28 S29 L34 G36 D37 Q38	Q28-K32 WeakPolarHBondContact O-CB 3.49Å; Q28-K32 PolarHBondContact O-N 3Å; S29-K32 PolarHBondContact O-N 2.91Å; S29-K32 VanDerWaalsContact O-N 3.08Å; K32-L34 VanDerWaalsContact C-N 3.34Å; K32-G36 WeakPolarHBondContact CG-O 3.28Å; K32-G36 CarbonylContact O-C 3.57Å; K32-G36 WeakPolarHBondContact O-CA 3.02Å; K32-G36 PolarHBondContact O-N 2.96Å; K32-D37 WeakPolarHBondContact CA-O 3.44Å; K32-Q38 HydrophobicContact CD-CG 4.38Å
33	E	83.8	Confident	85.8	Confident	163 Å²	163	76.7 Å²	76.7	76%	0.762	39%	0.389	S	S	*	.	H	α-helix	trans	-64.4	-40.1	173.1	-171.6	173.2	177.6	0	0	111.4	S29 D30	S29-E33 PolarHBondContact O-N 2.87Å; D30-E33 PolarHBondContact O-N 3.48Å
34	L	80.6	Confident	85.3	Confident	119 Å²	119	77 Å²	77	62%	0.623	39%	0.388	S	S	*	.	H	α-helix	trans	-76.9	-29.3	-178	-144	90.1	0	0	0	114.5	T10 D30 Y31 K32	T10-L34 HydrophobicContact CG2-CD2 3.73Å; D30-L34 WeakPolarHBondContact O-CB 3.49Å; D30-L34 PolarHBondContact O-N 2.81Å; Y31-L34 PolarHBondContact O-N 2.91Å; K32-L34 VanDerWaalsContact C-N 3.34Å
35	T	84.4	Confident	85.1	Confident	56 Å²	56	78.1 Å²	78.1	34%	0.344	41%	0.41	S	S	.	.	H	α-helix	trans	-117.8	-14.3	-171.9	64.7	0	0	0	0	114.7	T10 Y31 D37	T10-T35 HydrophobicContact CG2-CG2 3.9Å; Y31-T35 HydrophobicContact CD1-CG2 4.33Å; Y31-T35 WeakPolarHBondContact CD1-OG1 3.36Å; Y31-T35 HydrophobicContact CE1-CG2 3.93Å; Y31-T35 VanDerWaalsContact CE1-OG1 3.25Å; Y31-T35 WeakPolarHBondContact CE1-OG1 3.38Å; Y31-T35 HydrophobicContact CE2-CG2 4.31Å; Y31-T35 WeakPolarHBondContact O-CB 3.31Å; Y31-T35 PolarHBondContact O-N 2.84Å; Y31-T35 PolarHBondContact O-OG1 2.8Å; T35-D37 PolarHBondContact O-N 3.31Å; T35-D37 PolarHBondContact OG1-N 2.73Å; T35-D37 PolarHBondContact OG1-O 3.39Å
36	G	79.5	Confident	85.1	Confident	47 Å²	47	76.3 Å²	76.3	49%	0.485	39%	0.393	S	S	.	.	S	Bend	trans	88.3	-30.1	-169.4	0	0	0	0	0	113.8	K32	K32-G36 WeakPolarHBondContact CG-O 3.28Å; K32-G36 CarbonylContact O-C 3.57Å; K32-G36 WeakPolarHBondContact O-CA 3.02Å; K32-G36 PolarHBondContact O-N 2.96Å
37	D	84.6	Confident	84.9	Confident	118 Å²	118	75.8 Å²	75.8	63%	0.631	40%	0.404	S	S	*	.	S	Bend	trans	-114.8	161.3	-167.4	-73.5	-48.5	0	0	0	114.2	Y31 K32 T35	Y31-D37 WeakPolarHBondContact CD1-O 3.47Å; K32-D37 WeakPolarHBondContact CA-O 3.44Å; T35-D37 PolarHBondContact O-N 3.31Å; T35-D37 PolarHBondContact OG1-N 2.73Å; T35-D37 PolarHBondContact OG1-O 3.39Å
38	Q	88.9	Confident	84.8	Confident	126 Å²	126	81.3 Å²	81.3	59%	0.589	43%	0.43	S	S	*	.			trans	-74.4	154.3	176	-74.7	-159.7	71.7	0	0	112	K32 P40	K32-Q38 HydrophobicContact CD-CG 4.38Å; Q38-P40 VanDerWaalsContact O-CD 3.26Å; Q38-P40 WeakPolarHBondContact O-CD 3.41Å; Q38-P40 VanDerWaalsContact O-N 3.08Å
39	I	90.8	Very high	84.5	Confident	3 Å²	3	80.1 Å²	80.1	2%	0.015	43%	0.425	C	S	.	.			trans	-57.1	115.5	178.8	-58.2	174.7	0	0	0	109.8	L11 L27 Q28 Y31 H41 V49 L52	L11-I39 HydrophobicContact CD1-CG2 4.27Å; L11-I39 HydrophobicContact CD2-CD1 3.52Å; L11-I39 HydrophobicContact CD2-CG1 4.04Å; L11-I39 HydrophobicContact CD2-CG2 4.4Å; L27-I39 HydrophobicContact CG-CD1 4.27Å; Q28-I39 VanDerWaalsContact OE1-CD1 3.28Å; Y31-I39 HydrophobicContact CD1-CB 4.4Å; Y31-I39 HydrophobicContact CD1-CG1 3.61Å; Y31-I39 HydrophobicContact CD2-CG1 4Å; Y31-I39 HydrophobicContact CE1-CG1 4.26Å; Y31-I39 HydrophobicContact CG-CD1 4.25Å; Y31-I39 HydrophobicContact CG-CG1 3.49Å; Y31-I39 VanDerWaalsContact CG-CG1 3.49Å; I39-H41 PolarHBondContact O-N 2.96Å; I39-H41 PolarHBondContact O-ND1 3.03Å; I39-H41 VanDerWaalsContact O-ND1 3.12Å; I39-V49 HydrophobicContact CB-CG1 4.36Å; I39-V49 HydrophobicContact CB-CG2 4.4Å; I39-V49 HydrophobicContact CD1-CG1 3.9Å; I39-V49 HydrophobicContact CG2-CG1 4.1Å; I39-L52 HydrophobicContact CG2-CD2 3.75Å
40	P	87.5	Confident	84.4	Confident	26 Å²	26	80 Å²	80	17%	0.169	42%	0.417	C	S	.	.			trans	-81.7	49.7	-167.3	33.5	-37.2	0	0	0	112.9	V7 Q38 R42 E43 M44	V7-P40 HydrophobicContact CG1-CG 4.33Å; V7-P40 HydrophobicContact CG2-CG 3.84Å; Q38-P40 VanDerWaalsContact O-CD 3.26Å; Q38-P40 WeakPolarHBondContact O-CD 3.41Å; Q38-P40 VanDerWaalsContact O-N 3.08Å; P40-R42 PolarHBondContact O-N 3.19Å; P40-R42 VanDerWaalsContact O-N 3.11Å; P40-E43 HydrophobicContact CB-CB 4.37Å; P40-E43 WeakPolarHBondContact CB-OE2 3.28Å; P40-E43 PolarHBondContact O-N 3.2Å; P40-E43 VanDerWaalsContact O-N 3.17Å; P40-M44 HydrophobicContact CG-CG 4.42Å; P40-M44 WeakPolarHBondContact O-CG 3.49Å; P40-M44 PolarHBondContact O-N 3.49Å; P40-M44 VanDerWaalsContact O-N 3.09Å
41	H	85.2	Confident	84.2	Confident	38 Å²	38	80.5 Å²	80.5	18%	0.176	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-35.4	-173.3	62.7	-77.7	0	0	0	114.3	I39 M44 G45 H46 V49 L52	I39-H41 PolarHBondContact O-N 2.96Å; I39-H41 PolarHBondContact O-ND1 3.03Å; I39-H41 VanDerWaalsContact O-ND1 3.12Å; H41-M44 CarbonylContact O-C 3.51Å; H41-M44 WeakPolarHBondContact O-CB 3.44Å; H41-M44 PolarHBondContact O-N 3.23Å; H41-G45 PolarHBondContact O-N 3.08Å; H41-H46 CarbonylContact C-O 3.59Å; H41-H46 HydrophobicContact CB-CB 4.45Å; H41-H46 PolarHBondContact CD2-O 3.28Å; H41-H46 WeakPolarHBondContact O-CA 3.2Å; H41-H46 WeakPolarHBondContact O-CB 3.35Å; H41-H46 PolarHBondContact O-N 3.33Å; H41-H46 VanDerWaalsContact O-O 3.07Å; H41-V49 HydrophobicContact CB-CG2 4Å; H41-V49 WeakPolarHBondContact ND1-CG2 3.46Å; H41-L52 HydrophobicContact CB-CB 4.4Å; H41-L52 HydrophobicContact CB-CD2 4.3Å
42	R	85	Confident	83.9	Confident	195 Å²	195	79.8 Å²	79.8	74%	0.736	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-41.8	179.4	-64.2	-171.6	176.1	-166	-3.1	113.4	P40 M44 G45 H46	P40-R42 PolarHBondContact O-N 3.19Å; P40-R42 VanDerWaalsContact O-N 3.11Å; R42-M44 PolarHBondContact O-N 3.14Å; R42-G45 PolarHBondContact O-N 2.7Å; R42-H46 WeakPolarHBondContact CA-O 3.49Å
43	E	80.6	Confident	83.7	Confident	169 Å²	169	74.5 Å²	74.5	79%	0.79	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.4	175.2	-68.6	155.3	-153.8	0	0	110.7	P40 G45	P40-E43 HydrophobicContact CB-CB 4.37Å; P40-E43 WeakPolarHBondContact CB-OE2 3.28Å; P40-E43 PolarHBondContact O-N 3.2Å; P40-E43 VanDerWaalsContact O-N 3.17Å; E43-G45 PolarHBondContact O-N 3.2Å
44	M	77.8	Confident	83.5	Confident	32 Å²	32	70.2 Å²	70.2	16%	0.158	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	4.7	171.5	-59	-79.4	-76.9	0	0	113.7	V4 V7 K8 P40 H41 R42 H46 L52	V4-M44 HydrophobicContact CB-CE 4.18Å; V4-M44 HydrophobicContact CB-SD 4.05Å; V4-M44 HydrophobicContact CG1-CE 3.65Å; V4-M44 HydrophobicContact CG1-SD 4.04Å; V4-M44 HydrophobicContact CG2-SD 3.87Å; V7-M44 HydrophobicContact CB-CE 3.97Å; V7-M44 HydrophobicContact CB-SD 4.35Å; V7-M44 HydrophobicContact CG1-CE 3.96Å; V7-M44 HydrophobicContact CG1-SD 4.5Å; V7-M44 HydrophobicContact CG2-SD 4.28Å; K8-M44 HydrophobicContact CG-CE 4.35Å; P40-M44 HydrophobicContact CG-CG 4.42Å; P40-M44 WeakPolarHBondContact O-CG 3.49Å; P40-M44 PolarHBondContact O-N 3.49Å; P40-M44 VanDerWaalsContact O-N 3.09Å; H41-M44 CarbonylContact O-C 3.51Å; H41-M44 WeakPolarHBondContact O-CB 3.44Å; H41-M44 PolarHBondContact O-N 3.23Å; R42-M44 PolarHBondContact O-N 3.14Å; M44-H46 PolarHBondContact O-CD2 2.98Å; M44-L52 HydrophobicContact CB-CD1 4.11Å; M44-L52 HydrophobicContact CB-CD2 4.45Å; M44-L52 HydrophobicContact CE-CD1 3.66Å; M44-L52 HydrophobicContact CE-CD2 4.48Å; M44-L52 HydrophobicContact CG-CD1 4.45Å; M44-L52 HydrophobicContact CG-CD2 4.33Å
45	G	83.1	Confident	83.4	Confident	67 Å²	67	67 Å²	67	69%	0.691	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	11	177.7	0	0	0	0	0	115.8	H41 R42 E43	H41-G45 PolarHBondContact O-N 3.08Å; R42-G45 PolarHBondContact O-N 2.7Å; E43-G45 PolarHBondContact O-N 3.2Å
46	H	84.3	Confident	82.9	Confident	45 Å²	45	64.6 Å²	64.6	21%	0.208	37%	0.365	C	S	.	.			trans	-106.9	138.6	-178.6	-61.8	-81	0	0	0	112.3	H41 R42 M44 Q48 A51 L52 S55	H41-H46 CarbonylContact C-O 3.59Å; H41-H46 HydrophobicContact CB-CB 4.45Å; H41-H46 PolarHBondContact CD2-O 3.28Å; H41-H46 WeakPolarHBondContact O-CA 3.2Å; H41-H46 WeakPolarHBondContact O-CB 3.35Å; H41-H46 PolarHBondContact O-N 3.33Å; H41-H46 VanDerWaalsContact O-O 3.07Å; R42-H46 WeakPolarHBondContact CA-O 3.49Å; M44-H46 PolarHBondContact O-CD2 2.98Å; H46-Q48 VanDerWaalsContact C-N 3.33Å; H46-Q48 PolarHBondContact O-N 3.36Å; H46-A51 HydrophobicContact CB-CB 4.19Å; H46-A51 PolarHBondContact CE1-O 3.36Å; H46-A51 PolarHBondContact ND1-O 3.21Å; H46-L52 HydrophobicContact CB-CB 4.09Å; H46-S55 VanDerWaalsContact CE1-CB 3.49Å; H46-S55 WeakPolarHBondContact CE1-CB 3.28Å; H46-S55 PolarHBondContact CE1-OG 3.12Å; H46-S55 PolarHBondContact NE2-OG 3.09Å
47	V	82.8	Confident	82.1	Confident	123 Å²	123	68 Å²	68	75%	0.745	38%	0.381	S	S	*	.	S	Bend	trans	-71.3	-29.1	-178.2	-174.5	0	0	0	0	112.3
48	Q	84.7	Confident	81.3	Confident	117 Å²	117	64.6 Å²	64.6	55%	0.547	37%	0.367	S	S	.	.	S	Bend	trans	-143.3	159.6	-179.3	-66.8	-177.1	-40.2	0	0	110.1	H46 E50 A51 L52	H46-Q48 VanDerWaalsContact C-N 3.33Å; H46-Q48 PolarHBondContact O-N 3.36Å; Q48-E50 VanDerWaalsContact C-N 3.28Å; Q48-E50 WeakPolarHBondContact CB-OE2 3.4Å; Q48-E50 PolarHBondContact O-N 2.92Å; Q48-A51 PolarHBondContact O-N 3.08Å; Q48-L52 PolarHBondContact O-N 3.2Å
49	V	82.1	Confident	80.6	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-35.3	-177.6	178.3	0	0	0	0	111.1	L24 I39 H41 A51 L52 L53	L24-V49 HydrophobicContact CD1-CB 4.11Å; L24-V49 HydrophobicContact CD1-CG1 3.76Å; I39-V49 HydrophobicContact CB-CG1 4.36Å; I39-V49 HydrophobicContact CB-CG2 4.4Å; I39-V49 HydrophobicContact CD1-CG1 3.9Å; I39-V49 HydrophobicContact CG2-CG1 4.1Å; H41-V49 HydrophobicContact CB-CG2 4Å; H41-V49 WeakPolarHBondContact ND1-CG2 3.46Å; V49-A51 VanDerWaalsContact C-N 3.26Å; V49-A51 PolarHBondContact O-N 3.21Å; V49-L52 WeakPolarHBondContact O-CB 3.42Å; V49-L52 PolarHBondContact O-N 2.91Å; V49-L53 HydrophobicContact CG1-CD1 3.89Å; V49-L53 HydrophobicContact CG1-CG 4.32Å; V49-L53 WeakPolarHBondContact O-CG 3.02Å; V49-L53 PolarHBondContact O-N 3.43Å
50	E	84.9	Confident	80.1	Confident	66 Å²	66	62.2 Å²	62.2	31%	0.308	35%	0.354	S	S	.	.	H	α-helix	trans	-58.6	-36.7	176.3	-58.7	95.3	132.8	0	0	112	L24 Q48 L53 A54 Y71	L24-E50 HydrophobicContact CD1-CG 4.27Å; L24-E50 HydrophobicContact CD2-CG 3.8Å; L24-E50 VanDerWaalsContact CD2-OE1 3.28Å; L24-E50 WeakPolarHBondContact CD2-OE1 3.48Å; Q48-E50 VanDerWaalsContact C-N 3.28Å; Q48-E50 WeakPolarHBondContact CB-OE2 3.4Å; Q48-E50 PolarHBondContact O-N 2.92Å; E50-L53 PolarHBondContact O-N 3.11Å; E50-A54 WeakPolarHBondContact O-CB 3.45Å; E50-A54 PolarHBondContact O-N 3.26Å; E50-Y71 VanDerWaalsContact CG-OH 3.23Å; E50-Y71 WeakPolarHBondContact CG-OH 3.44Å
51	A	81.2	Confident	79.8	Confident	43 Å²	43	64.2 Å²	64.2	36%	0.355	36%	0.362	S	S	.	.	H	α-helix	trans	-72.8	-31.1	176.3	0	0	0	0	0	112.7	H46 Q48 V49 S55	H46-A51 HydrophobicContact CB-CB 4.19Å; H46-A51 PolarHBondContact CE1-O 3.36Å; H46-A51 PolarHBondContact ND1-O 3.21Å; Q48-A51 PolarHBondContact O-N 3.08Å; V49-A51 VanDerWaalsContact C-N 3.26Å; V49-A51 PolarHBondContact O-N 3.21Å; A51-S55 WeakPolarHBondContact O-CB 3.27Å; A51-S55 PolarHBondContact O-N 3.12Å
52	L	84.1	Confident	79.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-69.2	-41.8	171.4	170.1	62.6	0	0	0	111	V7 L11 I39 H41 M44 H46 Q48 V49 S55 T56	V7-L52 HydrophobicContact CG1-CD2 4.37Å; L11-L52 HydrophobicContact CD1-CD2 4.12Å; I39-L52 HydrophobicContact CG2-CD2 3.75Å; H41-L52 HydrophobicContact CB-CB 4.4Å; H41-L52 HydrophobicContact CB-CD2 4.3Å; M44-L52 HydrophobicContact CB-CD1 4.11Å; M44-L52 HydrophobicContact CB-CD2 4.45Å; M44-L52 HydrophobicContact CE-CD1 3.66Å; M44-L52 HydrophobicContact CE-CD2 4.48Å; M44-L52 HydrophobicContact CG-CD1 4.45Å; M44-L52 HydrophobicContact CG-CD2 4.33Å; H46-L52 HydrophobicContact CB-CB 4.09Å; Q48-L52 PolarHBondContact O-N 3.2Å; V49-L52 WeakPolarHBondContact O-CB 3.42Å; V49-L52 PolarHBondContact O-N 2.91Å; L52-S55 PolarHBondContact O-N 3.14Å; L52-S55 PolarHBondContact O-OG 3.2Å; L52-T56 PolarHBondContact O-N 3.14Å; L52-T56 PolarHBondContact O-OG1 3.46Å
53	L	82.9	Confident	79.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-67.2	-43.3	178.3	-66.2	168	0	0	0	111.3	L11 L24 L27 V49 E50 S55 T56 V59 Y71	L11-L53 HydrophobicContact CD1-CD2 4.12Å; L11-L53 HydrophobicContact CD2-CD2 4.41Å; L24-L53 HydrophobicContact CD1-CD1 3.86Å; L27-L53 HydrophobicContact CD2-CD1 3.56Å; L27-L53 HydrophobicContact CD2-CD2 3.86Å; L27-L53 HydrophobicContact CD2-CG 4.4Å; V49-L53 HydrophobicContact CG1-CD1 3.89Å; V49-L53 HydrophobicContact CG1-CG 4.32Å; V49-L53 WeakPolarHBondContact O-CG 3.02Å; V49-L53 PolarHBondContact O-N 3.43Å; E50-L53 PolarHBondContact O-N 3.11Å; L53-S55 PolarHBondContact O-N 3.45Å; L53-T56 PolarHBondContact O-N 2.94Å; L53-V59 HydrophobicContact CD2-CG1 4.49Å; L53-Y71 HydrophobicContact CB-CD1 4.02Å; L53-Y71 HydrophobicContact CB-CE1 3.81Å; L53-Y71 HydrophobicContact CD1-CD1 3.61Å; L53-Y71 HydrophobicContact CD1-CE1 3.38Å; L53-Y71 HydrophobicContact CD1-CE2 4.41Å; L53-Y71 HydrophobicContact CD1-CG 4.2Å; L53-Y71 HydrophobicContact CG-CD1 4.31Å; L53-Y71 HydrophobicContact CG-CE1 4.21Å
54	A	78.3	Confident	78.4	Confident	73 Å²	73	59.4 Å²	59.4	60%	0.603	35%	0.347	S	S	*	.	H	α-helix	trans	-62.3	-26.6	173	0	0	0	0	0	113.7	E50 T56 M61	E50-A54 WeakPolarHBondContact O-CB 3.45Å; E50-A54 PolarHBondContact O-N 3.26Å; A54-T56 VanDerWaalsContact C-N 3.3Å; A54-M61 HydrophobicContact CB-SD 4.08Å
55	S	78.6	Confident	77.5	Confident	52 Å²	52	62.6 Å²	62.6	36%	0.364	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-4.6	174.4	83.4	0	0	0	0	114.4	H46 A51 L52 L53	H46-S55 VanDerWaalsContact CE1-CB 3.49Å; H46-S55 WeakPolarHBondContact CE1-CB 3.28Å; H46-S55 PolarHBondContact CE1-OG 3.12Å; H46-S55 PolarHBondContact NE2-OG 3.09Å; A51-S55 WeakPolarHBondContact O-CB 3.27Å; A51-S55 PolarHBondContact O-N 3.12Å; L52-S55 PolarHBondContact O-N 3.14Å; L52-S55 PolarHBondContact O-OG 3.2Å; L53-S55 PolarHBondContact O-N 3.45Å
56	T	74.1	Confident	76.5	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.031	39%	0.39	C	S	.	.			trans	-106	102.9	-175	-59.7	0	0	0	0	109.3	K8 L52 L53 A54 S58 V59	K8-T56 HydrophobicContact CB-CG2 4.46Å; K8-T56 HydrophobicContact CD-CG2 4.38Å; K8-T56 HydrophobicContact CG-CG2 4.28Å; L52-T56 PolarHBondContact O-N 3.14Å; L52-T56 PolarHBondContact O-OG1 3.46Å; L53-T56 PolarHBondContact O-N 2.94Å; A54-T56 VanDerWaalsContact C-N 3.3Å; T56-S58 PolarHBondContact O-N 3.25Å; T56-V59 HydrophobicContact CG2-CG2 4.38Å; T56-V59 PolarHBondContact O-N 2.84Å
57	S	63.5	Low	75.5	Confident	118 Å²	118	64.2 Å²	64.2	83%	0.825	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-13.7	-176.3	51.7	0	0	0	0	115.5
58	S	67.6	Low	75.3	Confident	47 Å²	47	62.9 Å²	62.9	33%	0.329	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-4.4	178.3	-38.4	0	0	0	0	114.4	H12 T56 A74	H12-S58 WeakPolarHBondContact CD2-CB 3.23Å; H12-S58 PolarHBondContact CD2-O 3.1Å; T56-S58 PolarHBondContact O-N 3.25Å; S58-A74 PolarHBondContact O-N 3.32Å
59	V	74.6	Confident	75	Confident	14 Å²	14	60 Å²	60	9%	0.085	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.7	-179.6	-178.7	0	0	0	0	110.1	V15 L53 T56 Y71 F72	V15-V59 HydrophobicContact CG1-CG1 4.5Å; L53-V59 HydrophobicContact CD2-CG1 4.49Å; T56-V59 HydrophobicContact CG2-CG2 4.38Å; T56-V59 PolarHBondContact O-N 2.84Å; V59-Y71 HydrophobicContact CG1-CD1 4.07Å; V59-F72 CarbonylContact C-O 3.52Å; V59-F72 WeakPolarHBondContact CA-O 3.32Å
60	R	79.4	Confident	75.2	Confident	66 Å²	66	60.9 Å²	60.9	25%	0.249	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	148.9	173.3	71.9	-179	-147.6	-129.1	1	110.8	E62 Y71 F72	R60-E62 IonicContact CZ-OE1 3.76Å; R60-E62 IonicContact NE-OE1 3.44Å; R60-E62 PolarHBondContact NE-OE1 2.74Å; R60-E62 IonicContact NH2-OE1 2.73Å; R60-E62 PolarHBondContact NH2-OE1 2.87Å; R60-E62 IonicContact NH2-OE2 3.31Å; R60-Y71 WeakPolarHBondContact O-CA 3.19Å; R60-F72 HydrophobicContact CG-CB 3.72Å; R60-F72 HydrophobicContact CG-CD2 4.5Å; R60-F72 PolarHBondContact N-O 3.38Å; R60-F72 PolarHBondContact O-N 3.42Å
61	M	82.1	Confident	75.2	Confident	68 Å²	68	57.8 Å²	57.8	34%	0.335	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.3	-179.2	-61.7	177.3	58.7	0	0	110	A54 M69 Y71	A54-M61 HydrophobicContact CB-SD 4.08Å; M61-M69 HydrophobicContact CB-CE 3.98Å; M61-M69 HydrophobicContact CE-CE 4.04Å; M61-Y71 HydrophobicContact CE-CE1 3.59Å; M61-Y71 WeakPolarHBondContact CE-OH 3.21Å; M61-Y71 HydrophobicContact CG-CD1 3.62Å; M61-Y71 HydrophobicContact CG-CE1 3.51Å; M61-Y71 HydrophobicContact SD-CD1 4.35Å; M61-Y71 HydrophobicContact SD-CE1 3.68Å
62	E	79.3	Confident	75.2	Confident	84 Å²	84	57.2 Å²	57.2	39%	0.393	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	151	173.4	-61.6	175.3	-164	0	0	109.9	R60 V70 F72	R60-E62 IonicContact CZ-OE1 3.76Å; R60-E62 IonicContact NE-OE1 3.44Å; R60-E62 PolarHBondContact NE-OE1 2.74Å; R60-E62 IonicContact NH2-OE1 2.73Å; R60-E62 PolarHBondContact NH2-OE1 2.87Å; R60-E62 IonicContact NH2-OE2 3.31Å; E62-V70 PolarHBondContact N-O 3.32Å; E62-V70 PolarHBondContact O-N 2.74Å; E62-F72 HydrophobicContact CB-CD2 4.47Å; E62-F72 HydrophobicContact CB-CE2 3.95Å; E62-F72 HydrophobicContact CG-CD2 4.35Å; E62-F72 HydrophobicContact CG-CE2 4.2Å
63	R	76.5	Confident	74.9	Confident	189 Å²	189	57.8 Å²	57.8	71%	0.713	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.6	175.6	-168.9	174.5	-77.6	-159	-4.3	108.7	G67 M69	R63-G67 WeakPolarHBondContact CG-O 3.24Å; R63-M69 HydrophobicContact CB-CE 4.44Å; R63-M69 HydrophobicContact CB-SD 3.72Å; R63-M69 HydrophobicContact CG-SD 3.89Å
64	G	65.7	Low	74	Confident	27 Å²	27	60.4 Å²	60.4	28%	0.278	38%	0.38	S	S	.	.			trans	-68.2	167.6	-179.2	0	0	0	0	0	112.9	S66 G67 E68	G64-S66 PolarHBondContact O-N 2.7Å; G64-S66 VanDerWaalsContact O-N 3.08Å; G64-G67 PolarHBondContact O-N 2.71Å; G64-E68 PolarHBondContact N-O 3.05Å
65	G	57.2	Low	72.8	Confident	100 Å²	100	57.9 Å²	57.9	100%	1.031	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.7	-178.6	0	0	0	0	0	115.2
66	S	62.7	Low	71.2	Confident	103 Å²	103	57.4 Å²	57.4	72%	0.72	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-5.5	172.1	55.2	0	0	0	0	114.2	G64	G64-S66 PolarHBondContact O-N 2.7Å; G64-S66 VanDerWaalsContact O-N 3.08Å
67	G	64.3	Low	69.6	Low	42 Å²	42	64.9 Å²	64.9	43%	0.433	39%	0.392	S	S	.	.	S	Bend	trans	87.9	-7.8	-173	0	0	0	0	0	115.2	R63 G64	R63-G67 WeakPolarHBondContact CG-O 3.24Å; G64-G67 PolarHBondContact O-N 2.71Å
68	E	77.4	Confident	68.5	Low	96 Å²	96	65 Å²	65	45%	0.449	38%	0.38	S	S	.	.			trans	-72.9	147.7	177	-168.9	176.6	-179.2	0	0	112	S23 G64	S23-E68 WeakPolarHBondContact CB-OE1 3.4Å; G64-E68 PolarHBondContact N-O 3.05Å
69	M	79.3	Confident	67.1	Low	56 Å²	56	64.3 Å²	64.3	28%	0.276	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	128.3	176.5	-65.3	-56.9	-54.5	0	0	111.3	M61 R63 Y71	M61-M69 HydrophobicContact CB-CE 3.98Å; M61-M69 HydrophobicContact CE-CE 4.04Å; R63-M69 HydrophobicContact CB-CE 4.44Å; R63-M69 HydrophobicContact CB-SD 3.72Å; R63-M69 HydrophobicContact CG-SD 3.89Å; M69-Y71 HydrophobicContact CB-CE2 4.49Å
70	V	85.3	Confident	65.3	Low	29 Å²	29	66.6 Å²	66.6	18%	0.176	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.4	-177.1	-172.6	0	0	0	0	109.9	V22 E62 F72	V22-V70 CarbonylContact O-C 3.6Å; V22-V70 WeakPolarHBondContact O-CA 3.38Å; E62-V70 PolarHBondContact N-O 3.32Å; E62-V70 PolarHBondContact O-N 2.74Å; V70-F72 HydrophobicContact CB-CE2 3.85Å; V70-F72 HydrophobicContact CB-CZ 4.29Å; V70-F72 HydrophobicContact CG1-CD2 4.35Å; V70-F72 HydrophobicContact CG1-CE2 3.61Å; V70-F72 HydrophobicContact CG1-CZ 3.74Å
71	Y	84.8	Confident	63.4	Low	2 Å²	2	67.5 Å²	67.5	1%	0.008	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.5	-173.6	-58.7	-92.9	0	0	0	110.4	G21 V22 L24 L27 E50 L53 V59 R60 M61 M69	G21-Y71 CarbonylContact C-O 3.49Å; G21-Y71 VanDerWaalsContact CA-O 3.28Å; G21-Y71 WeakPolarHBondContact CA-O 3.41Å; V22-Y71 PolarHBondContact N-O 3.02Å; V22-Y71 WeakPolarHBondContact O-CD2 3.37Å; V22-Y71 PolarHBondContact O-N 3.21Å; L24-Y71 HydrophobicContact CB-CE2 3.84Å; L24-Y71 HydrophobicContact CD1-CE2 3.96Å; L27-Y71 HydrophobicContact CD2-CD2 4.4Å; L27-Y71 HydrophobicContact CD2-CG 4.22Å; E50-Y71 VanDerWaalsContact CG-OH 3.23Å; E50-Y71 WeakPolarHBondContact CG-OH 3.44Å; L53-Y71 HydrophobicContact CB-CD1 4.02Å; L53-Y71 HydrophobicContact CB-CE1 3.81Å; L53-Y71 HydrophobicContact CD1-CD1 3.61Å; L53-Y71 HydrophobicContact CD1-CE1 3.38Å; L53-Y71 HydrophobicContact CD1-CE2 4.41Å; L53-Y71 HydrophobicContact CD1-CG 4.2Å; L53-Y71 HydrophobicContact CG-CD1 4.31Å; L53-Y71 HydrophobicContact CG-CE1 4.21Å; V59-Y71 HydrophobicContact CG1-CD1 4.07Å; R60-Y71 WeakPolarHBondContact O-CA 3.19Å; M61-Y71 HydrophobicContact CE-CE1 3.59Å; M61-Y71 WeakPolarHBondContact CE-OH 3.21Å; M61-Y71 HydrophobicContact CG-CD1 3.62Å; M61-Y71 HydrophobicContact CG-CE1 3.51Å; M61-Y71 HydrophobicContact SD-CD1 4.35Å; M61-Y71 HydrophobicContact SD-CE1 3.68Å; M69-Y71 HydrophobicContact CB-CE2 4.49Å
72	F	80.9	Confident	61.4	Low	30 Å²	30	68 Å²	68	13%	0.132	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	157.8	-179.7	-54.6	-107.2	0	0	0	110.6	G20 G21 V59 R60 E62 V70	G20-F72 VanDerWaalsContact C-CE1 3.49Å; G20-F72 WeakPolarHBondContact O-CE1 3.23Å; G21-F72 VanDerWaalsContact CA-CD1 3.48Å; G21-F72 VanDerWaalsContact CA-CE1 3.49Å; V59-F72 CarbonylContact C-O 3.52Å; V59-F72 WeakPolarHBondContact CA-O 3.32Å; R60-F72 HydrophobicContact CG-CB 3.72Å; R60-F72 HydrophobicContact CG-CD2 4.5Å; R60-F72 PolarHBondContact N-O 3.38Å; R60-F72 PolarHBondContact O-N 3.42Å; E62-F72 HydrophobicContact CB-CD2 4.47Å; E62-F72 HydrophobicContact CB-CE2 3.95Å; E62-F72 HydrophobicContact CG-CD2 4.35Å; E62-F72 HydrophobicContact CG-CE2 4.2Å; V70-F72 HydrophobicContact CB-CE2 3.85Å; V70-F72 HydrophobicContact CB-CZ 4.29Å; V70-F72 HydrophobicContact CG1-CD2 4.35Å; V70-F72 HydrophobicContact CG1-CE2 3.61Å; V70-F72 HydrophobicContact CG1-CZ 3.74Å
73	S	78.6	Confident	59.4	Low	12 Å²	12	64.5 Å²	64.5	8%	0.084	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	141.6	172.7	171.3	0	0	0	0	108.5	H12 G75 A76	H12-S73 PolarHBondContact NE2-OG 3.49Å; S73-G75 PolarHBondContact O-N 2.99Å; S73-G75 VanDerWaalsContact O-N 3.13Å; S73-A76 WeakPolarHBondContact O-CB 3.37Å; S73-A76 PolarHBondContact O-N 3.38Å
74	A	64.4	Low	57.9	Low	56 Å²	56	57.1 Å²	57.1	46%	0.463	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-31.3	178.7	0	0	0	0	0	112.4	S58	S58-A74 PolarHBondContact O-N 3.32Å
75	G	53.7	Low	56.8	Low	20 Å²	20	57.4 Å²	57.4	21%	0.206	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	0.4	177.2	0	0	0	0	0	116	S73 K77 E78	S73-G75 PolarHBondContact O-N 2.99Å; S73-G75 VanDerWaalsContact O-N 3.13Å; G75-K77 PolarHBondContact O-N 3.21Å; G75-E78 WeakPolarHBondContact O-CB 3.46Å; G75-E78 WeakPolarHBondContact O-CG 3.37Å; G75-E78 PolarHBondContact O-N 3.35Å
76	A	45	Very low	56.1	Low	41 Å²	41	54.4 Å²	54.4	34%	0.339	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-5.2	-169.4	0	0	0	0	0	116.3	S73 E78	S73-A76 WeakPolarHBondContact O-CB 3.37Å; S73-A76 PolarHBondContact O-N 3.38Å; A76-E78 VanDerWaalsContact C-N 3.33Å
77	K	40.3	Very low	55.1	Low	163 Å²	163	49.6 Å²	49.6	71%	0.709	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-2.8	168.6	-72.4	-172.8	176	-177.6	0	113.9	G75 A79 A80	G75-K77 PolarHBondContact O-N 3.21Å; K77-A79 VanDerWaalsContact C-N 3.26Å; K77-A79 PolarHBondContact O-N 2.89Å; K77-A80 PolarHBondContact O-N 3.38Å
78	E	40.4	Very low	54.4	Low	121 Å²	121	47.9 Å²	47.9	57%	0.565	27%	0.274	S	S	*	.	H	α-helix	trans	-66.3	-15.8	-174.4	-79.1	167.6	-174.1	0	0	115	G75 A76 H81 T82	G75-E78 WeakPolarHBondContact O-CB 3.46Å; G75-E78 WeakPolarHBondContact O-CG 3.37Å; G75-E78 PolarHBondContact O-N 3.35Å; A76-E78 VanDerWaalsContact C-N 3.33Å; E78-H81 PolarHBondContact O-N 2.85Å; E78-T82 WeakPolarHBondContact O-CB 3.35Å; E78-T82 PolarHBondContact O-N 3.45Å; E78-T82 PolarHBondContact O-OG1 2.84Å
79	A	38.3	Very low	52.7	Low	31 Å²	31	48 Å²	48	26%	0.256	27%	0.274	S	S	.	.	H	α-helix	trans	-64.7	-49.3	176.3	0	0	0	0	0	111.7	K77 T82 A83 E592	K77-A79 VanDerWaalsContact C-N 3.26Å; K77-A79 PolarHBondContact O-N 2.89Å; A79-T82 PolarHBondContact O-N 3.4Å; A79-A83 PolarHBondContact O-N 2.99Å; A79-A83 VanDerWaalsContact O-N 3.13Å; A79-E592 VanDerWaalsContact CB-OE1 3.23Å; A79-E592 WeakPolarHBondContact CB-OE1 3.31Å
80	A	36.1	Very low	51	Low	62 Å²	62	52.6 Å²	52.6	51%	0.512	29%	0.289	S	S	.	.	H	α-helix	trans	-65	-39.7	174.3	0	0	0	0	0	112.2	K77 A83 K84	K77-A80 PolarHBondContact O-N 3.38Å; A80-A83 PolarHBondContact O-N 3.32Å; A80-K84 WeakPolarHBondContact O-CB 3.16Å; A80-K84 PolarHBondContact O-N 3.26Å
81	H	39.4	Very low	48.9	Very low	86 Å²	86	53.1 Å²	53.1	40%	0.398	29%	0.293	S	S	.	.	H	α-helix	trans	-68.8	-34.2	176.8	-175.2	70.1	0	0	0	112.3	E78 K84 V85 E521	E78-H81 PolarHBondContact O-N 2.85Å; H81-K84 WeakPolarHBondContact O-CB 3.15Å; H81-K84 PolarHBondContact O-N 3.39Å; H81-V85 WeakPolarHBondContact O-CB 3.45Å; H81-V85 VanDerWaalsContact O-CG2 3.28Å; H81-V85 WeakPolarHBondContact O-CG2 3.37Å; H81-V85 PolarHBondContact O-N 3.34Å; H81-E521 IonicContact CE1-OE1 2.68Å; H81-E521 PolarHBondContact CE1-OE1 2.78Å; H81-E521 VanDerWaalsContact CE1-OE1 3.28Å; H81-E521 IonicContact ND1-OE1 3.55Å; H81-E521 PolarHBondContact ND1-OE1 3.2Å
82	T	39.5	Very low	46.6	Very low	77 Å²	77	56.3 Å²	56.3	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-67.8	-40.6	175.7	-57.1	0	0	0	0	110.8	E78 A79 V85 V86	E78-T82 WeakPolarHBondContact O-CB 3.35Å; E78-T82 PolarHBondContact O-N 3.45Å; E78-T82 PolarHBondContact O-OG1 2.84Å; A79-T82 PolarHBondContact O-N 3.4Å; T82-V85 PolarHBondContact O-N 3.41Å; T82-V86 HydrophobicContact CG2-CG2 3.95Å; T82-V86 VanDerWaalsContact O-CB 3.24Å; T82-V86 WeakPolarHBondContact O-CB 3.39Å; T82-V86 WeakPolarHBondContact O-CG2 3.3Å; T82-V86 PolarHBondContact O-N 2.67Å
83	A	38.1	Very low	44.3	Very low	11 Å²	11	62.5 Å²	62.5	9%	0.091	34%	0.343	C	S	.	.	H	α-helix	trans	-63.1	-43.9	172	0	0	0	0	0	111.8	A79 A80 V85 V86 A87	A79-A83 PolarHBondContact O-N 2.99Å; A79-A83 VanDerWaalsContact O-N 3.13Å; A80-A83 PolarHBondContact O-N 3.32Å; A83-V85 VanDerWaalsContact C-N 3.34Å; A83-V85 PolarHBondContact O-N 2.74Å; A83-V86 PolarHBondContact O-N 2.88Å; A83-A87 VanDerWaalsContact O-CB 3.27Å; A83-A87 WeakPolarHBondContact O-CB 3.4Å; A83-A87 PolarHBondContact O-N 2.92Å
84	K	44.4	Very low	42.5	Very low	35 Å²	35	72.9 Å²	72.9	15%	0.152	38%	0.38	C	S	.	.	H	α-helix	trans	-56.4	-44	174.7	-161.8	-169.5	-169.7	-155.1	0	112.1	A80 H81 R88 E521 E549	A80-K84 WeakPolarHBondContact O-CB 3.16Å; A80-K84 PolarHBondContact O-N 3.26Å; H81-K84 WeakPolarHBondContact O-CB 3.15Å; H81-K84 PolarHBondContact O-N 3.39Å; K84-R88 WeakPolarHBondContact O-CG 3.39Å; K84-E521 WeakPolarHBondContact CE-OE2 3.2Å; K84-E521 IonicContact NZ-OE1 2.73Å; K84-E521 PolarHBondContact NZ-OE1 3.03Å; K84-E521 IonicContact NZ-OE2 3.57Å; K84-E521 PolarHBondContact NZ-OE2 3.48Å; K84-E549 WeakPolarHBondContact CE-OE1 3.43Å; K84-E549 IonicContact NZ-OE1 2.84Å; K84-E549 PolarHBondContact NZ-OE1 2.65Å
85	V	42	Very low	41	Very low	32 Å²	32	77.3 Å²	77.3	19%	0.194	40%	0.402	C	S	.	.	H	α-helix	trans	-79.3	-38.9	-179.6	171.8	0	0	0	0	112.4	H81 T82 A83 A87 R88 Q89	H81-V85 WeakPolarHBondContact O-CB 3.45Å; H81-V85 VanDerWaalsContact O-CG2 3.28Å; H81-V85 WeakPolarHBondContact O-CG2 3.37Å; H81-V85 PolarHBondContact O-N 3.34Å; T82-V85 PolarHBondContact O-N 3.41Å; A83-V85 VanDerWaalsContact C-N 3.34Å; A83-V85 PolarHBondContact O-N 2.74Å; V85-A87 PolarHBondContact O-N 2.71Å; V85-R88 PolarHBondContact O-N 2.8Å; V85-Q89 HydrophobicContact CG1-CG 3.9Å; V85-Q89 VanDerWaalsContact CG1-NE2 3.26Å; V85-Q89 WeakPolarHBondContact O-CB 3.49Å; V85-Q89 WeakPolarHBondContact O-CG 3.49Å; V85-Q89 PolarHBondContact O-N 3.13Å
86	V	43.5	Very low	39.7	Very low	37 Å²	37	79.4 Å²	79.4	22%	0.224	42%	0.423	C	S	.	.	H	α-helix	trans	-68.3	-35.1	178.7	169.6	0	0	0	0	111.6	T82 A83 R88 R90 G597	T82-V86 HydrophobicContact CG2-CG2 3.95Å; T82-V86 VanDerWaalsContact O-CB 3.24Å; T82-V86 WeakPolarHBondContact O-CB 3.39Å; T82-V86 WeakPolarHBondContact O-CG2 3.3Å; T82-V86 PolarHBondContact O-N 2.67Å; A83-V86 PolarHBondContact O-N 2.88Å; V86-R88 VanDerWaalsContact C-N 3.25Å; V86-R88 PolarHBondContact O-N 2.91Å; V86-R90 PolarHBondContact O-N 2.87Å; V86-G597 VanDerWaalsContact CG1-O 3.28Å; V86-G597 WeakPolarHBondContact CG1-O 3.43Å
87	A	42.3	Very low	38.8	Very low	2 Å²	2	89.3 Å²	89.3	2%	0.017	45%	0.452	C	S	.	.	H	α-helix	trans	-65.5	-26.1	173.8	0	0	0	0	0	113.7	A83 V85 L462 M464 R475	A83-A87 VanDerWaalsContact O-CB 3.27Å; A83-A87 WeakPolarHBondContact O-CB 3.4Å; A83-A87 PolarHBondContact O-N 2.92Å; V85-A87 PolarHBondContact O-N 2.71Å; A87-L462 HydrophobicContact CB-CD2 4.01Å; A87-M464 HydrophobicContact CB-CE 3.32Å; A87-M464 HydrophobicContact CB-SD 3.72Å; A87-R475 PolarHBondContact O-NH2 3.08Å
88	R	48.5	Very low	38.1	Very low	6 Å²	6	89.8 Å²	89.8	2%	0.023	46%	0.457	C	S	.	.	H	α-helix	trans	-91.8	-34.1	174.9	-65.8	179.8	-173.2	162.5	-0.2	113.9	K84 V85 V86 R90 S91 S92 E521 E522	K84-R88 WeakPolarHBondContact O-CG 3.39Å; V85-R88 PolarHBondContact O-N 2.8Å; V86-R88 VanDerWaalsContact C-N 3.25Å; V86-R88 PolarHBondContact O-N 2.91Å; R88-R90 VanDerWaalsContact C-N 3.25Å; R88-R90 PolarHBondContact O-N 3.33Å; R88-S91 PolarHBondContact O-OG 3.48Å; R88-S91 VanDerWaalsContact O-OG 3.1Å; R88-S92 PolarHBondContact O-N 3Å; R88-S92 PolarHBondContact O-OG 2.94Å; R88-E521 IonicContact CZ-OE2 3.76Å; R88-E521 IonicContact NH1-OE2 2.72Å; R88-E521 PolarHBondContact NH1-OE2 3.44Å; R88-E521 IonicContact NH2-OE2 3.15Å; R88-E521 PolarHBondContact NH2-OE2 3.22Å; R88-E522 WeakPolarHBondContact CD-OE1 3.47Å; R88-E522 IonicContact CZ-OE1 3.44Å; R88-E522 IonicContact NE-OE1 3.36Å; R88-E522 IonicContact NH1-OE1 2.68Å; R88-E522 PolarHBondContact NH1-OE1 3.05Å
89	Q	42.8	Very low	37.5	Very low	100 Å²	100	92.8 Å²	92.8	47%	0.467	47%	0.47	S	S	.	.	H	α-helix	trans	-71.2	-16.5	-179.7	-80	-169.3	13.3	0	0	114.1	V85	V85-Q89 HydrophobicContact CG1-CG 3.9Å; V85-Q89 VanDerWaalsContact CG1-NE2 3.26Å; V85-Q89 WeakPolarHBondContact O-CB 3.49Å; V85-Q89 WeakPolarHBondContact O-CG 3.49Å; V85-Q89 PolarHBondContact O-N 3.13Å
90	R	43.5	Very low	37.2	Very low	152 Å²	152	98.5 Å²	98.5	57%	0.574	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-20.3	179.6	-74.3	-170.6	172.9	-162.3	-1.7	114.7	V86 R88	V86-R90 PolarHBondContact O-N 2.87Å; R88-R90 VanDerWaalsContact C-N 3.25Å; R88-R90 PolarHBondContact O-N 3.33Å
91	S	40.4	Very low	37.3	Very low	39 Å²	39	98.2 Å²	98.2	27%	0.273	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-36.5	170.7	45.5	0	0	0	0	112.3	R88 D486	R88-S91 PolarHBondContact O-OG 3.48Å; R88-S91 VanDerWaalsContact O-OG 3.1Å; S91-D486 WeakPolarHBondContact CB-OD1 3.47Å
92	S	35.8	Very low	37.1	Very low	70 Å²	70	97.5 Å²	97.5	49%	0.49	49%	0.487	S	S	.	.	S	Bend	trans	-81.9	-13.8	-167.4	49.8	0	0	0	0	117.3	R88 R94	R88-S92 PolarHBondContact O-N 3Å; R88-S92 PolarHBondContact O-OG 2.94Å; S92-R94 PolarHBondContact O-N 2.9Å; S92-R94 VanDerWaalsContact O-N 3.16Å
93	K	32.9	Very low	36.9	Very low	160 Å²	160	97.6 Å²	97.6	70%	0.696	49%	0.487	S	S	*	.			trans	-88.7	82.8	-173.8	-77.7	-174.9	178.3	172.8	0	114.5
94	R	41.4	Very low	36.9	Very low	229 Å²	229	104.1 Å²	104.1	86%	0.864	52%	0.515	S	S	*	.			trans	-58.9	143.8	154.5	-107.8	178.4	172.4	173.6	0.4	110.3	S92	S92-R94 PolarHBondContact O-N 2.9Å; S92-R94 VanDerWaalsContact O-N 3.16Å
95	T	32.6	Very low	36.5	Very low	149 Å²	149	105.5 Å²	105.5	91%	0.914	52%	0.523	S	S	*	.	S	Bend	trans	80.3	76	178.4	71.4	0	0	0	0	117.3
96	G	26.1	Very low	36.7	Very low	64 Å²	64	108 Å²	108	66%	0.66	53%	0.529	S	S	*	.	S	Bend	trans	-176.1	143.1	162.2	0	0	0	0	0	109.7	H98	G96-H98 PolarHBondContact O-N 2.9Å
97	R	25.6	Very low	36.3	Very low	249 Å²	249	110.3 Å²	110.3	94%	0.94	54%	0.543	S	S	*	.			trans	-55.1	130.6	172.6	-85.2	-179.6	170.9	171.2	-4	108.6	H99	R97-H99 PolarHBondContact O-N 3.11Å
98	H	26.1	Very low	35.6	Very low	174 Å²	174	117.1 Å²	117.1	81%	0.806	57%	0.573	S	S	*	*			trans	-50.6	114.4	171.8	-67.7	-93.4	0	0	0	108.7	G96 L100	G96-H98 PolarHBondContact O-N 2.9Å; H98-L100 VanDerWaalsContact C-N 3.31Å; H98-L100 PolarHBondContact O-N 3.19Å
99	H	28.4	Very low	34.3	Very low	183 Å²	183	123.5 Å²	123.5	85%	0.847	62%	0.615	S	S	*	*			trans	-72.8	98.3	166	-144	71.6	0	0	0	104.7	R97 V101	R97-H99 PolarHBondContact O-N 3.11Å; H99-V101 PolarHBondContact O-N 3.38Å
100	L	32.2	Very low	33.5	Very low	152 Å²	152	120.8 Å²	120.8	80%	0.796	61%	0.609	S	S	*	*			trans	-58.2	109.4	170.9	-80.3	93.1	0	0	0	106.4	H98 N102	H98-L100 VanDerWaalsContact C-N 3.31Å; H98-L100 PolarHBondContact O-N 3.19Å; L100-N102 PolarHBondContact O-N 3.35Å
101	V	37.1	Very low	32.5	Very low	56 Å²	56	118.9 Å²	118.9	34%	0.339	61%	0.614	S	S	.	*			trans	-56.6	136.2	158.1	-177.6	0	0	0	0	105.4	H99 T103	H99-V101 PolarHBondContact O-N 3.38Å; V101-T103 PolarHBondContact O-N 3.23Å
102	N	36.8	Very low	31.7	Very low	71 Å²	71	120.6 Å²	120.6	38%	0.38	63%	0.625	S	S	.	*			trans	-67.2	97.6	178.2	-172.7	19	0	0	0	108.8	L100 Q104 T618	L100-N102 PolarHBondContact O-N 3.35Å; N102-Q104 PolarHBondContact O-N 2.97Å; N102-T618 PolarHBondContact O-OG1 3.5Å
103	T	35.3	Very low	31.2	Very low	79 Å²	79	120 Å²	120	49%	0.485	62%	0.616	S	S	.	*			trans	-84.1	5.6	-177	51.7	0	0	0	0	113	V101	V101-T103 PolarHBondContact O-N 3.23Å
104	Q	36.9	Very low	30.8	Very low	147 Å²	147	115.5 Å²	115.5	69%	0.687	60%	0.601	S	S	*	*	S	Bend	trans	-98.3	118.5	171.2	-67	-175.2	-8.7	0	0	109.5	N102 R106	N102-Q104 PolarHBondContact O-N 2.97Å; Q104-R106 PolarHBondContact O-N 3.04Å
105	M	36.3	Very low	30.1	Very low	64 Å²	64	105.9 Å²	105.9	32%	0.315	57%	0.567	S	S	.	*			trans	-57.7	122.1	163.9	-174.9	172.8	69.5	0	0	108.1	V107 Y458 L601 D623	M105-V107 HydrophobicContact CE-CG2 4.08Å; M105-V107 PolarHBondContact O-N 2.93Å; M105-Y458 HydrophobicContact CE-CE1 4.37Å; M105-Y458 HydrophobicContact SD-CE1 4.4Å; M105-L601 HydrophobicContact CB-CD2 4.17Å; M105-D623 VanDerWaalsContact CA-OD2 3.32Å; M105-D623 WeakPolarHBondContact CA-OD2 3.39Å; M105-D623 WeakPolarHBondContact CG-OD2 3.19Å
106	R	47	Very low	29.8	Very low	85 Å²	85	101.8 Å²	101.8	32%	0.321	54%	0.54	S	S	.	.			trans	-78	80.5	174.6	-72.4	165.3	-67.4	-157	-4.9	108.3	Q104 K108 T618 Q620 D621 D623	Q104-R106 PolarHBondContact O-N 3.04Å; R106-K108 PolarHBondContact O-N 3.25Å; R106-T618 PolarHBondContact NH2-O 2.85Å; R106-T618 VanDerWaalsContact NH2-O 3.14Å; R106-Q620 PolarHBondContact NH1-O 2.99Å; R106-Q620 PolarHBondContact NH2-O 2.76Å; R106-D621 PolarHBondContact NE-O 3.23Å; R106-D621 PolarHBondContact NH1-O 3.23Å; R106-D623 IonicContact CZ-OD1 3.51Å; R106-D623 PolarHBondContact N-OD2 3.38Å; R106-D623 IonicContact NE-OD1 2.7Å; R106-D623 PolarHBondContact NE-OD1 3.32Å; R106-D623 IonicContact NH2-OD1 3.48Å; R106-D623 PolarHBondContact NH2-OD1 3.32Å
107	V	34.6	Very low	30.2	Very low	86 Å²	86	99.8 Å²	99.8	52%	0.521	52%	0.517	S	S	.	.			trans	-49.9	110	165.7	-173.9	0	0	0	0	107.4	M105	M105-V107 HydrophobicContact CE-CG2 4.08Å; M105-V107 PolarHBondContact O-N 2.93Å
108	K	26.9	Very low	30.9	Very low	145 Å²	145	95 Å²	95	63%	0.63	50%	0.503	S	S	*	.			trans	-55.7	131.3	170.8	-75.5	-179.3	176.4	173.3	0	106.8	R106 A110 D622	R106-K108 PolarHBondContact O-N 3.25Å; K108-A110 PolarHBondContact O-N 3.28Å; K108-D622 WeakPolarHBondContact CE-OD1 3.48Å; K108-D622 IonicContact NZ-OD1 3.28Å; K108-D622 PolarHBondContact NZ-OD1 3.32Å
109	P	22.3	Very low	31.9	Very low	140 Å²	140	86.8 Å²	86.8	91%	0.909	47%	0.465	S	S	*	.	S	Bend	trans	-71.9	76.3	-170.8	28.2	-35.4	0	0	0	111.9
110	A	24.6	Very low	33.1	Very low	42 Å²	42	83.1 Å²	83.1	35%	0.347	45%	0.448	S	S	.	.			trans	-92.3	119.7	150.6	0	0	0	0	0	106.3	K108 P112	K108-A110 PolarHBondContact O-N 3.28Å; A110-P112 VanDerWaalsContact O-CD 3.23Å; A110-P112 WeakPolarHBondContact O-CD 3.27Å; A110-P112 VanDerWaalsContact O-N 3.12Å
111	V	22.2	Very low	33.8	Very low	113 Å²	113	78.4 Å²	78.4	69%	0.685	43%	0.426	S	S	*	.			trans	-54.9	115.9	-177.7	179.9	0	0	0	0	109.4	L113	V111-L113 PolarHBondContact O-N 3.09Å
112	P	24.4	Very low	34.5	Very low	75 Å²	75	80 Å²	80	49%	0.487	44%	0.439	S	S	.	.			trans	-67.4	120.3	-173.5	-23.2	34.8	0	0	0	111.8	A110 V114	A110-P112 VanDerWaalsContact O-CD 3.23Å; A110-P112 WeakPolarHBondContact O-CD 3.27Å; A110-P112 VanDerWaalsContact O-N 3.12Å; P112-V114 VanDerWaalsContact C-N 3.31Å; P112-V114 HydrophobicContact CB-CG2 4Å; P112-V114 PolarHBondContact O-N 3.18Å; P112-V114 VanDerWaalsContact O-N 3.1Å
113	L	25.2	Very low	35.5	Very low	57 Å²	57	78.3 Å²	78.3	30%	0.298	43%	0.43	S	S	.	.			trans	-83.7	80.4	168.5	-67.2	-176	0	0	0	108.9	V111 L115 H722 K1061	V111-L113 PolarHBondContact O-N 3.09Å; L113-L115 VanDerWaalsContact C-N 3.28Å; L113-L115 PolarHBondContact O-N 3.39Å; L113-H722 PolarHBondContact N-ND1 3.41Å; L113-K1061 HydrophobicContact CD1-CD 3.89Å; L113-K1061 HydrophobicContact CD2-CB 3.66Å; L113-K1061 HydrophobicContact CD2-CD 3.81Å; L113-K1061 HydrophobicContact CD2-CG 4.43Å
114	V	24.3	Very low	36.6	Very low	65 Å²	65	79.7 Å²	79.7	39%	0.394	43%	0.426	S	S	.	.			trans	-70	82.7	-179.4	-174.2	0	0	0	0	110.2	P112 N116 P1063	P112-V114 VanDerWaalsContact C-N 3.31Å; P112-V114 HydrophobicContact CB-CG2 4Å; P112-V114 PolarHBondContact O-N 3.18Å; P112-V114 VanDerWaalsContact O-N 3.1Å; V114-N116 PolarHBondContact O-N 3.13Å; V114-P1063 WeakPolarHBondContact O-CD 3.42Å; V114-P1063 WeakPolarHBondContact O-CG 3.41Å
115	L	26.7	Very low	36.4	Very low	28 Å²	28	81.3 Å²	81.3	15%	0.147	43%	0.434	C	S	.	.			trans	-85.9	15.6	-177.5	-120.5	168.8	0	0	0	113.6	L113 V726 Y932 W947	L113-L115 VanDerWaalsContact C-N 3.28Å; L113-L115 PolarHBondContact O-N 3.39Å; L115-V726 HydrophobicContact CD1-CG2 4.08Å; L115-Y932 HydrophobicContact CD1-CE2 4.34Å; L115-Y932 HydrophobicContact CD2-CD2 3.83Å; L115-Y932 HydrophobicContact CD2-CE2 3.33Å; L115-Y932 HydrophobicContact CG-CE2 3.68Å; L115-W947 HydrophobicContact CD2-CH2 4.09Å; L115-W947 HydrophobicContact CD2-CZ3 4.08Å; L115-W947 WeakPolarHBondContact O-CH2 3.41Å
116	N	27.5	Very low	36.3	Very low	63 Å²	63	82.9 Å²	82.9	34%	0.337	45%	0.449	S	S	.	.			trans	-133.6	-1.4	-156.7	-125	63.4	0	0	0	117	V114 K118 S724	V114-N116 PolarHBondContact O-N 3.13Å; N116-K118 PolarHBondContact O-N 3.06Å; N116-S724 VanDerWaalsContact CG-N 3.3Å; N116-S724 WeakPolarHBondContact ND2-CB 3.26Å; N116-S724 PolarHBondContact ND2-N 3.33Å; N116-S724 PolarHBondContact ND2-OG 3.01Å; N116-S724 PolarHBondContact OD1-N 3.27Å; N116-S724 PolarHBondContact OD1-OG 3.37Å
117	A	34.7	Very low	35.3	Very low	22 Å²	22	86.5 Å²	86.5	18%	0.182	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-69.9	120.8	155.2	0	0	0	0	0	107.5	P119 P1063	A117-P119 WeakPolarHBondContact O-CD 3.34Å; A117-P1063 HydrophobicContact CB-CG 4.24Å; A117-P1063 VanDerWaalsContact O-CB 3.27Å; A117-P1063 WeakPolarHBondContact O-CB 3.47Å; A117-P1063 WeakPolarHBondContact O-CG 3.47Å
118	K	39.4	Very low	34.9	Very low	148 Å²	148	90.8 Å²	90.8	64%	0.643	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-69.9	121.7	157	-178.9	-170.3	172.9	-170.8	0	105.5	N116 Q120	N116-K118 PolarHBondContact O-N 3.06Å; K118-Q120 PolarHBondContact O-N 2.88Å
119	P	48	Very low	35	Very low	2 Å²	2	95.5 Å²	95.5	1%	0.013	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-56.2	134.3	176.7	-21.9	33	0	0	0	109.6	A117 T121 D930 P1063 L1064 V1065	A117-P119 WeakPolarHBondContact O-CD 3.34Å; P119-T121 PolarHBondContact O-N 2.92Å; P119-D930 HydrophobicContact CB-CB 4.11Å; P119-D930 HydrophobicContact CG-CB 4.07Å; P119-P1063 HydrophobicContact CG-CB 3.91Å; P119-L1064 WeakPolarHBondContact CB-O 3.26Å; P119-L1064 WeakPolarHBondContact CG-O 3.47Å; P119-V1065 HydrophobicContact CB-CG2 3.55Å
120	Q	53.3	Low	35.3	Very low	106 Å²	106	92.3 Å²	92.3	50%	0.495	50%	0.495	S	S	.	.			trans	-85.3	98.4	176.8	-65.8	-158.2	18.2	0	0	108.6	K118 S122 V1065 T1089	K118-Q120 PolarHBondContact O-N 2.88Å; Q120-S122 CarbonylContact O-C 3.53Å; Q120-S122 PolarHBondContact O-N 2.72Å; Q120-V1065 WeakPolarHBondContact O-CG2 3.34Å; Q120-T1089 PolarHBondContact N-OG1 2.94Å; Q120-T1089 VanDerWaalsContact N-OG1 3.11Å
121	T	46.4	Very low	35.4	Very low	53 Å²	53	101.7 Å²	101.7	33%	0.325	52%	0.522	S	S	.	.	S	Bend	trans	-44.6	-32.8	173.4	50.3	0	0	0	0	113.5	P119 L123 N928 D930	P119-T121 PolarHBondContact O-N 2.92Å; T121-L123 PolarHBondContact O-N 3.06Å; T121-N928 PolarHBondContact O-ND2 2.82Å; T121-D930 VanDerWaalsContact CG2-CG 3.48Å; T121-D930 WeakPolarHBondContact CG2-OD1 3.38Å; T121-D930 WeakPolarHBondContact CG2-OD2 3.47Å
122	S	51.2	Low	35.6	Very low	88 Å²	88	100.1 Å²	100.1	62%	0.615	53%	0.528	S	S	*	.	S	Bend	trans	-82.6	83.9	173.1	-56.7	0	0	0	0	110.1	Q120 R124	Q120-S122 CarbonylContact O-C 3.53Å; Q120-S122 PolarHBondContact O-N 2.72Å; S122-R124 PolarHBondContact O-N 3.44Å
123	L	57.8	Low	35.8	Very low	36 Å²	36	108.3 Å²	108.3	19%	0.188	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-53.5	137.8	167.9	-63.5	175.4	0	0	0	109.8	T121 N928 V1065 V1087 T1089 D1095 W1097	T121-L123 PolarHBondContact O-N 3.06Å; L123-N928 WeakPolarHBondContact CD1-ND2 3.42Å; L123-N928 WeakPolarHBondContact CG-ND2 3.23Å; L123-V1065 HydrophobicContact CD2-CB 4.17Å; L123-V1065 HydrophobicContact CD2-CG1 4.08Å; L123-V1065 HydrophobicContact CD2-CG2 4.31Å; L123-V1065 HydrophobicContact CG-CG1 4.43Å; L123-V1087 HydrophobicContact CD1-CG2 4.41Å; L123-V1087 HydrophobicContact CD2-CB 4.03Å; L123-V1087 HydrophobicContact CD2-CG1 3.89Å; L123-V1087 HydrophobicContact CD2-CG2 4.21Å; L123-T1089 HydrophobicContact CD2-CG2 3.86Å; L123-D1095 WeakPolarHBondContact CA-OD2 3.16Å; L123-W1097 HydrophobicContact CD1-CH2 3.91Å; L123-W1097 HydrophobicContact CD1-CZ2 3.89Å
124	R	58	Low	35.9	Very low	109 Å²	109	109.4 Å²	109.4	41%	0.411	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-65.8	134.9	177.3	-60.1	-178.9	-176.7	-147.2	3.4	108	S122 E1092 E1093 D1095	S122-R124 PolarHBondContact O-N 3.44Å; R124-E1092 PolarHBondContact NH1-O 3.44Å; R124-E1092 PolarHBondContact NH2-O 3.27Å; R124-E1093 PolarHBondContact NH1-O 3.32Å; R124-D1095 PolarHBondContact N-OD2 3.49Å; R124-D1095 IonicContact NE-OD1 3.1Å
125	Q	34.2	Very low	36.1	Very low	180 Å²	180	111.5 Å²	111.5	84%	0.841	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-61.2	129.6	-179.2	-71.5	-155.6	1.9	0	0	109.9	N127	Q125-N127 PolarHBondContact O-N 2.72Å
126	P	33.8	Very low	36.1	Very low	97 Å²	97	113.9 Å²	113.9	63%	0.63	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-64	116.4	-179.1	24.7	-32.9	0	0	0	108.8	H128	P126-H128 PolarHBondContact O-N 3.49Å; P126-H128 PolarHBondContact O-ND1 3.02Å
127	N	26.8	Very low	36	Very low	162 Å²	162	116 Å²	116	87%	0.866	66%	0.656	S	S	*	*			trans	-49.9	111.1	170.1	-93.1	-33.3	0	0	0	108.2	Q125 R129	Q125-N127 PolarHBondContact O-N 2.72Å; N127-R129 PolarHBondContact O-N 3.43Å
128	H	25.8	Very low	35.5	Very low	175 Å²	175	118.3 Å²	118.3	81%	0.81	68%	0.682	S	S	*	*			trans	-68.8	80.3	-174	-83.2	23.6	0	0	0	111.1	P126 G130	P126-H128 PolarHBondContact O-N 3.49Å; P126-H128 PolarHBondContact O-ND1 3.02Å; H128-G130 PolarHBondContact O-N 2.86Å
129	R	27.6	Very low	35	Very low	244 Å²	244	123.8 Å²	123.8	92%	0.921	70%	0.698	S	S	*	*			trans	-68.9	79.9	155.4	-88.3	-172	168.1	-178	-0.7	108	N127 R131	N127-R129 PolarHBondContact O-N 3.43Å; R129-R131 PolarHBondContact O-N 3.14Å
130	G	29.4	Very low	33.9	Very low	74 Å²	74	127 Å²	127	76%	0.763	73%	0.732	S	S	*	*			trans	-57	112.9	174.3	0	0	0	0	0	110.5	H128	H128-G130 PolarHBondContact O-N 2.86Å
131	R	27.2	Very low	32.7	Very low	239 Å²	239	127.5 Å²	127.5	90%	0.902	75%	0.754	S	S	*	*			trans	-138	64.9	166.2	-129.8	-177.3	-169.3	-156.5	4.4	111	R129 R133	R129-R131 PolarHBondContact O-N 3.14Å; R131-R133 PolarHBondContact O-N 3.47Å
132	G	26.7	Very low	31.7	Very low	79 Å²	79	128 Å²	128	81%	0.814	77%	0.77	S	S	*	*			trans	-60	122.8	162.9	0	0	0	0	0	109.9
133	R	27.4	Very low	30.7	Very low	247 Å²	247	133.7 Å²	133.7	93%	0.932	79%	0.787	S	S	*	*			trans	-133.4	84.7	162.6	-114.6	-171.2	176.5	-154.2	-1.7	109.3	R131	R131-R133 PolarHBondContact O-N 3.47Å
134	G	28.2	Very low	29.3	Very low	80 Å²	80	135.1 Å²	135.1	83%	0.825	81%	0.809	S	S	*	*			trans	-76.6	140.1	160.3	0	0	0	0	0	110.1
135	A	27.8	Very low	27.9	Very low	109 Å²	109	136.9 Å²	136.9	90%	0.901	83%	0.827	S	S	*	*			trans	-139.9	124.3	161.9	0	0	0	0	0	107.2
136	G	26.2	Very low	27.6	Very low	78 Å²	78	135.4 Å²	135.4	80%	0.804	82%	0.818	S	S	*	*			cis	174.9	177.7	-8.4	0	0	0	0	0	110.8
137	A	26.6	Very low	27.3	Very low	109 Å²	109	141 Å²	141	90%	0.901	83%	0.827	S	S	*	*			trans	-166.7	121.4	156.8	0	0	0	0	0	112.2
138	G	24.8	Very low	27.4	Very low	69 Å²	69	142 Å²	142	71%	0.711	83%	0.826	S	S	*	*			trans	101.1	102.7	144.5	0	0	0	0	0	120.2
139	R	28.1	Very low	27.3	Very low	263 Å²	263	139.1 Å²	139.1	99%	0.992	82%	0.821	S	S	*	*			trans	62.5	134.9	143.5	-50.5	173.5	-177.4	-177.1	-0.3	117.5
140	G	25	Very low	27.3	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	82%	0.816	S	S	*	*			cis	163.7	148.6	-3	0	0	0	0	0	110.3
141	A	27	Very low	27.2	Very low	116 Å²	116	139.1 Å²	139.1	96%	0.959	81%	0.806	S	S	*	*			trans	63.4	148.2	-177.1	0	0	0	0	0	116.7
142	G	26.9	Very low	27.3	Very low	64 Å²	64	134.4 Å²	134.4	66%	0.66	80%	0.798	S	S	*	*			cis	168.3	140.4	-9.1	0	0	0	0	0	111.6
143	H	29.5	Very low	27.3	Very low	208 Å²	208	140.6 Å²	140.6	96%	0.963	80%	0.797	S	S	*	*			trans	56.3	150.3	179.2	-67.1	-76.6	0	0	0	117.4
144	G	27.6	Very low	27.3	Very low	65 Å²	65	134.7 Å²	134.7	67%	0.67	78%	0.784	S	S	*	*			cis	175.4	117.2	-8.7	0	0	0	0	0	112.8
145	D	29.7	Very low	27.2	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	78%	0.778	S	S	*	*			trans	64.7	158.1	137.2	-135	-8.7	0	0	0	124.1
146	F	26.9	Very low	27.2	Very low	150 Å²	150	138.4 Å²	138.4	66%	0.658	77%	0.773	S	S	*	*			trans	77.1	98.2	167	-79.9	-86.9	0	0	0	124
147	R	28.7	Very low	27.4	Very low	213 Å²	213	138.9 Å²	138.9	80%	0.804	76%	0.764	S	S	*	*				7.5	134.6	125.5	-54.8	170	170.1	176.2	-3.8	118.4
148	Q	27.8	Very low	27.4	Very low	184 Å²	184	142.5 Å²	142.5	86%	0.86	76%	0.762	S	S	*	*				-174.6	166.9	99.6	-105.6	-174.9	10.2	0	0	115.8
149	T	25.1	Very low	27.5	Very low	115 Å²	115	143.4 Å²	143.4	71%	0.706	76%	0.763	S	S	*	*			trans	-59.2	162.9	-173.5	46.5	0	0	0	0	120.2
150	R	27.1	Very low	27.5	Very low	212 Å²	212	142.3 Å²	142.3	80%	0.8	76%	0.759	S	S	*	*			trans	100.2	125.2	131.7	-102.1	-175.1	132	150.3	0.2	121.7
151	D	27.9	Very low	27.6	Very low	106 Å²	106	144.7 Å²	144.7	57%	0.567	76%	0.764	S	S	*	*			trans	66.5	122.3	131.8	-72.3	-10	0	0	0	123.9
152	L	28.1	Very low	27.4	Very low	140 Å²	140	142.5 Å²	142.5	73%	0.733	75%	0.753	S	S	*	*				80	114.3	129.6	-68.8	169.4	0	0	0	122.2
153	R	27.1	Very low	27.4	Very low	208 Å²	208	146.9 Å²	146.9	79%	0.785	77%	0.767	S	S	*	*				72.4	121.5	128	-86.9	-170.4	163.5	163.2	0.6	122.2
154	D	27.7	Very low	27.5	Very low	124 Å²	124	145.7 Å²	145.7	66%	0.663	76%	0.761	S	S	*	*				84.2	123.4	122.5	-69	-16.1	0	0	0	122.5
155	V	26.3	Very low	28.8	Very low	115 Å²	115	146.8 Å²	146.8	70%	0.697	76%	0.756	S	S	*	*				94.9	100.3	127	167	0	0	0	0	120.2
156	L	26.4	Very low	28.6	Very low	152 Å²	152	148.6 Å²	148.6	80%	0.796	75%	0.754	S	S	*	*				74.1	130.1	128.1	-68.2	-178.2	0	0	0	124.4
157	S	30.2	Very low	28.7	Very low	88 Å²	88	151.2 Å²	151.2	62%	0.615	76%	0.759	S	S	*	*				104	110	125.1	-78	0	0	0	0	123.2
158	E	27.1	Very low	28.6	Very low	184 Å²	184	148.1 Å²	148.1	86%	0.86	76%	0.758	S	S	*	*				84.2	147.1	120.1	-71.3	-162.3	116.1	0	0	125.2
159	A	27.6	Very low	28.7	Very low	88 Å²	88	143.9 Å²	143.9	73%	0.727	75%	0.749	S	S	*	*			trans	93.1	87.5	141.6	0	0	0	0	0	122.7
160	R	28.3	Very low	28.7	Very low	240 Å²	240	143 Å²	143	91%	0.906	75%	0.747	S	S	*	*				68.6	138.7	110.5	-82.3	-173.6	175.7	-177	1.4	124.1
161	S	25.9	Very low	28.9	Very low	121 Å²	121	140 Å²	140	85%	0.846	74%	0.742	S	S	*	*			trans	76	129.2	145.9	-58.8	0	0	0	0	118.8
162	G	24.6	Very low	28.9	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	74%	0.741	S	S	*	*			cis	151.5	-179.9	11.2	0	0	0	0	0	111.3
163	V	26	Very low	29.1	Very low	155 Å²	155	142.2 Å²	142.2	94%	0.939	74%	0.742	S	S	*	*			trans	98.8	133.3	161.8	-170.3	0	0	0	0	119.1
164	H	30.6	Very low	29.1	Very low	184 Å²	184	136.2 Å²	136.2	85%	0.852	74%	0.737	S	S	*	*			trans	-112.1	-161.4	-175.9	-108.2	-39.6	0	0	0	108.7
165	P	55.3	Low	29	Very low	87 Å²	87	140.3 Å²	140.3	57%	0.565	75%	0.745	S	S	*	*			cis	-153.1	-156.8	19.7	45.9	-22.2	0	0	0	118.2
166	Y	26.1	Very low	29.1	Very low	185 Å²	185	143.6 Å²	143.6	73%	0.725	75%	0.749	S	S	*	*			trans	95.4	141.7	172	-55.1	-47.4	0	0	0	115
167	R	29.8	Very low	29	Very low	204 Å²	204	148.4 Å²	148.4	77%	0.77	76%	0.757	S	S	*	*			cis	-155.1	-179.4	-3.6	-113.4	164.4	-159.6	-130.9	2.3	107.7
168	L	25.6	Very low	28.7	Very low	148 Å²	148	147.4 Å²	147.4	78%	0.775	76%	0.761	S	S	*	*			cis	-139.3	-87.5	9.3	-146	175.6	0	0	0	113.6
169	S	29.1	Very low	28.6	Very low	96 Å²	96	146.7 Å²	146.7	67%	0.671	76%	0.763	S	S	*	*			trans	-162	-177.7	-175.6	61.1	0	0	0	0	111
170	S	25.1	Very low	29	Very low	95 Å²	95	150.5 Å²	150.5	66%	0.664	77%	0.77	S	S	*	*			cis	-153.6	113.6	28.5	-166.3	0	0	0	0	112
171	Q	31.9	Very low	29.2	Very low	149 Å²	149	144.8 Å²	144.8	70%	0.696	76%	0.764	S	S	*	*				76.4	139.2	99.9	-67	-177	1.5	0	0	116
172	H	29	Very low	29.1	Very low	120 Å²	120	143.9 Å²	143.9	56%	0.556	76%	0.764	S	S	*	*			cis	-159.4	140.2	20.7	-120.5	-7.8	0	0	0	115.1
173	K	30.8	Very low	29.3	Very low	174 Å²	174	149.5 Å²	149.5	76%	0.757	77%	0.771	S	S	*	*			trans	59	150.1	140.3	-69.9	166.8	178.3	159.9	0	120.4
174	A	27.9	Very low	29.4	Very low	81 Å²	81	153.9 Å²	153.9	67%	0.669	77%	0.771	S	S	*	*			cis	-165.2	158.8	8.3	0	0	0	0	0	116.2
175	Y	25.7	Very low	29.4	Very low	211 Å²	211	150.2 Å²	150.2	83%	0.827	76%	0.763	S	S	*	*			trans	60.4	112.5	148.6	-75.9	-76.3	0	0	0	127.2
176	K	28.2	Very low	28	Very low	184 Å²	184	153.7 Å²	153.7	80%	0.8	78%	0.777	S	S	*	*				36.2	136.1	129.1	-71.2	-171.6	176.9	-179.2	0	125.1
177	R	24.7	Very low	28.2	Very low	252 Å²	252	153.3 Å²	153.3	95%	0.951	78%	0.779	S	S	*	*			trans	78.9	123.4	141.8	-110.7	-173	-166.1	-178.6	4.2	120.2
178	G	22.9	Very low	28	Very low	68 Å²	68	155 Å²	155	70%	0.701	79%	0.786	S	S	*	*			trans	118	139.5	141.4	0	0	0	0	0	118.5
179	N	25.1	Very low	27.9	Very low	168 Å²	168	156.7 Å²	156.7	90%	0.898	79%	0.792	S	S	*	*			trans	76.2	138.1	157.4	-63.8	4.4	0	0	0	122.1
180	L	37.1	Very low	27.9	Very low	168 Å²	168	159.5 Å²	159.5	88%	0.88	80%	0.798	S	S	*	*			trans	-62.4	156.1	154.8	-67.8	155.6	0	0	0	110.3
181	P	32.3	Very low	28.1	Very low	121 Å²	121	161.9 Å²	161.9	79%	0.786	80%	0.803	S	S	*	*				-155.2	159.8	99.9	39.2	-21.2	0	0	0	118
182	A	23.3	Very low	28	Very low	101 Å²	101	159.7 Å²	159.7	84%	0.835	80%	0.801	S	S	*	*			trans	35.5	140.8	139.7	0	0	0	0	0	124
183	E	28.8	Very low	28.2	Very low	188 Å²	188	160.5 Å²	160.5	88%	0.879	82%	0.815	S	S	*	*			trans	-53.8	159.9	166.8	-48.1	175.4	127.9	0	0	115.3
184	R	27.1	Very low	28.2	Very low	247 Å²	247	162.6 Å²	162.6	93%	0.932	82%	0.818	S	S	*	*			trans	-166.1	163.5	136.4	-106.5	172.2	-175.2	-166.9	2.9	112.2
185	P	31.8	Very low	28.4	Very low	107 Å²	107	167.3 Å²	167.3	70%	0.695	82%	0.824	S	S	*	*			trans	-110.2	158.8	-142.8	40.5	-39.4	0	0	0	116.4	K187	P185-K187 PolarHBondContact O-N 2.86Å
186	D	25.3	Very low	28.7	Very low	160 Å²	160	165.7 Å²	165.7	86%	0.856	82%	0.823	S	S	*	*			trans	-87.7	93.4	172.5	-89.8	-41.1	0	0	0	114.2
187	K	30.3	Very low	29	Very low	177 Å²	177	166 Å²	166	77%	0.77	83%	0.825	S	S	*	*			trans	16.6	117.1	138.3	-66	163.9	-174.7	162.4	0	118.8	P185 M189	P185-K187 PolarHBondContact O-N 2.86Å; K187-M189 PolarHBondContact O-N 2.87Å
188	R	26.4	Very low	29.3	Very low	239 Å²	239	162.8 Å²	162.8	90%	0.902	82%	0.82	S	S	*	*			trans	-34.3	130.9	145.4	-86.1	176.9	170.6	157.8	-1.8	112.9
189	M	24.1	Very low	29.5	Very low	184 Å²	184	168.6 Å²	168.6	91%	0.906	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-76.9	140	155	-71.8	-173	71.9	0	0	110.6	K187	K187-M189 PolarHBondContact O-N 2.87Å
190	I	28.5	Very low	29.9	Very low	156 Å²	156	169.9 Å²	169.9	80%	0.8	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-100.5	133.1	173.5	-64	172.9	0	0	0	107.8
191	L	28.4	Very low	29.6	Very low	145 Å²	145	165.2 Å²	165.2	76%	0.759	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.2	150.1	178.6	-93.4	98.9	0	0	0	112.8
192	P	29.9	Very low	29.5	Very low	103 Å²	103	168.6 Å²	168.6	67%	0.669	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-66.3	151.4	177.5	-21.4	33.8	0	0	0	115	R194	P192-R194 PolarHBondContact O-N 2.84Å
193	T	33.9	Very low	29.6	Very low	136 Å²	136	171.9 Å²	171.9	83%	0.834	83%	0.826	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	32.2	-173.7	7.2	0	0	0	0	116.2
194	R	30.5	Very low	29.4	Very low	218 Å²	218	168 Å²	168	82%	0.823	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-21.9	177.2	-168.1	169.2	178.2	-179.9	-1.4	114.5	P192	P192-R194 PolarHBondContact O-N 2.84Å
195	F	32.1	Very low	29.5	Very low	181 Å²	181	167.1 Å²	167.1	79%	0.794	82%	0.816	S	S	*	*	S	Bend	trans	-100.1	10.5	-173	-83.3	-80.7	0	0	0	116.1
196	Q	33.1	Very low	30	Very low	176 Å²	176	169.7 Å²	169.7	82%	0.822	82%	0.824	S	S	*	*	S	Bend	trans	-92.3	8.2	176.7	-84.7	-176.2	-26.7	0	0	114.9
197	K	32.9	Very low	30.8	Very low	191 Å²	191	166.3 Å²	166.3	83%	0.83	81%	0.811	S	S	*	*	S	Bend	trans	-117.5	0.2	-167.6	-126.1	-179.9	-178	-177.1	0	118.1
198	E	31.2	Very low	30.7	Very low	184 Å²	184	166.7 Å²	166.7	86%	0.86	82%	0.815	S	S	*	*	S	Bend	trans	-118.8	11.9	-177.8	-81.2	179.8	153.3	0	0	115.3
199	M	28.1	Very low	30.9	Very low	191 Å²	191	164 Å²	164	94%	0.941	81%	0.813	S	S	*	*	S	Bend	trans	-97.9	5	172.3	-110.5	-173.7	72.8	0	0	114.6
200	Q	32.2	Very low	31.2	Very low	194 Å²	194	162 Å²	162	91%	0.907	81%	0.811	S	S	*	*	S	Bend	trans	-120.7	21.3	-175.4	-109.2	-176.6	-0.7	0	0	114.5
201	A	30.9	Very low	31.1	Very low	71 Å²	71	158.2 Å²	158.2	59%	0.587	81%	0.811	S	S	*	*	S	Bend	trans	-139.1	64.3	-178.2	0	0	0	0	0	113
202	H	29.8	Very low	31.4	Very low	192 Å²	192	157.2 Å²	157.2	89%	0.889	81%	0.813	S	S	*	*	S	Bend	trans	-160.5	29.6	156.3	-92.8	-42.8	0	0	0	115.8
203	L	25.6	Very low	32.3	Very low	169 Å²	169	157.6 Å²	157.6	89%	0.885	82%	0.816	S	S	*	*	S	Bend	trans	-147.1	113.8	161	-68.2	174.7	0	0	0	106.4
204	S	25.8	Very low	31.9	Very low	106 Å²	106	156.9 Å²	156.9	74%	0.741	81%	0.811	S	S	*	*			cis	-144.5	167.5	5.6	-51	0	0	0	0	107.1
205	R	28.8	Very low	31.8	Very low	230 Å²	230	152.8 Å²	152.8	87%	0.868	81%	0.805	S	S	*	*				-174.6	144.9	61	-125.2	171.3	-174.7	172	-0.2	109.6
206	N	42.6	Very low	31.8	Very low	160 Å²	160	150.8 Å²	150.8	86%	0.856	80%	0.802	S	S	*	*			trans	-73.5	140.5	155.2	-153.8	12.1	0	0	0	108.1
207	P	40.7	Very low	31.5	Very low	90 Å²	90	148.5 Å²	148.5	58%	0.584	80%	0.795	S	S	*	*			trans	-149.7	151.1	138.2	32.3	-12.9	0	0	0	118.1
208	Q	29.5	Very low	31.3	Very low	185 Å²	185	147.4 Å²	147.4	86%	0.864	79%	0.793	S	S	*	*			trans	93.3	126.4	137.9	-81.6	163.2	-9.1	0	0	122.6
209	Q	30.6	Very low	31.3	Very low	181 Å²	181	142.7 Å²	142.7	85%	0.846	78%	0.781	S	S	*	*	S	Bend	trans	-70.9	127.7	152	-71.1	170.7	-29.4	0	0	109.9
210	T	29.7	Very low	31.5	Very low	143 Å²	143	143.3 Å²	143.3	88%	0.877	78%	0.779	S	S	*	*			trans	31.2	117.9	144.8	55.2	0	0	0	0	121.2
211	G	27.2	Very low	31.4	Very low	77 Å²	77	137.7 Å²	137.7	79%	0.794	77%	0.772	S	S	*	*			trans	166.9	107.4	158.2	0	0	0	0	0	113.7
212	P	33.5	Very low	32.3	Very low	123 Å²	123	141 Å²	141	80%	0.799	79%	0.788	S	S	*	*			trans	-110.8	-179.1	-175.5	41.7	-34.4	0	0	0	113.4
213	P	49.8	Very low	32.4	Very low	112 Å²	112	135.6 Å²	135.6	73%	0.727	79%	0.785	S	S	*	*			cis	-131	-170	-38.5	31.4	-11.4	0	0	0	112.2
214	V	25.2	Very low	33.3	Very low	120 Å²	120	139.9 Å²	139.9	73%	0.727	79%	0.789	S	S	*	*			trans	147.1	110.6	132.7	170.3	0	0	0	0	114.1
215	N	27.5	Very low	34.1	Very low	133 Å²	133	138.6 Å²	138.6	71%	0.711	79%	0.792	S	S	*	*			trans	55.5	125	143.8	-71.8	-14.6	0	0	0	126.6
216	L	32	Very low	34.9	Very low	139 Å²	139	135.3 Å²	135.3	73%	0.728	79%	0.792	S	S	*	*				77.8	124.1	125.6	-66.1	168.5	0	0	0	122.4
217	N	27.5	Very low	35.6	Very low	127 Å²	127	133.4 Å²	133.4	68%	0.679	79%	0.788	S	S	*	*			trans	57.4	152.5	153.1	-64.5	24.5	0	0	0	117.6
218	E	28.3	Very low	37.5	Very low	168 Å²	168	131.7 Å²	131.7	79%	0.785	77%	0.77	S	S	*	*			cis	-156	-179.3	3.2	-127.9	158.4	-142.3	0	0	109.9
219	S	32.8	Very low	40.1	Very low	86 Å²	86	126.9 Å²	126.9	60%	0.601	75%	0.751	S	S	*	*			trans	-62.5	151.5	179.5	43.6	0	0	0	0	115.5
220	F	32.3	Very low	42.6	Very low	204 Å²	204	120.9 Å²	120.9	90%	0.895	73%	0.727	S	S	*	*				-179.3	159.6	70.9	-92.9	-85	0	0	0	113
221	G	29.9	Very low	45.1	Very low	75 Å²	75	121.2 Å²	121.2	77%	0.773	72%	0.719	S	S	*	*			trans	112.8	133.9	144.2	0	0	0	0	0	120.7
222	P	48.9	Very low	48	Very low	140 Å²	140	122.3 Å²	122.3	91%	0.909	70%	0.703	S	S	*	*			trans	-107.2	158	-179.2	39.1	-33.5	0	0	0	116.6
223	G	32.7	Very low	50.7	Low	80 Å²	80	116.7 Å²	116.7	83%	0.825	67%	0.666	S	S	*	*			trans	-146.7	166.8	-178.1	0	0	0	0	0	116.4
224	R	44.4	Very low	52.6	Low	259 Å²	259	113 Å²	113	98%	0.977	64%	0.64	S	S	*	*			trans	-87.8	165.2	-164.4	-56.6	177.9	-178.4	-155.1	0.4	115.8
225	G	41.9	Very low	55.6	Low	78 Å²	78	110.1 Å²	110.1	80%	0.804	63%	0.625	S	S	*	*			trans	-109.3	158.6	170.8	0	0	0	0	0	115
226	N	45.8	Very low	58.6	Low	162 Å²	162	105.7 Å²	105.7	87%	0.866	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-87.2	156.6	-172.2	-98	-9.8	0	0	0	115.1
227	P	57.2	Low	61.3	Low	119 Å²	119	99 Å²	99	77%	0.773	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-75.3	153	170	32.6	-34.6	0	0	0	112.8
228	Y	81.4	Confident	64.2	Low	55 Å²	55	99.4 Å²	99.4	22%	0.216	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-87.2	162.3	179.6	81.7	-80.1	0	0	0	112.2	P230 V233 P266 E268 A269 D272 W276	Y228-P230 HydrophobicContact CE2-CB 4.26Å; Y228-P230 HydrophobicContact CE2-CG 4.27Å; Y228-P230 VanDerWaalsContact O-CD 3.31Å; Y228-P230 WeakPolarHBondContact O-CD 3.17Å; Y228-V233 HydrophobicContact CD2-CG2 3.84Å; Y228-V233 HydrophobicContact CE2-CB 4.3Å; Y228-V233 HydrophobicContact CE2-CG2 3.97Å; Y228-P266 HydrophobicContact CD1-CB 4Å; Y228-P266 HydrophobicContact CD2-CB 3.88Å; Y228-P266 HydrophobicContact CD2-CG 3.69Å; Y228-P266 HydrophobicContact CE2-CB 4.41Å; Y228-P266 HydrophobicContact CE2-CG 4.44Å; Y228-P266 HydrophobicContact CG-CB 3.65Å; Y228-P266 HydrophobicContact CG-CG 3.78Å; Y228-E268 HydrophobicContact CD1-CB 4.12Å; Y228-E268 HydrophobicContact CE1-CB 3.64Å; Y228-A269 HydrophobicContact CE2-CB 3.76Å; Y228-A269 WeakPolarHBondContact OH-CA 3.41Å; Y228-D272 PolarHBondContact OH-OD2 2.91Å; Y228-W276 HydrophobicContact CE2-CH2 4.21Å; Y228-W276 WeakPolarHBondContact OH-CH2 3.46Å; Y228-W276 VanDerWaalsContact OH-CZ2 3.23Å; Y228-W276 WeakPolarHBondContact OH-CZ2 3.32Å
229	N	84	Confident	66.9	Low	84 Å²	84	95.8 Å²	95.8	45%	0.449	54%	0.538	S	S	.	.			trans	-89.3	110.8	177.8	-177.2	-22.4	0	0	0	111.5	Q231 V233	N229-Q231 PolarHBondContact OD1-N 2.87Å; N229-Q231 VanDerWaalsContact OD1-N 3.09Å; N229-V233 WeakPolarHBondContact O-CG2 3.26Å
230	P	82.7	Confident	69.4	Low	54 Å²	54	91.7 Å²	91.7	35%	0.351	51%	0.51	S	S	.	.	H	α-helix	trans	-69.8	-34.9	-175.5	-20.9	35.6	0	0	0	113.9	Y228 Q232 V233 Q234 W276	Y228-P230 HydrophobicContact CE2-CB 4.26Å; Y228-P230 HydrophobicContact CE2-CG 4.27Å; Y228-P230 VanDerWaalsContact O-CD 3.31Å; Y228-P230 WeakPolarHBondContact O-CD 3.17Å; P230-Q232 PolarHBondContact O-N 3Å; P230-V233 PolarHBondContact O-N 2.56Å; P230-Q234 WeakPolarHBondContact O-CB 3.49Å; P230-Q234 WeakPolarHBondContact O-CG 3.39Å; P230-Q234 PolarHBondContact O-N 3.05Å; P230-W276 HydrophobicContact CB-CZ2 3.98Å
231	Q	82.8	Confident	71.8	Confident	151 Å²	151	82 Å²	82	71%	0.706	47%	0.467	S	S	*	.	H	α-helix	trans	-64.8	-41	-174	-65.1	168.4	-16.7	0	0	111.5	N229 S235	N229-Q231 PolarHBondContact OD1-N 2.87Å; N229-Q231 VanDerWaalsContact OD1-N 3.09Å; Q231-S235 PolarHBondContact O-N 3.06Å; Q231-S235 VanDerWaalsContact O-N 3.11Å
232	Q	86.9	Confident	74	Confident	99 Å²	99	82.3 Å²	82.3	46%	0.463	46%	0.463	S	S	.	.	H	α-helix	trans	-67	-38.3	176.1	-175.2	176.1	63.3	0	0	112	P230 R236	P230-Q232 PolarHBondContact O-N 3Å; Q232-R236 WeakPolarHBondContact O-CG 3.21Å; Q232-R236 PolarHBondContact O-N 3.09Å
233	V	89.8	Confident	75.2	Confident	5 Å²	5	82.5 Å²	82.5	3%	0.03	45%	0.449	C	S	.	.	H	α-helix	trans	-70.7	-42.3	178.7	-179.7	0	0	0	0	110.8	Y228 N229 P230 S235 R236 I237 Y257 L265 P266 A269 W276	Y228-V233 HydrophobicContact CD2-CG2 3.84Å; Y228-V233 HydrophobicContact CE2-CB 4.3Å; Y228-V233 HydrophobicContact CE2-CG2 3.97Å; N229-V233 WeakPolarHBondContact O-CG2 3.26Å; P230-V233 PolarHBondContact O-N 2.56Å; V233-S235 PolarHBondContact O-N 2.96Å; V233-R236 PolarHBondContact O-N 2.84Å; V233-I237 HydrophobicContact CG1-CD1 3.62Å; V233-I237 HydrophobicContact CG1-CG1 4.38Å; V233-I237 WeakPolarHBondContact O-CG1 3.32Å; V233-I237 PolarHBondContact O-N 3.31Å; V233-Y257 HydrophobicContact CG1-CE2 4.18Å; V233-L265 HydrophobicContact CG1-CD1 3.57Å; V233-P266 HydrophobicContact CG2-CG 4.33Å; V233-A269 HydrophobicContact CG1-CB 3.86Å; V233-W276 HydrophobicContact CB-CH2 4.2Å; V233-W276 HydrophobicContact CB-CZ3 4.46Å; V233-W276 HydrophobicContact CG1-CH2 3.96Å; V233-W276 HydrophobicContact CG1-CZ3 3.91Å
234	Q	90.2	Very high	77.1	Confident	35 Å²	35	83.5 Å²	83.5	16%	0.164	43%	0.429	C	S	.	.	H	α-helix	trans	-56.8	-48.4	173.7	-77	-179.5	6	0	0	112.4	P230 R236 I237 R238 W276 H278 I279	P230-Q234 WeakPolarHBondContact O-CB 3.49Å; P230-Q234 WeakPolarHBondContact O-CG 3.39Å; P230-Q234 PolarHBondContact O-N 3.05Å; Q234-R236 VanDerWaalsContact C-N 3.33Å; Q234-R236 PolarHBondContact O-N 2.92Å; Q234-I237 PolarHBondContact O-N 2.83Å; Q234-R238 PolarHBondContact O-N 3.1Å; Q234-W276 HydrophobicContact CG-CD2 3.5Å; Q234-W276 VanDerWaalsContact CG-CD2 3.5Å; Q234-W276 HydrophobicContact CG-CE3 3.59Å; Q234-W276 HydrophobicContact CG-CG 4.02Å; Q234-W276 HydrophobicContact CG-CH2 4.15Å; Q234-W276 HydrophobicContact CG-CZ2 4.07Å; Q234-W276 HydrophobicContact CG-CZ3 3.94Å; Q234-W276 VanDerWaalsContact NE2-CE2 3.29Å; Q234-H278 PolarHBondContact OE1-NE2 3.02Å; Q234-I279 HydrophobicContact CB-CD1 3.93Å; Q234-I279 HydrophobicContact CB-CG1 3.99Å; Q234-I279 HydrophobicContact CG-CD1 4.45Å; Q234-I279 HydrophobicContact CG-CG1 4.02Å
235	S	88.1	Confident	77.9	Confident	60 Å²	60	74.9 Å²	74.9	42%	0.42	41%	0.408	S	S	.	.	H	α-helix	trans	-58.4	-44.8	178.3	-167.8	0	0	0	0	112.1	Q231 V233 R238 E239	Q231-S235 PolarHBondContact O-N 3.06Å; Q231-S235 VanDerWaalsContact O-N 3.11Å; V233-S235 PolarHBondContact O-N 2.96Å; S235-R238 WeakPolarHBondContact O-CB 3.41Å; S235-R238 PolarHBondContact O-N 3.16Å; S235-E239 PolarHBondContact O-N 2.93Å
236	R	91.4	Very high	79	Confident	39 Å²	39	77.1 Å²	77.1	15%	0.147	40%	0.402	C	S	.	.	H	α-helix	trans	-68.7	-34.7	179.5	-74.2	176.3	171.7	179.4	-2.2	113.2	Q232 V233 Q234 E239 I240 Y257 Y261	Q232-R236 WeakPolarHBondContact O-CG 3.21Å; Q232-R236 PolarHBondContact O-N 3.09Å; V233-R236 PolarHBondContact O-N 2.84Å; Q234-R236 VanDerWaalsContact C-N 3.33Å; Q234-R236 PolarHBondContact O-N 2.92Å; R236-E239 PolarHBondContact O-N 2.98Å; R236-I240 VanDerWaalsContact O-CG1 3.28Å; R236-I240 WeakPolarHBondContact O-CG1 3.35Å; R236-I240 PolarHBondContact O-N 3.4Å; R236-Y257 HydrophobicContact CB-CD2 4.38Å; R236-Y257 HydrophobicContact CB-CE2 3.59Å; R236-Y257 VanDerWaalsContact CD-OH 3.24Å; R236-Y257 WeakPolarHBondContact CD-OH 3.33Å; R236-Y257 HydrophobicContact CG-CE2 4.45Å; R236-Y257 PolarHBondContact NH1-OH 3.44Å; R236-Y257 VanDerWaalsContact NH1-OH 3.13Å; R236-Y261 HydrophobicContact CB-CD2 4.06Å; R236-Y261 HydrophobicContact CB-CE1 4.22Å; R236-Y261 HydrophobicContact CB-CE2 3.57Å; R236-Y261 HydrophobicContact CG-CD1 3.95Å; R236-Y261 HydrophobicContact CG-CD2 4.17Å; R236-Y261 HydrophobicContact CG-CE1 3.64Å; R236-Y261 HydrophobicContact CG-CE2 3.89Å; R236-Y261 HydrophobicContact CG-CG 4.2Å; R236-Y261 PolarHBondContact O-OH 2.84Å
237	I	89.4	Confident	80.1	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-71	-36.2	174.5	-69.4	165.4	0	0	0	110.8	V233 Q234 I240 L241 L253 Y257 L265 L273 W276 I279 L295	V233-I237 HydrophobicContact CG1-CD1 3.62Å; V233-I237 HydrophobicContact CG1-CG1 4.38Å; V233-I237 WeakPolarHBondContact O-CG1 3.32Å; V233-I237 PolarHBondContact O-N 3.31Å; Q234-I237 PolarHBondContact O-N 2.83Å; I237-I240 PolarHBondContact O-N 2.85Å; I237-L241 HydrophobicContact CG2-CD1 3.68Å; I237-L241 HydrophobicContact CG2-CG 4.38Å; I237-L241 WeakPolarHBondContact O-CB 3.43Å; I237-L241 WeakPolarHBondContact O-CG 3.16Å; I237-L241 PolarHBondContact O-N 2.89Å; I237-L253 HydrophobicContact CD1-CD2 4.27Å; I237-L253 HydrophobicContact CG1-CD1 4.43Å; I237-Y257 HydrophobicContact CG1-CD2 4.29Å; I237-Y257 HydrophobicContact CG1-CE2 4.4Å; I237-L265 HydrophobicContact CD1-CD1 4.22Å; I237-L273 HydrophobicContact CD1-CD2 3.93Å; I237-W276 HydrophobicContact CD1-CE3 4.29Å; I237-W276 HydrophobicContact CD1-CZ3 3.76Å; I237-I279 HydrophobicContact CB-CG2 4.26Å; I237-I279 HydrophobicContact CG2-CG2 3.93Å; I237-L295 HydrophobicContact CG2-CD2 4.29Å
238	R	88	Confident	81.1	Confident	134 Å²	134	65.4 Å²	65.4	51%	0.506	34%	0.337	S	S	.	.	H	α-helix	trans	-59.6	-45.3	171.1	-169	-177.3	-76.4	170.4	-10.3	111.5	Q234 S235 I240 L241 A242 H278 I279	Q234-R238 PolarHBondContact O-N 3.1Å; S235-R238 WeakPolarHBondContact O-CB 3.41Å; S235-R238 PolarHBondContact O-N 3.16Å; R238-I240 PolarHBondContact O-N 2.85Å; R238-L241 PolarHBondContact O-N 3.41Å; R238-A242 WeakPolarHBondContact O-CB 3.17Å; R238-A242 PolarHBondContact O-N 3.13Å; R238-H278 PolarHBondContact NH2-O 2.94Å; R238-H278 VanDerWaalsContact NH2-O 3.17Å; R238-I279 HydrophobicContact CB-CG2 4.15Å
239	E	84.1	Confident	81	Confident	92 Å²	92	67.2 Å²	67.2	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-37	174.1	-76.3	170.2	-147.9	0	0	113.6	S235 R236 Y261	S235-E239 PolarHBondContact O-N 2.93Å; R236-E239 PolarHBondContact O-N 2.98Å; E239-Y261 VanDerWaalsContact CB-OH 3.26Å; E239-Y261 WeakPolarHBondContact CB-OH 3.44Å; E239-Y261 PolarHBondContact OE2-OH 3.25Å
240	I	85.8	Confident	80.8	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-51.6	173.2	-69.9	166	0	0	0	109.9	R236 I237 R238 A242 K243 Y244 F248 L253 I256 Y257 L260 Y261	R236-I240 VanDerWaalsContact O-CG1 3.28Å; R236-I240 WeakPolarHBondContact O-CG1 3.35Å; R236-I240 PolarHBondContact O-N 3.4Å; I237-I240 PolarHBondContact O-N 2.85Å; R238-I240 PolarHBondContact O-N 2.85Å; I240-A242 VanDerWaalsContact C-N 3.28Å; I240-A242 PolarHBondContact O-N 3.45Å; I240-K243 WeakPolarHBondContact O-CA 3.46Å; I240-K243 WeakPolarHBondContact O-CB 3.49Å; I240-K243 PolarHBondContact O-N 3.3Å; I240-Y244 HydrophobicContact CG2-CD2 3.85Å; I240-Y244 HydrophobicContact CG2-CE2 4.16Å; I240-Y244 WeakPolarHBondContact O-CD2 3.37Å; I240-Y244 PolarHBondContact O-N 2.91Å; I240-F248 HydrophobicContact CG2-CE1 3.83Å; I240-F248 HydrophobicContact CG2-CZ 3.52Å; I240-L253 HydrophobicContact CD1-CD1 4.23Å; I240-L253 HydrophobicContact CG2-CD1 4.4Å; I240-I256 HydrophobicContact CD1-CG2 4.2Å; I240-I256 HydrophobicContact CG1-CG2 4.19Å; I240-I256 HydrophobicContact CG2-CG2 3.69Å; I240-Y257 HydrophobicContact CD1-CD2 3.81Å; I240-Y257 HydrophobicContact CD1-CG 4.37Å; I240-L260 HydrophobicContact CD1-CD1 4.49Å; I240-L260 HydrophobicContact CG1-CD1 3.76Å; I240-Y261 HydrophobicContact CD1-CE2 3.94Å; I240-Y261 HydrophobicContact CG1-CE2 4.03Å
241	L	82.9	Confident	80.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-66.1	-30.7	-175.3	-72.1	162.2	0	0	0	112.7	I237 R238 K243 Y244 S245 F248 C280 L295 P297	I237-L241 HydrophobicContact CG2-CD1 3.68Å; I237-L241 HydrophobicContact CG2-CG 4.38Å; I237-L241 WeakPolarHBondContact O-CB 3.43Å; I237-L241 WeakPolarHBondContact O-CG 3.16Å; I237-L241 PolarHBondContact O-N 2.89Å; R238-L241 PolarHBondContact O-N 3.41Å; L241-K243 PolarHBondContact O-N 2.98Å; L241-Y244 CarbonylContact O-C 3.51Å; L241-Y244 VanDerWaalsContact O-C 3.25Å; L241-Y244 PolarHBondContact O-N 2.84Å; L241-Y244 VanDerWaalsContact O-N 3.07Å; L241-S245 PolarHBondContact O-N 2.8Å; L241-F248 HydrophobicContact CD2-CD1 4.25Å; L241-F248 HydrophobicContact CD2-CE1 3.48Å; L241-F248 VanDerWaalsContact CD2-CE1 3.48Å; L241-F248 HydrophobicContact CD2-CZ 4.08Å; L241-F248 HydrophobicContact CG-CE1 4.26Å; L241-C280 HydrophobicContact CD1-CB 3.47Å; L241-C280 VanDerWaalsContact CD1-CB 3.47Å; L241-L295 HydrophobicContact CD1-CD2 4.08Å; L241-L295 HydrophobicContact CD1-CG 4.32Å; L241-L295 HydrophobicContact CD2-CB 4.43Å; L241-L295 HydrophobicContact CD2-CD2 4.02Å; L241-L295 HydrophobicContact CD2-CG 4.05Å; L241-L295 HydrophobicContact CG-CD2 4.37Å; L241-P297 HydrophobicContact CB-CB 4.03Å
242	A	76	Confident	80.5	Confident	82 Å²	82	62.4 Å²	62.4	68%	0.678	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.7	169.5	0	0	0	0	0	113.8	R238 I240	R238-A242 WeakPolarHBondContact O-CB 3.17Å; R238-A242 PolarHBondContact O-N 3.13Å; I240-A242 VanDerWaalsContact C-N 3.28Å; I240-A242 PolarHBondContact O-N 3.45Å
243	K	73.8	Confident	80.5	Confident	143 Å²	143	57.7 Å²	57.7	62%	0.622	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-11.7	175	-64.6	177.3	-179.3	174.9	0	113.9	I240 L241	I240-K243 WeakPolarHBondContact O-CA 3.46Å; I240-K243 WeakPolarHBondContact O-CB 3.49Å; I240-K243 PolarHBondContact O-N 3.3Å; L241-K243 PolarHBondContact O-N 2.98Å
244	Y	73.2	Confident	80.3	Confident	101 Å²	101	58.9 Å²	58.9	40%	0.396	31%	0.306	S	S	.	.			trans	-130.1	61.7	-179.5	-62.4	-79.9	0	0	0	109.7	I240 L241 N246 G247 F248 I256	I240-Y244 HydrophobicContact CG2-CD2 3.85Å; I240-Y244 HydrophobicContact CG2-CE2 4.16Å; I240-Y244 WeakPolarHBondContact O-CD2 3.37Å; I240-Y244 PolarHBondContact O-N 2.91Å; L241-Y244 CarbonylContact O-C 3.51Å; L241-Y244 VanDerWaalsContact O-C 3.25Å; L241-Y244 PolarHBondContact O-N 2.84Å; L241-Y244 VanDerWaalsContact O-N 3.07Å; Y244-N246 PolarHBondContact O-N 3.26Å; Y244-N246 VanDerWaalsContact O-N 3.16Å; Y244-G247 PolarHBondContact O-N 3.47Å; Y244-F248 VanDerWaalsContact CB-CD1 3.46Å; Y244-F248 HydrophobicContact CD2-CD1 4.21Å; Y244-F248 HydrophobicContact CD2-CE1 4.01Å; Y244-F248 AromaticContact CG-CD1 3.88Å; Y244-F248 HydrophobicContact CG-CD1 3.88Å; Y244-F248 HydrophobicContact CG-CE1 4.11Å; Y244-I256 HydrophobicContact CE2-CD1 4.31Å; Y244-I256 HydrophobicContact CE2-CG2 3.9Å
245	S	61.3	Low	79.9	Confident	79 Å²	79	62.6 Å²	62.6	55%	0.552	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.7	-174.6	54.3	0	0	0	0	114.2	L241 G247	L241-S245 PolarHBondContact O-N 2.8Å; S245-G247 PolarHBondContact O-N 3.2Å
246	N	63.6	Low	79.7	Confident	124 Å²	124	60.5 Å²	60.5	66%	0.663	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	9.6	-177.7	-56.2	4.8	0	0	0	112.7	Y244 Y296	Y244-N246 PolarHBondContact O-N 3.26Å; Y244-N246 VanDerWaalsContact O-N 3.16Å; N246-Y296 VanDerWaalsContact O-CE1 3.27Å; N246-Y296 WeakPolarHBondContact O-CE1 3.35Å
247	G	69.1	Low	79.6	Confident	20 Å²	20	58.9 Å²	58.9	21%	0.206	30%	0.301	C	S	.	.			trans	73.6	168.3	-179.2	0	0	0	0	0	115.3	Y244 S245 L295	Y244-G247 PolarHBondContact O-N 3.47Å; S245-G247 PolarHBondContact O-N 3.2Å; G247-L295 CarbonylContact C-O 3.56Å; G247-L295 WeakPolarHBondContact CA-O 3.42Å
248	F	77.6	Confident	79.6	Confident	15 Å²	15	64.4 Å²	64.4	7%	0.066	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	155.4	176.8	59.9	-85.1	0	0	0	111.8	I240 L241 Y244 V250 K252 L253 I256 L295	I240-F248 HydrophobicContact CG2-CE1 3.83Å; I240-F248 HydrophobicContact CG2-CZ 3.52Å; L241-F248 HydrophobicContact CD2-CD1 4.25Å; L241-F248 HydrophobicContact CD2-CE1 3.48Å; L241-F248 VanDerWaalsContact CD2-CE1 3.48Å; L241-F248 HydrophobicContact CD2-CZ 4.08Å; L241-F248 HydrophobicContact CG-CE1 4.26Å; Y244-F248 VanDerWaalsContact CB-CD1 3.46Å; Y244-F248 HydrophobicContact CD2-CD1 4.21Å; Y244-F248 HydrophobicContact CD2-CE1 4.01Å; Y244-F248 AromaticContact CG-CD1 3.88Å; Y244-F248 HydrophobicContact CG-CD1 3.88Å; Y244-F248 HydrophobicContact CG-CE1 4.11Å; F248-V250 PolarHBondContact O-N 2.83Å; F248-K252 HydrophobicContact CD2-CB 4.36Å; F248-L253 HydrophobicContact CE2-CB 3.92Å; F248-L253 HydrophobicContact CE2-CD1 3.67Å; F248-L253 HydrophobicContact CE2-CG 4.41Å; F248-L253 HydrophobicContact CZ-CD1 3.6Å; F248-I256 HydrophobicContact CD2-CD1 3.74Å; F248-I256 HydrophobicContact CE2-CD1 3.75Å; F248-I256 HydrophobicContact CG-CD1 4.33Å; F248-I256 HydrophobicContact CZ-CD1 4.33Å; F248-L295 HydrophobicContact CE2-CD2 4.48Å; F248-L295 HydrophobicContact CZ-CD2 4.15Å; F248-L295 PolarHBondContact N-O 2.67Å; F248-L295 WeakPolarHBondContact O-CB 3.47Å; F248-L295 PolarHBondContact O-N 3.47Å
249	W	80.8	Confident	79.2	Confident	93 Å²	93	63 Å²	63	35%	0.352	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	133.2	179.9	-60.3	92.5	0	0	0	112.5	S251 K252 T285 E292 L293 L294	W249-S251 WeakPolarHBondContact CB-OG 3.45Å; W249-S251 PolarHBondContact O-N 2.9Å; W249-S251 VanDerWaalsContact O-N 3.14Å; W249-K252 HydrophobicContact CB-CG 4.49Å; W249-K252 WeakPolarHBondContact O-CB 3.27Å; W249-K252 PolarHBondContact O-N 3.48Å; W249-T285 HydrophobicContact CH2-CG2 3.79Å; W249-T285 HydrophobicContact CZ3-CG2 4Å; W249-E292 HydrophobicContact CZ3-CB 4.36Å; W249-E292 WeakPolarHBondContact CZ3-O 3.49Å; W249-L293 CarbonylContact C-O 3.59Å; W249-L293 WeakPolarHBondContact CA-O 3.43Å; W249-L294 HydrophobicContact CD2-CD2 3.66Å; W249-L294 HydrophobicContact CD2-CG 3.95Å; W249-L294 HydrophobicContact CE3-CD2 4.05Å; W249-L294 HydrophobicContact CE3-CG 3.79Å; W249-L294 HydrophobicContact CG-CD2 3.94Å; W249-L294 HydrophobicContact CH2-CD1 4.02Å; W249-L294 HydrophobicContact CH2-CG 4.15Å; W249-L294 HydrophobicContact CZ2-CD1 4.22Å; W249-L294 HydrophobicContact CZ2-CD2 4.19Å; W249-L294 HydrophobicContact CZ2-CG 4.29Å; W249-L294 HydrophobicContact CZ3-CD1 4.17Å; W249-L294 HydrophobicContact CZ3-CD2 4.47Å; W249-L294 HydrophobicContact CZ3-CG 3.89Å
250	V	80.3	Confident	79	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.03	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-55.8	-31.2	176.4	174.8	0	0	0	0	111.4	F248 K252 L253 P254 I270 L273 V282 L293 L295	F248-V250 PolarHBondContact O-N 2.83Å; V250-K252 PolarHBondContact O-N 3.31Å; V250-K252 VanDerWaalsContact O-N 3.13Å; V250-L253 WeakPolarHBondContact O-CB 3.45Å; V250-L253 PolarHBondContact O-N 2.87Å; V250-P254 VanDerWaalsContact O-CD 3.26Å; V250-P254 WeakPolarHBondContact O-CD 3.25Å; V250-I270 HydrophobicContact CG1-CG2 4.09Å; V250-L273 HydrophobicContact CG1-CD1 3.77Å; V250-L273 HydrophobicContact CG2-CD1 4.42Å; V250-V282 HydrophobicContact CG2-CG1 4.41Å; V250-L293 HydrophobicContact CB-CB 3.91Å; V250-L293 HydrophobicContact CG2-CB 3.53Å; V250-L293 PolarHBondContact N-O 2.88Å; V250-L295 HydrophobicContact CG2-CB 3.96Å; V250-L295 HydrophobicContact CG2-CD1 4.07Å
251	S	77.9	Confident	79	Confident	70 Å²	70	64.2 Å²	64.2	49%	0.49	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-56.7	-24.1	172.3	53.5	0	0	0	0	114.2	W249 S291	W249-S251 WeakPolarHBondContact CB-OG 3.45Å; W249-S251 PolarHBondContact O-N 2.9Å; W249-S251 VanDerWaalsContact O-N 3.14Å; S251-S291 PolarHBondContact OG-O 3.37Å
252	K	81.1	Confident	79	Confident	114 Å²	114	72.1 Å²	72.1	50%	0.496	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-89.5	-19.5	174.8	-59.3	-177	179.9	-178.5	0	113.5	F248 W249 V250 Q255 I256	F248-K252 HydrophobicContact CD2-CB 4.36Å; W249-K252 HydrophobicContact CB-CG 4.49Å; W249-K252 WeakPolarHBondContact O-CB 3.27Å; W249-K252 PolarHBondContact O-N 3.48Å; V250-K252 PolarHBondContact O-N 3.31Å; V250-K252 VanDerWaalsContact O-N 3.13Å; K252-Q255 PolarHBondContact O-N 3.06Å; K252-Q255 VanDerWaalsContact O-N 3.11Å; K252-I256 HydrophobicContact CB-CD1 3.98Å; K252-I256 WeakPolarHBondContact O-CG1 3.19Å; K252-I256 PolarHBondContact O-N 3.42Å
253	L	86.6	Confident	79.4	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-56.8	-45.1	-176.6	-174.4	73.4	0	0	0	113.5	I237 I240 F248 V250 Q255 I256 Y257 L265 L273 L295	I237-L253 HydrophobicContact CD1-CD2 4.27Å; I237-L253 HydrophobicContact CG1-CD1 4.43Å; I240-L253 HydrophobicContact CD1-CD1 4.23Å; I240-L253 HydrophobicContact CG2-CD1 4.4Å; F248-L253 HydrophobicContact CE2-CB 3.92Å; F248-L253 HydrophobicContact CE2-CD1 3.67Å; F248-L253 HydrophobicContact CE2-CG 4.41Å; F248-L253 HydrophobicContact CZ-CD1 3.6Å; V250-L253 WeakPolarHBondContact O-CB 3.45Å; V250-L253 PolarHBondContact O-N 2.87Å; L253-Q255 PolarHBondContact O-N 2.79Å; L253-I256 PolarHBondContact O-N 3.11Å; L253-Y257 VanDerWaalsContact O-CB 3.26Å; L253-Y257 WeakPolarHBondContact O-CB 3.37Å; L253-Y257 PolarHBondContact O-N 3.21Å; L253-L265 HydrophobicContact CD2-CD2 3.61Å; L253-L265 HydrophobicContact CG-CD2 3.87Å; L253-L273 HydrophobicContact CD2-CD1 3.74Å; L253-L273 HydrophobicContact CD2-CD2 3.92Å; L253-L273 HydrophobicContact CD2-CG 4.42Å; L253-L295 HydrophobicContact CD1-CD2 3.98Å; L253-L295 HydrophobicContact CD2-CD2 3.99Å; L253-L295 HydrophobicContact CG-CD2 4.49Å
254	P	85.7	Confident	79.7	Confident	30 Å²	30	71 Å²	71	20%	0.195	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-21.1	179.4	-20.2	33.2	0	0	0	113.8	V250 R258 L265 I270	V250-P254 VanDerWaalsContact O-CD 3.26Å; V250-P254 WeakPolarHBondContact O-CD 3.25Å; P254-R258 WeakPolarHBondContact O-CB 3.43Å; P254-L265 HydrophobicContact CB-CB 4.36Å; P254-L265 HydrophobicContact CG-CD2 4.27Å; P254-I270 HydrophobicContact CG-CD1 3.78Å
255	Q	80.5	Confident	80.3	Confident	112 Å²	112	66.8 Å²	66.8	52%	0.523	33%	0.332	S	S	.	.	H	α-helix	trans	-81.5	-50.6	173.6	-178.1	172.1	-9.8	0	0	110.4	K252 L253 Y257 R258 E259	K252-Q255 PolarHBondContact O-N 3.06Å; K252-Q255 VanDerWaalsContact O-N 3.11Å; L253-Q255 PolarHBondContact O-N 2.79Å; Q255-Y257 VanDerWaalsContact C-N 3.32Å; Q255-Y257 PolarHBondContact O-N 3.01Å; Q255-R258 WeakPolarHBondContact O-CB 3.14Å; Q255-R258 PolarHBondContact O-N 2.69Å; Q255-R258 VanDerWaalsContact O-N 3.12Å; Q255-E259 HydrophobicContact CG-CG 4.42Å; Q255-E259 VanDerWaalsContact CG-OE1 3.24Å; Q255-E259 WeakPolarHBondContact CG-OE1 3.43Å; Q255-E259 PolarHBondContact NE2-OE1 3.37Å; Q255-E259 WeakPolarHBondContact O-CG 3.42Å; Q255-E259 PolarHBondContact O-N 2.91Å
256	I	85.8	Confident	81.5	Confident	17 Å²	17	64.7 Å²	64.7	9%	0.087	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-44	179.4	-65.2	164.6	0	0	0	111.1	I240 Y244 F248 K252 L253 R258 E259 L260	I240-I256 HydrophobicContact CD1-CG2 4.2Å; I240-I256 HydrophobicContact CG1-CG2 4.19Å; I240-I256 HydrophobicContact CG2-CG2 3.69Å; Y244-I256 HydrophobicContact CE2-CD1 4.31Å; Y244-I256 HydrophobicContact CE2-CG2 3.9Å; F248-I256 HydrophobicContact CD2-CD1 3.74Å; F248-I256 HydrophobicContact CE2-CD1 3.75Å; F248-I256 HydrophobicContact CG-CD1 4.33Å; F248-I256 HydrophobicContact CZ-CD1 4.33Å; K252-I256 HydrophobicContact CB-CD1 3.98Å; K252-I256 WeakPolarHBondContact O-CG1 3.19Å; K252-I256 PolarHBondContact O-N 3.42Å; L253-I256 PolarHBondContact O-N 3.11Å; I256-R258 VanDerWaalsContact C-N 3.34Å; I256-R258 PolarHBondContact O-N 3.03Å; I256-E259 PolarHBondContact O-N 3.28Å; I256-L260 HydrophobicContact CG2-CD1 3.82Å; I256-L260 PolarHBondContact O-N 3.49Å
257	Y	89	Confident	82.2	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-62.2	-40.3	177.6	-170.1	-83.8	0	0	0	112.2	V233 R236 I237 I240 L253 Q255 Y261 Q263 L265	V233-Y257 HydrophobicContact CG1-CE2 4.18Å; R236-Y257 HydrophobicContact CB-CD2 4.38Å; R236-Y257 HydrophobicContact CB-CE2 3.59Å; R236-Y257 VanDerWaalsContact CD-OH 3.24Å; R236-Y257 WeakPolarHBondContact CD-OH 3.33Å; R236-Y257 HydrophobicContact CG-CE2 4.45Å; R236-Y257 PolarHBondContact NH1-OH 3.44Å; R236-Y257 VanDerWaalsContact NH1-OH 3.13Å; I237-Y257 HydrophobicContact CG1-CD2 4.29Å; I237-Y257 HydrophobicContact CG1-CE2 4.4Å; I240-Y257 HydrophobicContact CD1-CD2 3.81Å; I240-Y257 HydrophobicContact CD1-CG 4.37Å; L253-Y257 VanDerWaalsContact O-CB 3.26Å; L253-Y257 WeakPolarHBondContact O-CB 3.37Å; L253-Y257 PolarHBondContact O-N 3.21Å; Q255-Y257 VanDerWaalsContact C-N 3.32Å; Q255-Y257 PolarHBondContact O-N 3.01Å; Y257-Y261 HydrophobicContact CD1-CD2 4.44Å; Y257-Y261 AromaticContact CD2-CD2 3.96Å; Y257-Y261 HydrophobicContact CD2-CD2 3.96Å; Y257-Y261 HydrophobicContact CD2-CE2 4.31Å; Y257-Y261 HydrophobicContact CE2-CD2 4.08Å; Y257-Y261 HydrophobicContact CE2-CE2 4.47Å; Y257-Y261 HydrophobicContact CG-CD2 4.14Å; Y257-Y261 WeakPolarHBondContact O-CB 3.34Å; Y257-Y261 WeakPolarHBondContact O-CD2 3.23Å; Y257-Y261 PolarHBondContact O-N 3.45Å; Y257-Q263 WeakPolarHBondContact CD1-O 3.41Å; Y257-L265 HydrophobicContact CD1-CB 3.96Å; Y257-L265 HydrophobicContact CD1-CD1 4.17Å; Y257-L265 HydrophobicContact CD2-CD1 3.81Å; Y257-L265 HydrophobicContact CE1-CD1 4.27Å; Y257-L265 HydrophobicContact CE2-CD1 3.91Å; Y257-L265 HydrophobicContact CG-CB 4.11Å; Y257-L265 HydrophobicContact CG-CD1 3.95Å
258	R	88.2	Confident	82.6	Confident	117 Å²	117	65.5 Å²	65.5	44%	0.442	32%	0.32	S	S	.	.	H	α-helix	trans	-70.2	-38	177.2	-165.2	-165	-32.6	-127.6	1.1	112.5	P254 Q255 I256 K262 Q263 D264	P254-R258 WeakPolarHBondContact O-CB 3.43Å; Q255-R258 WeakPolarHBondContact O-CB 3.14Å; Q255-R258 PolarHBondContact O-N 2.69Å; Q255-R258 VanDerWaalsContact O-N 3.12Å; I256-R258 VanDerWaalsContact C-N 3.34Å; I256-R258 PolarHBondContact O-N 3.03Å; R258-K262 WeakPolarHBondContact O-CA 3.4Å; R258-K262 PolarHBondContact O-N 3.39Å; R258-Q263 VanDerWaalsContact CA-O 3.3Å; R258-Q263 WeakPolarHBondContact CA-O 3.25Å; R258-D264 VanDerWaalsContact CD-OD1 3.26Å; R258-D264 WeakPolarHBondContact CD-OD1 3.34Å; R258-D264 WeakPolarHBondContact CG-OD1 3.43Å; R258-D264 IonicContact CZ-OD1 3.63Å; R258-D264 IonicContact NE-OD1 3.2Å; R258-D264 PolarHBondContact NE-OD1 2.96Å; R258-D264 IonicContact NH1-OD1 3.64Å; R258-D264 PolarHBondContact NH1-OD1 2.83Å; R258-D264 IonicContact NH1-OD2 3.75Å; R258-D264 IonicContact NH2-OD1 2.93Å
259	E	81	Confident	82.8	Confident	105 Å²	105	64.8 Å²	64.8	49%	0.491	32%	0.317	S	S	.	.	H	α-helix	trans	-67.4	-40.3	177.7	-75.6	174.9	-169.4	0	0	111.8	Q255 I256 K262	Q255-E259 HydrophobicContact CG-CG 4.42Å; Q255-E259 VanDerWaalsContact CG-OE1 3.24Å; Q255-E259 WeakPolarHBondContact CG-OE1 3.43Å; Q255-E259 PolarHBondContact NE2-OE1 3.37Å; Q255-E259 WeakPolarHBondContact O-CG 3.42Å; Q255-E259 PolarHBondContact O-N 2.91Å; I256-E259 PolarHBondContact O-N 3.28Å; E259-K262 WeakPolarHBondContact O-CE 3.27Å; E259-K262 PolarHBondContact O-NZ 3.32Å
260	L	79.6	Confident	82.9	Confident	75 Å²	75	63.2 Å²	63.2	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-80.9	-45	-179.4	-71.5	167	0	0	0	113.6	I240 I256	I240-L260 HydrophobicContact CD1-CD1 4.49Å; I240-L260 HydrophobicContact CG1-CD1 3.76Å; I256-L260 HydrophobicContact CG2-CD1 3.82Å; I256-L260 PolarHBondContact O-N 3.49Å
261	Y	85.1	Confident	82.9	Confident	42 Å²	42	69.1 Å²	69.1	17%	0.165	34%	0.34	C	S	.	.	H	α-helix	trans	-107	1.9	-172.1	-55.9	-71.3	0	0	0	114.6	R236 E239 I240 Y257 Q263	R236-Y261 HydrophobicContact CB-CD2 4.06Å; R236-Y261 HydrophobicContact CB-CE1 4.22Å; R236-Y261 HydrophobicContact CB-CE2 3.57Å; R236-Y261 HydrophobicContact CG-CD1 3.95Å; R236-Y261 HydrophobicContact CG-CD2 4.17Å; R236-Y261 HydrophobicContact CG-CE1 3.64Å; R236-Y261 HydrophobicContact CG-CE2 3.89Å; R236-Y261 HydrophobicContact CG-CG 4.2Å; R236-Y261 PolarHBondContact O-OH 2.84Å; E239-Y261 VanDerWaalsContact CB-OH 3.26Å; E239-Y261 WeakPolarHBondContact CB-OH 3.44Å; E239-Y261 PolarHBondContact OE2-OH 3.25Å; I240-Y261 HydrophobicContact CD1-CE2 3.94Å; I240-Y261 HydrophobicContact CG1-CE2 4.03Å; Y257-Y261 HydrophobicContact CD1-CD2 4.44Å; Y257-Y261 AromaticContact CD2-CD2 3.96Å; Y257-Y261 HydrophobicContact CD2-CD2 3.96Å; Y257-Y261 HydrophobicContact CD2-CE2 4.31Å; Y257-Y261 HydrophobicContact CE2-CD2 4.08Å; Y257-Y261 HydrophobicContact CE2-CE2 4.47Å; Y257-Y261 HydrophobicContact CG-CD2 4.14Å; Y257-Y261 WeakPolarHBondContact O-CB 3.34Å; Y257-Y261 WeakPolarHBondContact O-CD2 3.23Å; Y257-Y261 PolarHBondContact O-N 3.45Å; Y261-Q263 PolarHBondContact O-N 2.96Å; Y261-Q263 VanDerWaalsContact O-N 3.09Å
262	K	83.8	Confident	83.1	Confident	167 Å²	167	68.6 Å²	68.6	73%	0.726	33%	0.331	S	S	*	.	S	Bend	trans	53	28.1	179.9	-50.8	-51.3	-174.5	-163.4	0	114.1	R258 E259	R258-K262 WeakPolarHBondContact O-CA 3.4Å; R258-K262 PolarHBondContact O-N 3.39Å; E259-K262 WeakPolarHBondContact O-CE 3.27Å; E259-K262 PolarHBondContact O-NZ 3.32Å
263	Q	83	Confident	83.2	Confident	96 Å²	96	63.2 Å²	63.2	45%	0.449	31%	0.308	S	S	.	.	S	Bend	trans	-136.3	143.1	-179.6	-70.2	175.8	-5.9	0	0	108.7	Y257 R258 Y261	Y257-Q263 WeakPolarHBondContact CD1-O 3.41Å; R258-Q263 VanDerWaalsContact CA-O 3.3Å; R258-Q263 WeakPolarHBondContact CA-O 3.25Å; Y261-Q263 PolarHBondContact O-N 2.96Å; Y261-Q263 VanDerWaalsContact O-N 3.09Å
264	D	81.3	Confident	82.8	Confident	104 Å²	104	67.8 Å²	67.8	56%	0.556	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-70	138.3	174	-69.4	-35.6	0	0	0	110.7	R258 P266	R258-D264 VanDerWaalsContact CD-OD1 3.26Å; R258-D264 WeakPolarHBondContact CD-OD1 3.34Å; R258-D264 WeakPolarHBondContact CG-OD1 3.43Å; R258-D264 IonicContact CZ-OD1 3.63Å; R258-D264 IonicContact NE-OD1 3.2Å; R258-D264 PolarHBondContact NE-OD1 2.96Å; R258-D264 IonicContact NH1-OD1 3.64Å; R258-D264 PolarHBondContact NH1-OD1 2.83Å; R258-D264 IonicContact NH1-OD2 3.75Å; R258-D264 IonicContact NH2-OD1 2.93Å; D264-P266 WeakPolarHBondContact O-CD 3.26Å
265	L	86.3	Confident	82.5	Confident	13 Å²	13	69.6 Å²	69.6	7%	0.068	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-65.3	125.5	171.6	-176.9	67.6	0	0	0	109	V233 I237 L253 P254 Y257 S267 A269 I270	V233-L265 HydrophobicContact CG1-CD1 3.57Å; I237-L265 HydrophobicContact CD1-CD1 4.22Å; L253-L265 HydrophobicContact CD2-CD2 3.61Å; L253-L265 HydrophobicContact CG-CD2 3.87Å; P254-L265 HydrophobicContact CB-CB 4.36Å; P254-L265 HydrophobicContact CG-CD2 4.27Å; Y257-L265 HydrophobicContact CD1-CB 3.96Å; Y257-L265 HydrophobicContact CD1-CD1 4.17Å; Y257-L265 HydrophobicContact CD2-CD1 3.81Å; Y257-L265 HydrophobicContact CE1-CD1 4.27Å; Y257-L265 HydrophobicContact CE2-CD1 3.91Å; Y257-L265 HydrophobicContact CG-CB 4.11Å; Y257-L265 HydrophobicContact CG-CD1 3.95Å; L265-S267 PolarHBondContact O-N 2.9Å; L265-A269 HydrophobicContact CD1-CB 4.12Å; L265-A269 HydrophobicContact CG-CB 4.41Å; L265-I270 HydrophobicContact CD2-CD1 4.23Å; L265-I270 HydrophobicContact CD2-CG1 3.65Å; L265-I270 HydrophobicContact CG-CG1 4.3Å
266	P	85.5	Confident	82.8	Confident	36 Å²	36	65.1 Å²	65.1	23%	0.234	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-57.4	134.8	177.6	-27.1	37.1	0	0	0	111.7	Y228 V233 D264 E268 A269	Y228-P266 HydrophobicContact CD1-CB 4Å; Y228-P266 HydrophobicContact CD2-CB 3.88Å; Y228-P266 HydrophobicContact CD2-CG 3.69Å; Y228-P266 HydrophobicContact CE2-CB 4.41Å; Y228-P266 HydrophobicContact CE2-CG 4.44Å; Y228-P266 HydrophobicContact CG-CB 3.65Å; Y228-P266 HydrophobicContact CG-CG 3.78Å; V233-P266 HydrophobicContact CG2-CG 4.33Å; D264-P266 WeakPolarHBondContact O-CD 3.26Å; P266-E268 PolarHBondContact O-N 3.43Å; P266-A269 HydrophobicContact CB-CB 4.24Å; P266-A269 VanDerWaalsContact O-CB 3.27Å; P266-A269 WeakPolarHBondContact O-CB 3.39Å; P266-A269 PolarHBondContact O-N 3.07Å
267	S	77.6	Confident	82.6	Confident	79 Å²	79	69.2 Å²	69.2	55%	0.552	35%	0.351	S	S	*	.	H	α-helix	trans	-59.1	-31.1	-178	55.3	0	0	0	0	113.4	L265	L265-S267 PolarHBondContact O-N 2.9Å
268	E	78.1	Confident	82.1	Confident	82 Å²	82	73.6 Å²	73.6	38%	0.383	37%	0.372	S	S	.	.	H	α-helix	trans	-72.1	-32.9	176.4	-54.7	-48.1	113.2	0	0	111.7	Y228 P266 I270 K271 D272	Y228-E268 HydrophobicContact CD1-CB 4.12Å; Y228-E268 HydrophobicContact CE1-CB 3.64Å; P266-E268 PolarHBondContact O-N 3.43Å; E268-I270 PolarHBondContact O-N 3.47Å; E268-K271 WeakPolarHBondContact O-CB 3.41Å; E268-K271 PolarHBondContact O-N 3.28Å; E268-K271 IonicContact OE1-NZ 3.37Å; E268-K271 PolarHBondContact OE1-NZ 3.17Å; E268-K271 WeakPolarHBondContact OE2-CE 3.32Å; E268-K271 IonicContact OE2-NZ 2.74Å; E268-K271 PolarHBondContact OE2-NZ 3.12Å; E268-D272 PolarHBondContact O-N 3.48Å
269	A	82.4	Confident	81.8	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-31.9	175.9	0	0	0	0	0	112.7	Y228 V233 L265 P266 K271 D272 L273 W276	Y228-A269 HydrophobicContact CE2-CB 3.76Å; Y228-A269 WeakPolarHBondContact OH-CA 3.41Å; V233-A269 HydrophobicContact CG1-CB 3.86Å; L265-A269 HydrophobicContact CD1-CB 4.12Å; L265-A269 HydrophobicContact CG-CB 4.41Å; P266-A269 HydrophobicContact CB-CB 4.24Å; P266-A269 VanDerWaalsContact O-CB 3.27Å; P266-A269 WeakPolarHBondContact O-CB 3.39Å; P266-A269 PolarHBondContact O-N 3.07Å; A269-K271 VanDerWaalsContact C-N 3.29Å; A269-K271 PolarHBondContact O-N 2.82Å; A269-D272 PolarHBondContact O-N 3.21Å; A269-L273 WeakPolarHBondContact O-CG 3.44Å; A269-L273 PolarHBondContact O-N 3.47Å; A269-L273 VanDerWaalsContact O-N 3.07Å; A269-W276 HydrophobicContact CB-CH2 3.78Å; A269-W276 HydrophobicContact CB-CZ3 4.24Å
270	I	82.5	Confident	81.7	Confident	59 Å²	59	63.4 Å²	63.4	30%	0.303	33%	0.329	S	S	.	.	H	α-helix	trans	-65.5	-34.1	175.9	-58	173.1	0	0	0	111	V250 P254 L265 E268 L273	V250-I270 HydrophobicContact CG1-CG2 4.09Å; P254-I270 HydrophobicContact CG-CD1 3.78Å; L265-I270 HydrophobicContact CD2-CD1 4.23Å; L265-I270 HydrophobicContact CD2-CG1 3.65Å; L265-I270 HydrophobicContact CG-CG1 4.3Å; E268-I270 PolarHBondContact O-N 3.47Å; I270-L273 HydrophobicContact CG2-CD1 4.31Å
271	K	80	Confident	81.9	Confident	130 Å²	130	63.6 Å²	63.6	57%	0.565	33%	0.33	S	S	*	.	H	α-helix	trans	-74.4	-34.5	175.3	-53.8	175	-163.7	164.1	0	111.2	E268 A269 L273	E268-K271 WeakPolarHBondContact O-CB 3.41Å; E268-K271 PolarHBondContact O-N 3.28Å; E268-K271 IonicContact OE1-NZ 3.37Å; E268-K271 PolarHBondContact OE1-NZ 3.17Å; E268-K271 WeakPolarHBondContact OE2-CE 3.32Å; E268-K271 IonicContact OE2-NZ 2.74Å; E268-K271 PolarHBondContact OE2-NZ 3.12Å; A269-K271 VanDerWaalsContact C-N 3.29Å; A269-K271 PolarHBondContact O-N 2.82Å; K271-L273 VanDerWaalsContact C-N 3.32Å; K271-L273 PolarHBondContact O-N 3.11Å
272	D	81.9	Confident	81.6	Confident	58 Å²	58	63 Å²	63	31%	0.31	33%	0.331	S	S	.	.	H	α-helix	trans	-77.1	-13.6	-179.7	-61.4	-33.4	0	0	0	113.3	Y228 E268 A269 E274 A275 W276	Y228-D272 PolarHBondContact OH-OD2 2.91Å; E268-D272 PolarHBondContact O-N 3.48Å; A269-D272 PolarHBondContact O-N 3.21Å; D272-E274 VanDerWaalsContact C-N 3.3Å; D272-E274 PolarHBondContact O-N 3.39Å; D272-A275 CarbonylContact O-C 3.35Å; D272-A275 WeakPolarHBondContact O-CA 3.42Å; D272-A275 WeakPolarHBondContact O-CB 3.41Å; D272-A275 PolarHBondContact O-N 2.84Å; D272-W276 HydrophobicContact CB-CD2 4.34Å; D272-W276 HydrophobicContact CB-CH2 4.24Å; D272-W276 HydrophobicContact CB-CZ2 3.54Å; D272-W276 VanDerWaalsContact O-CD1 3.3Å; D272-W276 PolarHBondContact O-N 3.37Å; D272-W276 VanDerWaalsContact O-N 3.17Å
273	L	83.4	Confident	81.2	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-51.9	-44.1	175.3	-72.5	173.1	0	0	0	113	I237 V250 L253 A269 I270 K271 A275 W276 V282 L295	I237-L273 HydrophobicContact CD1-CD2 3.93Å; V250-L273 HydrophobicContact CG1-CD1 3.77Å; V250-L273 HydrophobicContact CG2-CD1 4.42Å; L253-L273 HydrophobicContact CD2-CD1 3.74Å; L253-L273 HydrophobicContact CD2-CD2 3.92Å; L253-L273 HydrophobicContact CD2-CG 4.42Å; A269-L273 WeakPolarHBondContact O-CG 3.44Å; A269-L273 PolarHBondContact O-N 3.47Å; A269-L273 VanDerWaalsContact O-N 3.07Å; I270-L273 HydrophobicContact CG2-CD1 4.31Å; K271-L273 VanDerWaalsContact C-N 3.32Å; K271-L273 PolarHBondContact O-N 3.11Å; L273-A275 PolarHBondContact O-N 2.88Å; L273-W276 HydrophobicContact CD2-CE3 4.29Å; L273-W276 PolarHBondContact O-N 3.04Å; L273-W276 VanDerWaalsContact O-N 3.09Å; L273-V282 HydrophobicContact CB-CG2 4.23Å; L273-L295 HydrophobicContact CD1-CD1 4.29Å; L273-L295 HydrophobicContact CD2-CD1 4.28Å; L273-L295 HydrophobicContact CD2-CD2 4.41Å
274	E	78.5	Confident	80.5	Confident	95 Å²	95	60.9 Å²	60.9	44%	0.444	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-66.4	-17.8	179.4	-63	-171.7	-165.7	0	0	112.6	D272 V282 K284	D272-E274 VanDerWaalsContact C-N 3.3Å; D272-E274 PolarHBondContact O-N 3.39Å; E274-V282 HydrophobicContact CG-CB 4.3Å; E274-V282 HydrophobicContact CG-CG1 4.25Å; E274-V282 HydrophobicContact CG-CG2 4.2Å; E274-K284 WeakPolarHBondContact OE1-CE 3.45Å; E274-K284 IonicContact OE1-NZ 3.66Å; E274-K284 PolarHBondContact OE1-NZ 3.31Å; E274-K284 IonicContact OE2-NZ 2.67Å; E274-K284 PolarHBondContact OE2-NZ 3.01Å
275	A	79.4	Confident	79.1	Confident	69 Å²	69	58.3 Å²	58.3	57%	0.57	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-96.4	-10.2	175.2	0	0	0	0	0	113.4	D272 L273 T277	D272-A275 CarbonylContact O-C 3.35Å; D272-A275 WeakPolarHBondContact O-CA 3.42Å; D272-A275 WeakPolarHBondContact O-CB 3.41Å; D272-A275 PolarHBondContact O-N 2.84Å; L273-A275 PolarHBondContact O-N 2.88Å; A275-T277 VanDerWaalsContact C-N 3.33Å; A275-T277 PolarHBondContact O-N 3.2Å
276	W	86.4	Confident	77	Confident	17 Å²	17	64.7 Å²	64.7	6%	0.064	35%	0.354	C	S	.	.			trans	-96.6	51.2	-178.1	-62.1	-9.4	0	0	0	112.1	Y228 P230 V233 Q234 I237 A269 D272 L273 H278 I279 C280	Y228-W276 HydrophobicContact CE2-CH2 4.21Å; Y228-W276 WeakPolarHBondContact OH-CH2 3.46Å; Y228-W276 VanDerWaalsContact OH-CZ2 3.23Å; Y228-W276 WeakPolarHBondContact OH-CZ2 3.32Å; P230-W276 HydrophobicContact CB-CZ2 3.98Å; V233-W276 HydrophobicContact CB-CH2 4.2Å; V233-W276 HydrophobicContact CB-CZ3 4.46Å; V233-W276 HydrophobicContact CG1-CH2 3.96Å; V233-W276 HydrophobicContact CG1-CZ3 3.91Å; Q234-W276 HydrophobicContact CG-CD2 3.5Å; Q234-W276 VanDerWaalsContact CG-CD2 3.5Å; Q234-W276 HydrophobicContact CG-CE3 3.59Å; Q234-W276 HydrophobicContact CG-CG 4.02Å; Q234-W276 HydrophobicContact CG-CH2 4.15Å; Q234-W276 HydrophobicContact CG-CZ2 4.07Å; Q234-W276 HydrophobicContact CG-CZ3 3.94Å; Q234-W276 VanDerWaalsContact NE2-CE2 3.29Å; I237-W276 HydrophobicContact CD1-CE3 4.29Å; I237-W276 HydrophobicContact CD1-CZ3 3.76Å; A269-W276 HydrophobicContact CB-CH2 3.78Å; A269-W276 HydrophobicContact CB-CZ3 4.24Å; D272-W276 HydrophobicContact CB-CD2 4.34Å; D272-W276 HydrophobicContact CB-CH2 4.24Å; D272-W276 HydrophobicContact CB-CZ2 3.54Å; D272-W276 VanDerWaalsContact O-CD1 3.3Å; D272-W276 PolarHBondContact O-N 3.37Å; D272-W276 VanDerWaalsContact O-N 3.17Å; L273-W276 HydrophobicContact CD2-CE3 4.29Å; L273-W276 PolarHBondContact O-N 3.04Å; L273-W276 VanDerWaalsContact O-N 3.09Å; W276-H278 PolarHBondContact O-N 3.17Å; W276-H278 VanDerWaalsContact O-N 3.1Å; W276-I279 HydrophobicContact CB-CB 4.22Å; W276-I279 HydrophobicContact CB-CG1 4.14Å; W276-I279 WeakPolarHBondContact O-CA 3.36Å; W276-I279 WeakPolarHBondContact O-CB 3.43Å; W276-I279 PolarHBondContact O-N 3.39Å; W276-C280 PolarHBondContact O-N 3.06Å
277	T	82	Confident	74.9	Confident	104 Å²	104	64.4 Å²	64.4	64%	0.638	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-17	-177.6	57.8	0	0	0	0	113.9	A275 I279 C280 A298	A275-T277 VanDerWaalsContact C-N 3.33Å; A275-T277 PolarHBondContact O-N 3.2Å; T277-I279 VanDerWaalsContact C-N 3.27Å; T277-C280 WeakPolarHBondContact CA-O 3.4Å; T277-A298 WeakPolarHBondContact O-CB 3.14Å
278	H	77.9	Confident	73.1	Confident	96 Å²	96	66.1 Å²	66.1	44%	0.444	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	5.4	170.8	66	-67.7	0	0	0	114.3	Q234 R238 W276	Q234-H278 PolarHBondContact OE1-NE2 3.02Å; R238-H278 PolarHBondContact NH2-O 2.94Å; R238-H278 VanDerWaalsContact NH2-O 3.17Å; W276-H278 PolarHBondContact O-N 3.17Å; W276-H278 VanDerWaalsContact O-N 3.1Å
279	I	81.8	Confident	71.9	Confident	7 Å²	7	66.6 Å²	66.6	4%	0.036	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-47	177.8	-54.4	-65.3	0	0	0	110.3	Q234 I237 R238 W276 T277 A298	Q234-I279 HydrophobicContact CB-CD1 3.93Å; Q234-I279 HydrophobicContact CB-CG1 3.99Å; Q234-I279 HydrophobicContact CG-CD1 4.45Å; Q234-I279 HydrophobicContact CG-CG1 4.02Å; I237-I279 HydrophobicContact CB-CG2 4.26Å; I237-I279 HydrophobicContact CG2-CG2 3.93Å; R238-I279 HydrophobicContact CB-CG2 4.15Å; W276-I279 HydrophobicContact CB-CB 4.22Å; W276-I279 HydrophobicContact CB-CG1 4.14Å; W276-I279 WeakPolarHBondContact O-CA 3.36Å; W276-I279 WeakPolarHBondContact O-CB 3.43Å; W276-I279 PolarHBondContact O-N 3.39Å; T277-I279 VanDerWaalsContact C-N 3.27Å; I279-A298 PolarHBondContact O-N 3.04Å; I279-A298 VanDerWaalsContact O-N 3.16Å
280	C	79.8	Confident	70.3	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.007	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	150.9	-171.6	56.4	0	0	0	0	113.5	L241 W276 T277 L295 Y296	L241-C280 HydrophobicContact CD1-CB 3.47Å; L241-C280 VanDerWaalsContact CD1-CB 3.47Å; W276-C280 PolarHBondContact O-N 3.06Å; T277-C280 WeakPolarHBondContact CA-O 3.4Å; C280-L295 HydrophobicContact CB-CD1 3.82Å; C280-L295 HydrophobicContact CB-CD2 4.48Å; C280-L295 HydrophobicContact CB-CG 4Å; C280-Y296 CarbonylContact C-O 3.53Å; C280-Y296 WeakPolarHBondContact CA-O 3.37Å; C280-Y296 WeakPolarHBondContact CB-O 3.49Å
281	I	83.2	Confident	68.8	Low	78 Å²	78	71.4 Å²	71.4	40%	0.4	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.5	166.4	-60.4	166.9	0	0	0	107.5	L295 Y296	I281-L295 WeakPolarHBondContact O-CA 3.44Å; I281-Y296 PolarHBondContact N-O 3.18Å; I281-Y296 PolarHBondContact O-N 2.69Å
282	V	79.8	Confident	67.8	Low	30 Å²	30	68.1 Å²	68.1	18%	0.182	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.6	178.4	-165.2	0	0	0	0	109.2	V250 L273 E274 L293 L294 L295	V250-V282 HydrophobicContact CG2-CG1 4.41Å; L273-V282 HydrophobicContact CB-CG2 4.23Å; E274-V282 HydrophobicContact CG-CB 4.3Å; E274-V282 HydrophobicContact CG-CG1 4.25Å; E274-V282 HydrophobicContact CG-CG2 4.2Å; V282-L293 HydrophobicContact CG1-CB 3.98Å; V282-L293 HydrophobicContact CG1-CD1 4.11Å; V282-L293 HydrophobicContact CG1-CD2 4.31Å; V282-L293 HydrophobicContact CG1-CG 4.37Å; V282-L294 CarbonylContact C-O 3.25Å; V282-L294 WeakPolarHBondContact CA-O 3.47Å; V282-L295 HydrophobicContact CG2-CD1 3.82Å
283	E	74	Confident	67.3	Low	97 Å²	97	65.9 Å²	65.9	45%	0.453	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142.9	178.5	-172.2	-179	162.7	0	0	110.4	L293 L294 Y296	E283-L293 CarbonylContact O-C 3.59Å; E283-L293 VanDerWaalsContact O-CA 3.25Å; E283-L293 WeakPolarHBondContact O-CA 3.48Å; E283-L294 HydrophobicContact CB-CB 4.28Å; E283-L294 PolarHBondContact N-O 3.23Å; E283-L294 PolarHBondContact O-N 2.91Å; E283-Y296 HydrophobicContact CB-CE2 4.06Å; E283-Y296 WeakPolarHBondContact OE2-CE2 3.28Å
284	K	69.6	Low	66.9	Low	121 Å²	121	66.9 Å²	66.9	53%	0.526	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.3	-179.1	-35.1	-155	175.7	-165.8	0	109.2	E274 L293	E274-K284 WeakPolarHBondContact OE1-CE 3.45Å; E274-K284 IonicContact OE1-NZ 3.66Å; E274-K284 PolarHBondContact OE1-NZ 3.31Å; E274-K284 IonicContact OE2-NZ 2.67Å; E274-K284 PolarHBondContact OE2-NZ 3.01Å; K284-L293 HydrophobicContact CB-CD2 3.79Å; K284-L293 HydrophobicContact CD-CD2 3.56Å; K284-L293 HydrophobicContact CG-CD2 3.43Å; K284-L293 VanDerWaalsContact CG-CD2 3.43Å
285	T	51.8	Low	66.9	Low	50 Å²	50	62.4 Å²	62.4	31%	0.307	37%	0.372	S	S	.	.			trans	-79.4	176	174.2	64	0	0	0	0	111.1	W249 G287 E292 L294	W249-T285 HydrophobicContact CH2-CG2 3.79Å; W249-T285 HydrophobicContact CZ3-CG2 4Å; T285-G287 PolarHBondContact O-N 2.96Å; T285-E292 PolarHBondContact N-O 3.43Å; T285-E292 PolarHBondContact OG1-O 2.71Å; T285-L294 HydrophobicContact CG2-CD1 4.09Å
286	C	40.4	Very low	66.9	Low	148 Å²	148	61.9 Å²	61.9	100%	1	36%	0.356	S	S	*	.	S	Bend	trans	-65.5	1.3	-168.2	-75.5	0	0	0	0	117
287	G	42.6	Very low	66.8	Low	29 Å²	29	63.1 Å²	63.1	30%	0.299	37%	0.366	S	S	.	.	S	Bend	trans	-97.1	148.5	171.2	0	0	0	0	0	113	T285 N289 E292	T285-G287 PolarHBondContact O-N 2.96Å; G287-N289 PolarHBondContact O-N 3.28Å; G287-N289 VanDerWaalsContact O-N 3.12Å; G287-E292 VanDerWaalsContact CA-OE2 3.24Å; G287-E292 WeakPolarHBondContact CA-OE2 3.25Å
288	S	39.5	Very low	66.6	Low	116 Å²	116	59.6 Å²	59.6	81%	0.811	35%	0.347	S	S	*	.	S	Bend	trans	-85.6	31.9	-174.3	-65.6	0	0	0	0	114.3
289	N	52.7	Low	66	Low	91 Å²	91	60.6 Å²	60.6	49%	0.487	36%	0.36	S	S	.	.			trans	-111.4	135.5	-175.9	-68.5	-38.1	0	0	0	112.5	G287 S291 E292	G287-N289 PolarHBondContact O-N 3.28Å; G287-N289 VanDerWaalsContact O-N 3.12Å; N289-S291 PolarHBondContact O-N 3.33Å; N289-S291 VanDerWaalsContact O-N 3.15Å; N289-E292 HydrophobicContact CB-CG 4.23Å; N289-E292 WeakPolarHBondContact CB-OE1 3.32Å; N289-E292 PolarHBondContact ND2-OE1 3.24Å; N289-E292 PolarHBondContact O-N 3.32Å
290	S	48.7	Very low	64.2	Low	96 Å²	96	69.3 Å²	69.3	67%	0.671	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-7.2	176.3	54	0	0	0	0	114.7	L293	S290-L293 WeakPolarHBondContact O-CD1 3.39Å; S290-L293 WeakPolarHBondContact O-CG 3.4Å
291	S	50.8	Low	62.2	Low	64 Å²	64	76.9 Å²	76.9	45%	0.448	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.6	170.4	47.7	0	0	0	0	113.9	S251 N289 L293	S251-S291 PolarHBondContact OG-O 3.37Å; N289-S291 PolarHBondContact O-N 3.33Å; N289-S291 VanDerWaalsContact O-N 3.15Å; S291-L293 VanDerWaalsContact C-N 3.35Å
292	E	58.8	Low	59.6	Low	61 Å²	61	78.9 Å²	78.9	29%	0.285	46%	0.461	S	S	.	.	S	Bend	trans	-102.3	27.8	-178.8	-67	162.4	-143.6	0	0	111.4	W249 T285 G287 N289	W249-E292 HydrophobicContact CZ3-CB 4.36Å; W249-E292 WeakPolarHBondContact CZ3-O 3.49Å; T285-E292 PolarHBondContact N-O 3.43Å; T285-E292 PolarHBondContact OG1-O 2.71Å; G287-E292 VanDerWaalsContact CA-OE2 3.24Å; G287-E292 WeakPolarHBondContact CA-OE2 3.25Å; N289-E292 HydrophobicContact CB-CG 4.23Å; N289-E292 WeakPolarHBondContact CB-OE1 3.32Å; N289-E292 PolarHBondContact ND2-OE1 3.24Å; N289-E292 PolarHBondContact O-N 3.32Å
293	L	72.1	Confident	57.3	Low	12 Å²	12	85.2 Å²	85.2	6%	0.063	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	138.2	173.2	-57.2	175.8	0	0	0	110	W249 V250 V282 E283 K284 S290 S291	W249-L293 CarbonylContact C-O 3.59Å; W249-L293 WeakPolarHBondContact CA-O 3.43Å; V250-L293 HydrophobicContact CB-CB 3.91Å; V250-L293 HydrophobicContact CG2-CB 3.53Å; V250-L293 PolarHBondContact N-O 2.88Å; V282-L293 HydrophobicContact CG1-CB 3.98Å; V282-L293 HydrophobicContact CG1-CD1 4.11Å; V282-L293 HydrophobicContact CG1-CD2 4.31Å; V282-L293 HydrophobicContact CG1-CG 4.37Å; E283-L293 CarbonylContact O-C 3.59Å; E283-L293 VanDerWaalsContact O-CA 3.25Å; E283-L293 WeakPolarHBondContact O-CA 3.48Å; K284-L293 HydrophobicContact CB-CD2 3.79Å; K284-L293 HydrophobicContact CD-CD2 3.56Å; K284-L293 HydrophobicContact CG-CD2 3.43Å; K284-L293 VanDerWaalsContact CG-CD2 3.43Å; S290-L293 WeakPolarHBondContact O-CD1 3.39Å; S290-L293 WeakPolarHBondContact O-CG 3.4Å; S291-L293 VanDerWaalsContact C-N 3.35Å
294	L	75.3	Confident	54.9	Low	23 Å²	23	85.9 Å²	85.9	12%	0.12	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	139.6	170.3	-77.3	154.9	0	0	0	109.8	W249 V282 E283 T285 Y296	W249-L294 HydrophobicContact CD2-CD2 3.66Å; W249-L294 HydrophobicContact CD2-CG 3.95Å; W249-L294 HydrophobicContact CE3-CD2 4.05Å; W249-L294 HydrophobicContact CE3-CG 3.79Å; W249-L294 HydrophobicContact CG-CD2 3.94Å; W249-L294 HydrophobicContact CH2-CD1 4.02Å; W249-L294 HydrophobicContact CH2-CG 4.15Å; W249-L294 HydrophobicContact CZ2-CD1 4.22Å; W249-L294 HydrophobicContact CZ2-CD2 4.19Å; W249-L294 HydrophobicContact CZ2-CG 4.29Å; W249-L294 HydrophobicContact CZ3-CD1 4.17Å; W249-L294 HydrophobicContact CZ3-CD2 4.47Å; W249-L294 HydrophobicContact CZ3-CG 3.89Å; V282-L294 CarbonylContact C-O 3.25Å; V282-L294 WeakPolarHBondContact CA-O 3.47Å; E283-L294 HydrophobicContact CB-CB 4.28Å; E283-L294 PolarHBondContact N-O 3.23Å; E283-L294 PolarHBondContact O-N 2.91Å; T285-L294 HydrophobicContact CG2-CD1 4.09Å; L294-Y296 HydrophobicContact CB-CD2 4.41Å; L294-Y296 HydrophobicContact CB-CE2 3.58Å
295	L	79.2	Confident	53.2	Low	0 Å²	0	86.2 Å²	86.2	0%	0	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.1	-178.5	-158.5	75.9	0	0	0	110.1	I237 L241 G247 F248 V250 L253 L273 C280 I281 V282	I237-L295 HydrophobicContact CG2-CD2 4.29Å; L241-L295 HydrophobicContact CD1-CD2 4.08Å; L241-L295 HydrophobicContact CD1-CG 4.32Å; L241-L295 HydrophobicContact CD2-CB 4.43Å; L241-L295 HydrophobicContact CD2-CD2 4.02Å; L241-L295 HydrophobicContact CD2-CG 4.05Å; L241-L295 HydrophobicContact CG-CD2 4.37Å; G247-L295 CarbonylContact C-O 3.56Å; G247-L295 WeakPolarHBondContact CA-O 3.42Å; F248-L295 HydrophobicContact CE2-CD2 4.48Å; F248-L295 HydrophobicContact CZ-CD2 4.15Å; F248-L295 PolarHBondContact N-O 2.67Å; F248-L295 WeakPolarHBondContact O-CB 3.47Å; F248-L295 PolarHBondContact O-N 3.47Å; V250-L295 HydrophobicContact CG2-CB 3.96Å; V250-L295 HydrophobicContact CG2-CD1 4.07Å; L253-L295 HydrophobicContact CD1-CD2 3.98Å; L253-L295 HydrophobicContact CD2-CD2 3.99Å; L253-L295 HydrophobicContact CG-CD2 4.49Å; L273-L295 HydrophobicContact CD1-CD1 4.29Å; L273-L295 HydrophobicContact CD2-CD1 4.28Å; L273-L295 HydrophobicContact CD2-CD2 4.41Å; C280-L295 HydrophobicContact CB-CD1 3.82Å; C280-L295 HydrophobicContact CB-CD2 4.48Å; C280-L295 HydrophobicContact CB-CG 4Å; I281-L295 WeakPolarHBondContact O-CA 3.44Å; V282-L295 HydrophobicContact CG2-CD1 3.82Å
296	Y	79.7	Confident	52.1	Low	59 Å²	59	89.3 Å²	89.3	23%	0.231	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.9	178.8	-60.9	-93.7	0	0	0	110.8	N246 C280 I281 E283 L294	N246-Y296 VanDerWaalsContact O-CE1 3.27Å; N246-Y296 WeakPolarHBondContact O-CE1 3.35Å; C280-Y296 CarbonylContact C-O 3.53Å; C280-Y296 WeakPolarHBondContact CA-O 3.37Å; C280-Y296 WeakPolarHBondContact CB-O 3.49Å; I281-Y296 PolarHBondContact N-O 3.18Å; I281-Y296 PolarHBondContact O-N 2.69Å; E283-Y296 HydrophobicContact CB-CE2 4.06Å; E283-Y296 WeakPolarHBondContact OE2-CE2 3.28Å; L294-Y296 HydrophobicContact CB-CD2 4.41Å; L294-Y296 HydrophobicContact CB-CE2 3.58Å
297	P	83.1	Confident	52	Low	43 Å²	43	87.6 Å²	87.6	28%	0.279	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	144.6	170	22.8	-31.5	0	0	0	111.3	L241	L241-P297 HydrophobicContact CB-CB 4.03Å
298	A	78.4	Confident	51.3	Low	29 Å²	29	91.6 Å²	91.6	24%	0.24	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-67.1	135.9	170.1	0	0	0	0	0	111	T277 I279 E300	T277-A298 WeakPolarHBondContact O-CB 3.14Å; I279-A298 PolarHBondContact O-N 3.04Å; I279-A298 VanDerWaalsContact O-N 3.16Å; A298-E300 PolarHBondContact O-N 3.18Å
299	T	65.4	Low	50.8	Low	118 Å²	118	94 Å²	94	72%	0.724	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-72.3	121.2	175.7	47.9	0	0	0	0	111	L301	T299-L301 PolarHBondContact O-N 3.34Å
300	E	44.4	Very low	49.5	Very low	190 Å²	190	96 Å²	96	89%	0.888	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-70.8	123.8	175.8	-66.2	-163.3	160.3	0	0	111.5	A298	A298-E300 PolarHBondContact O-N 3.18Å
301	L	36.9	Very low	48.4	Very low	160 Å²	160	94.6 Å²	94.6	84%	0.838	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-75	121.7	166.9	-80.6	158.9	0	0	0	109.1	T299 N303	T299-L301 PolarHBondContact O-N 3.34Å; L301-N303 PolarHBondContact O-N 3Å; L301-N303 VanDerWaalsContact O-N 3.16Å
302	S	29.6	Very low	47.3	Very low	120 Å²	120	99 Å²	99	84%	0.839	59%	0.591	S	S	*	*			trans	-66.1	108.9	179.8	56.1	0	0	0	0	112
303	N	30.1	Very low	45.7	Very low	163 Å²	163	103.2 Å²	103.2	87%	0.872	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-84.3	123.8	169	-79.5	-28.3	0	0	0	110.8	L301	L301-N303 PolarHBondContact O-N 3Å; L301-N303 VanDerWaalsContact O-N 3.16Å
304	S	24.9	Very low	43.6	Very low	110 Å²	110	107.3 Å²	107.3	77%	0.769	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-89.5	161.4	162.5	57.2	0	0	0	0	110.4
305	P	33.8	Very low	41.1	Very low	128 Å²	128	112.3 Å²	112.3	83%	0.831	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-84.8	149.8	-150.6	31.9	-36.2	0	0	0	115.3
306	S	28.6	Very low	38.5	Very low	116 Å²	116	117.2 Å²	117.2	81%	0.811	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-89	156.5	169.3	51.5	0	0	0	0	112.5
307	P	38	Very low	35.7	Very low	111 Å²	111	120 Å²	120	72%	0.721	74%	0.74	S	S	*	*			trans	-110	153.2	164.2	36.1	-28.6	0	0	0	113.8
308	S	26.4	Very low	33.7	Very low	113 Å²	113	123.8 Å²	123.8	79%	0.79	76%	0.764	S	S	*	*			trans	62.1	137.1	160.4	60.3	0	0	0	0	120.3
309	Q	30.1	Very low	31.2	Very low	168 Å²	168	126.3 Å²	126.3	79%	0.785	79%	0.786	S	S	*	*			cis	176.3	155.4	-27.9	-120.3	-171.4	28.5	0	0	106.5
310	T	25.7	Very low	29.2	Very low	131 Å²	131	128.8 Å²	128.8	80%	0.804	79%	0.789	S	S	*	*			trans	76.8	137.2	153.4	48.6	0	0	0	0	121.9
311	G	24.7	Very low	28.2	Very low	68 Å²	68	125.2 Å²	125.2	70%	0.701	78%	0.779	S	S	*	*			trans	-80.3	-163.8	179.2	0	0	0	0	0	113.9
312	N	27.5	Very low	27.6	Very low	155 Å²	155	121.9 Å²	121.9	83%	0.829	77%	0.77	S	S	*	*			cis	-151	176.5	21.8	-105	-19.8	0	0	0	111.7
313	N	26.6	Very low	27.4	Very low	151 Å²	151	127 Å²	127	81%	0.807	77%	0.771	S	S	*	*			trans	-25.5	153.6	161.2	-49	-31.4	0	0	0	115.7
314	S	26.5	Very low	27.3	Very low	98 Å²	98	125.1 Å²	125.1	69%	0.685	77%	0.765	S	S	*	*			cis	-171.6	152.4	36.8	51.6	0	0	0	0	115.5
315	T	23.4	Very low	27.4	Very low	128 Å²	128	127.3 Å²	127.3	79%	0.785	76%	0.763	S	S	*	*			trans	67.6	144.3	142.5	46.5	0	0	0	0	124.8
316	S	23.8	Very low	26.9	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	76%	0.761	S	S	*	*			trans	70.1	104.9	157.6	48.1	0	0	0	0	121.2
317	S	22.2	Very low	27.2	Very low	117 Å²	117	135.2 Å²	135.2	82%	0.818	76%	0.763	S	S	*	*				31.7	156.3	107.5	-40.2	0	0	0	0	120.7
318	P	40.3	Very low	26.8	Very low	123 Å²	123	136 Å²	136	80%	0.799	77%	0.768	S	S	*	*			cis	-139.2	-169.9	15.9	41	-20.3	0	0	0	117.1
319	A	25.4	Very low	26.9	Very low	83 Å²	83	138.6 Å²	138.6	69%	0.686	77%	0.768	S	S	*	*			trans	-37.5	154.3	177	0	0	0	0	0	118.1
320	E	23.5	Very low	26.7	Very low	170 Å²	170	138.6 Å²	138.6	79%	0.794	77%	0.771	S	S	*	*				179.5	161.2	90.1	-98.9	-77.4	81.5	0	0	109.1
321	V	23.3	Very low	26.7	Very low	114 Å²	114	139.4 Å²	139.4	69%	0.691	77%	0.771	S	S	*	*			cis	-140.9	-137.1	3.2	65.1	0	0	0	0	110.5
322	S	25.4	Very low	28.2	Very low	91 Å²	91	140.9 Å²	140.9	64%	0.636	77%	0.768	S	S	*	*			trans	-147	167.8	-178.2	58.7	0	0	0	0	113.3
323	R	26.1	Very low	28.4	Very low	228 Å²	228	141.3 Å²	141.3	86%	0.86	77%	0.769	S	S	*	*				120.2	104.6	125	-138	169.3	-170	-172.7	3.4	119.9
324	V	27.4	Very low	28.4	Very low	122 Å²	122	139 Å²	139	74%	0.739	77%	0.771	S	S	*	*				46.3	126.1	129.8	-172.8	0	0	0	0	120.7
325	Q	25.8	Very low	29	Very low	157 Å²	157	146 Å²	146	73%	0.734	78%	0.783	S	S	*	*				-173.8	138.1	115.6	-100.7	-171.1	65.3	0	0	116.9
326	K	23.2	Very low	29.2	Very low	182 Å²	182	145.2 Å²	145.2	79%	0.791	78%	0.782	S	S	*	*			trans	44.1	144.3	143.2	-65.8	178.2	-178.5	170.3	0	124.1
327	R	35.3	Very low	29.7	Very low	227 Å²	227	145.5 Å²	145.5	86%	0.857	79%	0.785	S	S	*	*			trans	-80	166.5	170.4	-63.9	178.1	173.5	-178.4	-3.1	113.3
328	P	29.4	Very low	30.3	Very low	128 Å²	128	145.5 Å²	145.5	83%	0.831	78%	0.784	S	S	*	*				-134.8	177.3	124.6	34.3	-20.5	0	0	0	115.3
329	H	28.3	Very low	30.6	Very low	168 Å²	168	143 Å²	143	78%	0.778	77%	0.768	S	S	*	*			trans	-95	165	179.7	-80.5	-101.2	0	0	0	113.2
330	I	26.6	Very low	32.1	Very low	167 Å²	167	143.9 Å²	143.9	86%	0.856	78%	0.776	S	S	*	*			trans	-179	155.9	131.7	-92	154.3	0	0	0	111.2
331	N	26	Very low	34	Very low	148 Å²	148	139 Å²	139	79%	0.791	76%	0.764	S	S	*	*			trans	-118.8	-179.7	-178.4	-111.1	-0.2	0	0	0	109.1
332	P	55.9	Low	36.7	Very low	99 Å²	99	134.7 Å²	134.7	64%	0.643	74%	0.737	S	S	*	*			cis	-136.6	-164.6	-28	37.4	-16.9	0	0	0	113.3
333	L	31.9	Very low	39.4	Very low	164 Å²	164	133 Å²	133	86%	0.859	73%	0.725	S	S	*	*			trans	76.6	112.9	159.6	-74	157.5	0	0	0	121.2
334	A	26.6	Very low	41.9	Very low	103 Å²	103	127 Å²	127	85%	0.851	72%	0.716	S	S	*	*			trans	-154.6	142.8	141.3	0	0	0	0	0	110.6
335	R	38.9	Very low	44.4	Very low	246 Å²	246	126.1 Å²	126.1	93%	0.928	71%	0.707	S	S	*	*			trans	-102.8	140.1	168.9	-70	174.5	171.4	173.7	-4.1	108.9
336	S	28.7	Very low	47.2	Very low	110 Å²	110	119.3 Å²	119.3	77%	0.769	68%	0.675	S	S	*	*			trans	-162.7	128.7	155.9	55.2	0	0	0	0	114.7
337	S	32.8	Very low	50.2	Low	109 Å²	109	114 Å²	114	76%	0.762	65%	0.652	S	S	*	*			trans	37.3	120.6	145	60.2	0	0	0	0	121.7
338	S	34.7	Very low	52.5	Low	116 Å²	116	108.9 Å²	108.9	81%	0.811	64%	0.638	S	S	*	*			trans	-71.7	131.1	150.5	48.6	0	0	0	0	111.4
339	P	47.3	Very low	55.3	Low	71 Å²	71	106.8 Å²	106.8	46%	0.461	61%	0.613	S	S	.	*			trans	-85	146.7	172	33.6	-32.1	0	0	0	111.9	Y381	P339-Y381 HydrophobicContact CG-CD1 4.07Å; P339-Y381 HydrophobicContact CG-CD2 4.45Å; P339-Y381 HydrophobicContact CG-CE1 3.85Å; P339-Y381 HydrophobicContact CG-CE2 4.29Å; P339-Y381 HydrophobicContact CG-CG 4.38Å
340	A	56.4	Low	58.1	Low	102 Å²	102	98.8 Å²	98.8	84%	0.843	58%	0.576	S	S	*	*	S	Bend	trans	-101.8	3.4	-171.3	0	0	0	0	0	115.6
341	A	64.9	Low	60.8	Low	66 Å²	66	93.9 Å²	93.9	55%	0.545	55%	0.55	S	S	.	*	S	Bend	trans	-157.1	156	177	0	0	0	0	0	111.3
342	L	78.1	Confident	63.4	Low	25 Å²	25	90.8 Å²	90.8	13%	0.131	53%	0.531	C	S	.	.			trans	-70.7	141.9	166.9	-64.2	170.6	0	0	0	109.8	L346 K347 Y381 V382 L388 L389	L342-L346 HydrophobicContact CD2-CD2 3.84Å; L342-L346 HydrophobicContact CD2-CG 4.38Å; L342-K347 HydrophobicContact CB-CB 4.48Å; L342-Y381 HydrophobicContact CD2-CE2 4.06Å; L342-V382 HydrophobicContact CD2-CG1 4.27Å; L342-V382 HydrophobicContact CD2-CG2 3.66Å; L342-L388 HydrophobicContact CD1-CB 4.09Å; L342-L388 WeakPolarHBondContact CD1-O 3.47Å; L342-L388 HydrophobicContact CG-CB 4.08Å; L342-L389 HydrophobicContact CD1-CD2 3.54Å; L342-L389 HydrophobicContact CD1-CG 4.5Å
343	S	82.6	Confident	64.8	Low	55 Å²	55	86.1 Å²	86.1	39%	0.385	50%	0.5	S	S	.	.			trans	-69.1	148.4	170.9	63.4	0	0	0	0	110.8	D345 L346 K347	S343-D345 VanDerWaalsContact C-N 3.3Å; S343-D345 PolarHBondContact O-N 3.19Å; S343-L346 WeakPolarHBondContact O-CB 3.45Å; S343-L346 PolarHBondContact O-N 3.45Å; S343-L346 VanDerWaalsContact OG-CB 3.24Å; S343-L346 WeakPolarHBondContact OG-CB 3.38Å; S343-K347 PolarHBondContact O-N 2.71Å
344	P	78.2	Confident	67.2	Low	102 Å²	102	78.3 Å²	78.3	66%	0.662	46%	0.459	S	S	*	.	H	α-helix	trans	-54.4	-43.8	-179.7	-27.4	35.6	0	0	0	113.1	L346 K347 Q348	P344-L346 VanDerWaalsContact C-N 3.3Å; P344-L346 PolarHBondContact O-N 2.73Å; P344-K347 PolarHBondContact O-N 2.95Å; P344-Q348 WeakPolarHBondContact O-CB 3.37Å; P344-Q348 PolarHBondContact O-N 2.95Å
345	D	80.4	Confident	69.5	Low	103 Å²	103	78.5 Å²	78.5	55%	0.551	44%	0.444	S	S	*	.	H	α-helix	trans	-62.3	-35.3	177.6	-52	-78.7	0	0	0	113.2	S343 R349	S343-D345 VanDerWaalsContact C-N 3.3Å; S343-D345 PolarHBondContact O-N 3.19Å; D345-R349 WeakPolarHBondContact O-CB 3.49Å; D345-R349 WeakPolarHBondContact O-CD 3.44Å; D345-R349 WeakPolarHBondContact O-CG 3.24Å; D345-R349 PolarHBondContact O-N 3.21Å
346	L	84.9	Confident	71.3	Confident	14 Å²	14	73.1 Å²	73.1	7%	0.073	43%	0.427	C	S	.	.	H	α-helix	trans	-72.9	-43.7	178.4	176	57.6	0	0	0	110.3	L342 S343 P344 R349 L350 F370 L378 P379 V382	L342-L346 HydrophobicContact CD2-CD2 3.84Å; L342-L346 HydrophobicContact CD2-CG 4.38Å; S343-L346 WeakPolarHBondContact O-CB 3.45Å; S343-L346 PolarHBondContact O-N 3.45Å; S343-L346 VanDerWaalsContact OG-CB 3.24Å; S343-L346 WeakPolarHBondContact OG-CB 3.38Å; P344-L346 VanDerWaalsContact C-N 3.3Å; P344-L346 PolarHBondContact O-N 2.73Å; L346-R349 PolarHBondContact O-N 2.7Å; L346-L350 HydrophobicContact CD1-CD1 3.93Å; L346-L350 HydrophobicContact CD1-CG 4.3Å; L346-L350 HydrophobicContact CG-CD1 3.93Å; L346-L350 WeakPolarHBondContact O-CB 3.18Å; L346-L350 WeakPolarHBondContact O-CD1 3.49Å; L346-L350 VanDerWaalsContact O-CG 3.25Å; L346-L350 WeakPolarHBondContact O-CG 3.23Å; L346-L350 PolarHBondContact O-N 2.91Å; L346-F370 HydrophobicContact CD1-CE1 3.98Å; L346-F370 HydrophobicContact CD1-CE2 3.81Å; L346-F370 HydrophobicContact CD1-CZ 3.37Å; L346-L378 HydrophobicContact CD1-CD1 3.88Å; L346-P379 HydrophobicContact CD2-CG 3.89Å; L346-V382 HydrophobicContact CD2-CG2 4.19Å
347	K	85.8	Confident	73.6	Confident	72 Å²	72	72.1 Å²	72.1	31%	0.313	41%	0.408	S	S	.	.	H	α-helix	trans	-61.2	-48.5	177.5	-175.6	178.9	174	176.9	0	111.8	L342 S343 P344 R349 L350 E351 D391 I392	L342-K347 HydrophobicContact CB-CB 4.48Å; S343-K347 PolarHBondContact O-N 2.71Å; P344-K347 PolarHBondContact O-N 2.95Å; K347-R349 PolarHBondContact O-N 2.85Å; K347-L350 WeakPolarHBondContact O-CB 3.21Å; K347-L350 PolarHBondContact O-N 2.93Å; K347-E351 PolarHBondContact O-N 3.42Å; K347-D391 WeakPolarHBondContact CE-OD2 3.35Å; K347-D391 IonicContact NZ-OD2 3.67Å; K347-D391 PolarHBondContact NZ-OD2 2.72Å; K347-I392 HydrophobicContact CD-CG2 4.39Å; K347-I392 VanDerWaalsContact CE-CG2 3.42Å; K347-I392 HydrophobicContact CG-CD1 4.34Å; K347-I392 HydrophobicContact CG-CG2 4.04Å
348	Q	83.6	Confident	74.8	Confident	119 Å²	119	71.6 Å²	71.6	56%	0.556	40%	0.404	S	S	*	.	H	α-helix	trans	-59.9	-45.3	178.1	-177.1	174.5	0.7	0	0	112.1	P344 L350 E351 E352	P344-Q348 WeakPolarHBondContact O-CB 3.37Å; P344-Q348 PolarHBondContact O-N 2.95Å; Q348-L350 VanDerWaalsContact C-N 3.31Å; Q348-L350 PolarHBondContact O-N 2.91Å; Q348-E351 PolarHBondContact O-N 2.88Å; Q348-E352 WeakPolarHBondContact O-CG 3.43Å; Q348-E352 PolarHBondContact O-N 3.41Å
349	R	88.1	Confident	76.2	Confident	83 Å²	83	71.2 Å²	71.2	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-32.3	176.8	-70.4	174.3	-169.9	-163.4	4.4	113.1	D345 L346 K347 L353 F370 Y374	D345-R349 WeakPolarHBondContact O-CB 3.49Å; D345-R349 WeakPolarHBondContact O-CD 3.44Å; D345-R349 WeakPolarHBondContact O-CG 3.24Å; D345-R349 PolarHBondContact O-N 3.21Å; L346-R349 PolarHBondContact O-N 2.7Å; K347-R349 PolarHBondContact O-N 2.85Å; R349-L353 VanDerWaalsContact O-CB 3.28Å; R349-L353 WeakPolarHBondContact O-CB 3.42Å; R349-L353 PolarHBondContact O-N 2.89Å; R349-L353 VanDerWaalsContact O-N 3.1Å; R349-F370 HydrophobicContact CB-CE2 3.53Å; R349-F370 HydrophobicContact CB-CZ 3.91Å; R349-Y374 HydrophobicContact CB-CD1 4.28Å; R349-Y374 HydrophobicContact CB-CD2 4.04Å; R349-Y374 HydrophobicContact CB-CE1 3.93Å; R349-Y374 HydrophobicContact CB-CE2 3.69Å; R349-Y374 HydrophobicContact CB-CG 4.34Å; R349-Y374 HydrophobicContact CG-CD1 3.82Å; R349-Y374 HydrophobicContact CG-CD2 4.45Å; R349-Y374 HydrophobicContact CG-CE1 3.58Å; R349-Y374 HydrophobicContact CG-CE2 4.27Å; R349-Y374 HydrophobicContact CG-CG 4.26Å; R349-Y374 VanDerWaalsContact O-CE2 3.3Å; R349-Y374 WeakPolarHBondContact O-CE2 3.47Å; R349-Y374 PolarHBondContact O-OH 3.33Å
350	L	88	Confident	77.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-70.3	-39.1	173.6	-75.6	165.7	0	0	0	111.4	L346 K347 Q348 L353 L354 L366 F370 L378 V382 L389 I392	L346-L350 HydrophobicContact CD1-CD1 3.93Å; L346-L350 HydrophobicContact CD1-CG 4.3Å; L346-L350 HydrophobicContact CG-CD1 3.93Å; L346-L350 WeakPolarHBondContact O-CB 3.18Å; L346-L350 WeakPolarHBondContact O-CD1 3.49Å; L346-L350 VanDerWaalsContact O-CG 3.25Å; L346-L350 WeakPolarHBondContact O-CG 3.23Å; L346-L350 PolarHBondContact O-N 2.91Å; K347-L350 WeakPolarHBondContact O-CB 3.21Å; K347-L350 PolarHBondContact O-N 2.93Å; Q348-L350 VanDerWaalsContact C-N 3.31Å; Q348-L350 PolarHBondContact O-N 2.91Å; L350-L353 PolarHBondContact O-N 2.9Å; L350-L354 WeakPolarHBondContact O-CB 3.43Å; L350-L354 WeakPolarHBondContact O-CD1 3.34Å; L350-L354 VanDerWaalsContact O-CG 3.24Å; L350-L354 WeakPolarHBondContact O-CG 3.06Å; L350-L354 PolarHBondContact O-N 3.33Å; L350-L366 HydrophobicContact CD2-CD1 3.75Å; L350-L366 HydrophobicContact CD2-CD2 3.86Å; L350-L366 HydrophobicContact CD2-CG 3.92Å; L350-F370 HydrophobicContact CD2-CD2 3.67Å; L350-F370 HydrophobicContact CD2-CE2 4.02Å; L350-F370 HydrophobicContact CG-CD2 4.05Å; L350-F370 HydrophobicContact CG-CE2 3.86Å; L350-L378 HydrophobicContact CD1-CD1 4.29Å; L350-L378 HydrophobicContact CD2-CD1 3.88Å; L350-L378 HydrophobicContact CG-CD1 4.43Å; L350-V382 HydrophobicContact CD1-CG1 4.36Å; L350-L389 HydrophobicContact CD1-CD2 3.71Å; L350-I392 HydrophobicContact CB-CD1 3.92Å
351	E	82.6	Confident	78.5	Confident	65 Å²	65	64.3 Å²	64.3	30%	0.304	35%	0.35	S	S	.	.	H	α-helix	trans	-67.6	-44.6	176.1	-163.5	-172.8	161.3	0	0	112.5	K347 Q348 L353 L354 M355 I392 R410	K347-E351 PolarHBondContact O-N 3.42Å; Q348-E351 PolarHBondContact O-N 2.88Å; E351-L353 PolarHBondContact O-N 2.81Å; E351-L354 PolarHBondContact O-N 2.88Å; E351-M355 WeakPolarHBondContact O-CB 3.42Å; E351-M355 PolarHBondContact O-N 3.01Å; E351-I392 HydrophobicContact CB-CD1 4.41Å; E351-I392 HydrophobicContact CG-CB 4.45Å; E351-I392 HydrophobicContact CG-CG2 4.49Å; E351-R410 IonicContact OE1-CZ 2.82Å; E351-R410 IonicContact OE1-NE 2.79Å; E351-R410 IonicContact OE1-NH2 3.22Å; E351-R410 PolarHBondContact OE1-NH2 3.24Å
352	E	81.7	Confident	79.3	Confident	82 Å²	82	66 Å²	66	38%	0.383	34%	0.343	S	S	.	.	H	α-helix	trans	-58.5	-34.4	171.6	-77.9	175.9	-170.8	0	0	113.1	Q348 M355 Y374	Q348-E352 WeakPolarHBondContact O-CG 3.43Å; Q348-E352 PolarHBondContact O-N 3.41Å; E352-M355 WeakPolarHBondContact O-CB 3.45Å; E352-Y374 WeakPolarHBondContact CB-OH 3.25Å; E352-Y374 PolarHBondContact OE2-OH 3.06Å
353	L	83.8	Confident	79.6	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-73.2	-49.6	176.6	-172.1	64.5	0	0	0	110.5	R349 L350 E351 M355 K356 Y357 L366 L369 F370 T373 Y374	R349-L353 VanDerWaalsContact O-CB 3.28Å; R349-L353 WeakPolarHBondContact O-CB 3.42Å; R349-L353 PolarHBondContact O-N 2.89Å; R349-L353 VanDerWaalsContact O-N 3.1Å; L350-L353 PolarHBondContact O-N 2.9Å; E351-L353 PolarHBondContact O-N 2.81Å; L353-M355 PolarHBondContact O-N 2.92Å; L353-K356 WeakPolarHBondContact O-CB 3.37Å; L353-K356 PolarHBondContact O-N 3.15Å; L353-Y357 HydrophobicContact CD1-CE2 4.29Å; L353-Y357 VanDerWaalsContact O-CD2 3.31Å; L353-Y357 WeakPolarHBondContact O-CD2 3.4Å; L353-L366 HydrophobicContact CD2-CD1 3.98Å; L353-L369 HydrophobicContact CD1-CB 4.38Å; L353-L369 HydrophobicContact CD2-CB 4.12Å; L353-F370 HydrophobicContact CD2-CB 4Å; L353-F370 HydrophobicContact CD2-CD2 4.21Å; L353-T373 HydrophobicContact CD1-CG2 4.38Å; L353-T373 WeakPolarHBondContact CD1-OG1 3.36Å; L353-Y374 HydrophobicContact CB-CE2 4.42Å
354	L	82.8	Confident	79.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.2	-29.5	175.9	-72.5	164.6	0	0	0	112.3	L350 E351 K356 Y357 L361 I392 C393 L408 R410	L350-L354 WeakPolarHBondContact O-CB 3.43Å; L350-L354 WeakPolarHBondContact O-CD1 3.34Å; L350-L354 VanDerWaalsContact O-CG 3.24Å; L350-L354 WeakPolarHBondContact O-CG 3.06Å; L350-L354 PolarHBondContact O-N 3.33Å; E351-L354 PolarHBondContact O-N 2.88Å; L354-K356 PolarHBondContact O-N 2.79Å; L354-Y357 CarbonylContact O-C 3.52Å; L354-Y357 PolarHBondContact O-N 3.49Å; L354-L361 HydrophobicContact CD2-CB 3.88Å; L354-L361 HydrophobicContact CD2-CD2 3.85Å; L354-L361 HydrophobicContact CD2-CG 4.41Å; L354-I392 HydrophobicContact CD1-CD1 4.15Å; L354-I392 HydrophobicContact CD1-CG1 4.44Å; L354-C393 HydrophobicContact CD1-CB 3.94Å; L354-L408 HydrophobicContact CD2-CB 3.8Å; L354-R410 HydrophobicContact CB-CB 4.07Å; L354-R410 HydrophobicContact CB-CG 4.46Å
355	M	76	Confident	79.7	Confident	108 Å²	108	63.8 Å²	63.8	53%	0.532	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-34.8	172.1	-117.5	-52.4	-151.9	0	0	113	E351 E352 L353 Y357 R410	E351-M355 WeakPolarHBondContact O-CB 3.42Å; E351-M355 PolarHBondContact O-N 3.01Å; E352-M355 WeakPolarHBondContact O-CB 3.45Å; L353-M355 PolarHBondContact O-N 2.92Å; M355-Y357 VanDerWaalsContact C-N 3.28Å; M355-Y357 PolarHBondContact O-N 3.12Å; M355-R410 PolarHBondContact SD-NH1 3.46Å
356	K	75.1	Confident	79.9	Confident	132 Å²	132	58.9 Å²	58.9	57%	0.574	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-6	-178.4	-60.7	170	-174	170	0	113	L353 L354	L353-K356 WeakPolarHBondContact O-CB 3.37Å; L353-K356 PolarHBondContact O-N 3.15Å; L354-K356 PolarHBondContact O-N 2.79Å
357	Y	76.9	Confident	80	Confident	90 Å²	90	60 Å²	60	35%	0.353	30%	0.303	S	S	.	.			trans	-131.9	56.1	-175.6	-61.7	-77.7	0	0	0	110.8	L353 L354 M355 S359 G360 L361 L369	L353-Y357 HydrophobicContact CD1-CE2 4.29Å; L353-Y357 VanDerWaalsContact O-CD2 3.31Å; L353-Y357 WeakPolarHBondContact O-CD2 3.4Å; L354-Y357 CarbonylContact O-C 3.52Å; L354-Y357 PolarHBondContact O-N 3.49Å; M355-Y357 VanDerWaalsContact C-N 3.28Å; M355-Y357 PolarHBondContact O-N 3.12Å; Y357-S359 PolarHBondContact O-N 3.35Å; Y357-G360 PolarHBondContact O-N 3.4Å; Y357-L361 HydrophobicContact CD2-CD1 4.3Å; Y357-L361 HydrophobicContact CD2-CD2 4.13Å; Y357-L361 HydrophobicContact CG-CB 4.49Å; Y357-L361 HydrophobicContact CG-CD1 4.24Å; Y357-L369 HydrophobicContact CE2-CD1 4.26Å; Y357-L369 HydrophobicContact CE2-CD2 4.43Å; Y357-L369 WeakPolarHBondContact OH-CD2 3.43Å
358	S	59.4	Low	79.8	Confident	97 Å²	97	63.6 Å²	63.6	68%	0.678	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.8	-178.4	51.7	0	0	0	0	114.2	G360	S358-G360 PolarHBondContact O-N 3.26Å
359	S	63.3	Low	79.8	Confident	109 Å²	109	59.9 Å²	59.9	76%	0.762	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	4.5	174.4	-49.8	0	0	0	0	114.7	Y357 Y409	Y357-S359 PolarHBondContact O-N 3.35Å; S359-Y409 VanDerWaalsContact O-CE1 3.26Å; S359-Y409 WeakPolarHBondContact O-CE1 3.46Å
360	G	70.4	Confident	79.9	Confident	19 Å²	19	56.1 Å²	56.1	20%	0.196	29%	0.289	C	S	.	.			trans	102.2	141.1	-179.2	0	0	0	0	0	113.4	Y357 S358	Y357-G360 PolarHBondContact O-N 3.4Å; S358-G360 PolarHBondContact O-N 3.26Å
361	L	80.9	Confident	79.9	Confident	8 Å²	8	60 Å²	60	4%	0.042	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.8	-178.9	176.9	57.6	0	0	0	110.8	L354 Y357 A363 A365 L366 L369 L408	L354-L361 HydrophobicContact CD2-CB 3.88Å; L354-L361 HydrophobicContact CD2-CD2 3.85Å; L354-L361 HydrophobicContact CD2-CG 4.41Å; Y357-L361 HydrophobicContact CD2-CD1 4.3Å; Y357-L361 HydrophobicContact CD2-CD2 4.13Å; Y357-L361 HydrophobicContact CG-CB 4.49Å; Y357-L361 HydrophobicContact CG-CD1 4.24Å; L361-A363 PolarHBondContact O-N 2.87Å; L361-A365 HydrophobicContact CD1-CB 4.29Å; L361-L366 HydrophobicContact CD2-CD1 3.6Å; L361-L369 HydrophobicContact CD1-CD1 3.52Å; L361-L408 PolarHBondContact N-O 2.74Å; L361-L408 WeakPolarHBondContact O-CB 3.4Å; L361-L408 PolarHBondContact O-N 2.9Å
362	W	82.4	Confident	79.9	Confident	103 Å²	103	60.9 Å²	60.9	39%	0.39	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	131.6	176.8	-68.7	92.5	0	0	0	112.2	H364 A365 L366 P398 R405 I407	W362-H364 VanDerWaalsContact CB-CE1 3.49Å; W362-H364 WeakPolarHBondContact CB-CE1 3.36Å; W362-H364 AromaticContact CG-CE1 3.83Å; W362-H364 PolarHBondContact O-N 3.47Å; W362-A365 HydrophobicContact CB-CB 4.37Å; W362-A365 WeakPolarHBondContact O-CB 3.34Å; W362-A365 PolarHBondContact O-N 2.97Å; W362-L366 PolarHBondContact O-N 2.71Å; W362-P398 HydrophobicContact CH2-CG 4.2Å; W362-P398 HydrophobicContact CZ3-CG 4.12Å; W362-R405 HydrophobicContact CZ3-CB 4.31Å; W362-R405 VanDerWaalsContact CZ3-O 3.27Å; W362-R405 WeakPolarHBondContact CZ3-O 3.21Å; W362-I407 HydrophobicContact CD2-CD1 4.4Å; W362-I407 HydrophobicContact CD2-CG1 3.82Å; W362-I407 HydrophobicContact CE3-CD1 4.39Å; W362-I407 HydrophobicContact CE3-CG1 3.64Å; W362-I407 HydrophobicContact CH2-CD1 3.73Å; W362-I407 HydrophobicContact CH2-CG1 3.88Å; W362-I407 HydrophobicContact CZ2-CD1 3.7Å; W362-I407 HydrophobicContact CZ2-CG1 4.02Å; W362-I407 HydrophobicContact CZ3-CD1 4.07Å; W362-I407 HydrophobicContact CZ3-CG1 3.68Å
363	A	83.7	Confident	80.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-54.7	-46.3	-178	0	0	0	0	0	112.6	L361 A365 L366 L383 L386 A406 L408	L361-A363 PolarHBondContact O-N 2.87Å; A363-A365 PolarHBondContact O-N 3.33Å; A363-A365 VanDerWaalsContact O-N 3.14Å; A363-L366 WeakPolarHBondContact O-CB 3.49Å; A363-L366 PolarHBondContact O-N 3.41Å; A363-L383 HydrophobicContact CB-CD2 4.32Å; A363-L383 VanDerWaalsContact O-CD2 3.25Å; A363-L383 WeakPolarHBondContact O-CD2 3.29Å; A363-L386 HydrophobicContact CB-CD1 3.74Å; A363-L386 HydrophobicContact CB-CD2 3.99Å; A363-A406 HydrophobicContact CB-CB 4.17Å; A363-A406 PolarHBondContact N-O 3.08Å; A363-L408 HydrophobicContact CB-CD1 4.38Å; A363-L408 HydrophobicContact CB-CG 4.41Å
364	H	81.7	Confident	80.3	Confident	105 Å²	105	61.5 Å²	61.5	49%	0.486	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-62.6	-19.1	177.1	69.4	-88.9	0	0	0	115	W362 Q404	W362-H364 VanDerWaalsContact CB-CE1 3.49Å; W362-H364 WeakPolarHBondContact CB-CE1 3.36Å; W362-H364 AromaticContact CG-CE1 3.83Å; W362-H364 PolarHBondContact O-N 3.47Å; H364-Q404 WeakPolarHBondContact CB-O 3.28Å; H364-Q404 PolarHBondContact N-O 2.86Å
365	A	81.8	Confident	80.5	Confident	30 Å²	30	69.3 Å²	69.3	25%	0.248	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-84.2	-22.7	175.2	0	0	0	0	0	112.5	L361 W362 A363 P367 K368 L369	L361-A365 HydrophobicContact CD1-CB 4.29Å; W362-A365 HydrophobicContact CB-CB 4.37Å; W362-A365 WeakPolarHBondContact O-CB 3.34Å; W362-A365 PolarHBondContact O-N 2.97Å; A363-A365 PolarHBondContact O-N 3.33Å; A363-A365 VanDerWaalsContact O-N 3.14Å; A365-P367 VanDerWaalsContact C-CD 3.5Å; A365-K368 PolarHBondContact O-N 2.91Å; A365-L369 HydrophobicContact CB-CD1 4.09Å; A365-L369 PolarHBondContact O-N 2.9Å; A365-L369 VanDerWaalsContact O-N 3.09Å
366	L	86	Confident	81	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-54.6	-44.5	-176	-169.2	71.6	0	0	0	114.2	L350 L353 L361 W362 A363 K368 L369 F370 L378 L383 L389 L408	L350-L366 HydrophobicContact CD2-CD1 3.75Å; L350-L366 HydrophobicContact CD2-CD2 3.86Å; L350-L366 HydrophobicContact CD2-CG 3.92Å; L353-L366 HydrophobicContact CD2-CD1 3.98Å; L361-L366 HydrophobicContact CD2-CD1 3.6Å; W362-L366 PolarHBondContact O-N 2.71Å; A363-L366 WeakPolarHBondContact O-CB 3.49Å; A363-L366 PolarHBondContact O-N 3.41Å; L366-K368 VanDerWaalsContact C-N 3.35Å; L366-K368 PolarHBondContact O-N 2.89Å; L366-L369 PolarHBondContact O-N 3.43Å; L366-F370 WeakPolarHBondContact O-CB 3.39Å; L366-F370 PolarHBondContact O-N 3.33Å; L366-L378 HydrophobicContact CB-CD2 4.43Å; L366-L378 HydrophobicContact CD2-CD2 3.89Å; L366-L378 HydrophobicContact CG-CD2 3.95Å; L366-L383 HydrophobicContact CB-CD2 4.37Å; L366-L383 HydrophobicContact CD2-CD2 4.23Å; L366-L389 HydrophobicContact CD2-CD1 4.09Å; L366-L408 HydrophobicContact CD1-CD1 4.45Å; L366-L408 HydrophobicContact CD2-CD1 3.85Å
367	P	86.7	Confident	81.3	Confident	36 Å²	36	69.5 Å²	69.5	23%	0.234	35%	0.354	C	S	.	.	H	α-helix	trans	-65.4	-38.8	-177	-18.8	30.5	0	0	0	112.9	A365 Q371 L378 L383	A365-P367 VanDerWaalsContact C-CD 3.5Å; P367-Q371 VanDerWaalsContact O-CB 3.27Å; P367-Q371 WeakPolarHBondContact O-CB 3.08Å; P367-Q371 PolarHBondContact O-N 2.76Å; P367-L378 HydrophobicContact CB-CB 4.07Å; P367-L378 HydrophobicContact CB-CD2 4.18Å; P367-L378 HydrophobicContact CG-CD2 4.03Å; P367-L383 HydrophobicContact CG-CD1 3.25Å; P367-L383 HydrophobicContact CG-CD2 4.38Å; P367-L383 HydrophobicContact CG-CG 3.91Å
368	K	80.4	Confident	81.8	Confident	149 Å²	149	66 Å²	66	65%	0.648	34%	0.342	S	S	*	.	H	α-helix	trans	-71.8	-46.8	-179.3	-172	176.8	178	-173.1	0	110.1	A365 L366 F370 Q371 D372	A365-K368 PolarHBondContact O-N 2.91Å; L366-K368 VanDerWaalsContact C-N 3.35Å; L366-K368 PolarHBondContact O-N 2.89Å; K368-F370 VanDerWaalsContact C-N 3.35Å; K368-F370 PolarHBondContact O-N 3.06Å; K368-Q371 PolarHBondContact O-N 2.81Å; K368-D372 WeakPolarHBondContact CG-OD2 3.25Å; K368-D372 WeakPolarHBondContact O-CB 3.46Å; K368-D372 VanDerWaalsContact O-CG 3.27Å; K368-D372 PolarHBondContact O-N 2.93Å
369	L	84.6	Confident	83.1	Confident	40 Å²	40	63.4 Å²	63.4	21%	0.209	32%	0.323	C	S	.	.	H	α-helix	trans	-63.8	-37.9	176.8	-78.3	163.8	0	0	0	113	L353 Y357 L361 A365 L366 D372 T373	L353-L369 HydrophobicContact CD1-CB 4.38Å; L353-L369 HydrophobicContact CD2-CB 4.12Å; Y357-L369 HydrophobicContact CE2-CD1 4.26Å; Y357-L369 HydrophobicContact CE2-CD2 4.43Å; Y357-L369 WeakPolarHBondContact OH-CD2 3.43Å; L361-L369 HydrophobicContact CD1-CD1 3.52Å; A365-L369 HydrophobicContact CB-CD1 4.09Å; A365-L369 PolarHBondContact O-N 2.9Å; A365-L369 VanDerWaalsContact O-N 3.09Å; L366-L369 PolarHBondContact O-N 3.43Å; L369-D372 PolarHBondContact O-N 2.88Å; L369-T373 VanDerWaalsContact O-CB 3.24Å; L369-T373 WeakPolarHBondContact O-CB 3.45Å; L369-T373 PolarHBondContact O-N 2.99Å; L369-T373 PolarHBondContact O-OG1 3.19Å
370	F	89.7	Confident	83.6	Confident	5 Å²	5	60.6 Å²	60.6	2%	0.022	31%	0.31	C	S	.	.	H	α-helix	trans	-65.8	-43.9	174	-169.1	-87.9	0	0	0	111.5	L346 R349 L350 L353 L366 K368 T373 Y374 I376 L378	L346-F370 HydrophobicContact CD1-CE1 3.98Å; L346-F370 HydrophobicContact CD1-CE2 3.81Å; L346-F370 HydrophobicContact CD1-CZ 3.37Å; R349-F370 HydrophobicContact CB-CE2 3.53Å; R349-F370 HydrophobicContact CB-CZ 3.91Å; L350-F370 HydrophobicContact CD2-CD2 3.67Å; L350-F370 HydrophobicContact CD2-CE2 4.02Å; L350-F370 HydrophobicContact CG-CD2 4.05Å; L350-F370 HydrophobicContact CG-CE2 3.86Å; L353-F370 HydrophobicContact CD2-CB 4Å; L353-F370 HydrophobicContact CD2-CD2 4.21Å; L366-F370 WeakPolarHBondContact O-CB 3.39Å; L366-F370 PolarHBondContact O-N 3.33Å; K368-F370 VanDerWaalsContact C-N 3.35Å; K368-F370 PolarHBondContact O-N 3.06Å; F370-T373 PolarHBondContact O-N 3.08Å; F370-Y374 AromaticContact CD2-CD2 3.83Å; F370-Y374 HydrophobicContact CD2-CD2 3.83Å; F370-Y374 HydrophobicContact CD2-CE2 4.18Å; F370-Y374 HydrophobicContact CE1-CD2 4.48Å; F370-Y374 AromaticContact CE2-CD2 3.82Å; F370-Y374 HydrophobicContact CE2-CD2 3.82Å; F370-Y374 HydrophobicContact CE2-CE2 4.16Å; F370-Y374 HydrophobicContact CG-CD2 4.19Å; F370-Y374 HydrophobicContact CZ-CD2 4.14Å; F370-Y374 PolarHBondContact O-N 2.75Å; F370-I376 WeakPolarHBondContact CD1-O 3.5Å; F370-L378 HydrophobicContact CB-CB 4.21Å; F370-L378 HydrophobicContact CB-CD1 4.25Å; F370-L378 HydrophobicContact CD1-CB 4.03Å; F370-L378 HydrophobicContact CD1-CD1 3.91Å; F370-L378 HydrophobicContact CD2-CD1 4Å; F370-L378 HydrophobicContact CE1-CD1 4.26Å; F370-L378 HydrophobicContact CE2-CD1 4.33Å; F370-L378 HydrophobicContact CG-CB 4.27Å; F370-L378 HydrophobicContact CG-CD1 3.78Å; F370-L378 HydrophobicContact CZ-CD1 4.47Å
371	Q	87.2	Confident	84.2	Confident	80 Å²	80	62.5 Å²	62.5	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-66.3	-39.5	175.5	-172.4	-179.8	-10.5	0	0	112.5	P367 K368 K375 I376 K377	P367-Q371 VanDerWaalsContact O-CB 3.27Å; P367-Q371 WeakPolarHBondContact O-CB 3.08Å; P367-Q371 PolarHBondContact O-N 2.76Å; K368-Q371 PolarHBondContact O-N 2.81Å; Q371-K375 WeakPolarHBondContact O-CA 3.32Å; Q371-K375 PolarHBondContact O-N 3.5Å; Q371-I376 VanDerWaalsContact CA-O 3.31Å; Q371-I376 WeakPolarHBondContact CA-O 3.38Å; Q371-K377 HydrophobicContact CG-CG 4.34Å
372	D	82.6	Confident	84.2	Confident	84 Å²	84	62.1 Å²	62.1	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-71	-33	179.2	-72.5	-24.4	0	0	0	111.5	K368 L369 K375	K368-D372 WeakPolarHBondContact CG-OD2 3.25Å; K368-D372 WeakPolarHBondContact O-CB 3.46Å; K368-D372 VanDerWaalsContact O-CG 3.27Å; K368-D372 PolarHBondContact O-N 2.93Å; L369-D372 PolarHBondContact O-N 2.88Å; D372-K375 WeakPolarHBondContact O-CE 3.29Å; D372-K375 PolarHBondContact O-NZ 3.34Å
373	T	86.7	Confident	84.2	Confident	56 Å²	56	58.3 Å²	58.3	34%	0.344	30%	0.297	S	S	.	.	H	α-helix	trans	-79.2	-52.8	178.2	-55.6	0	0	0	0	112.4	L353 L369 F370	L353-T373 HydrophobicContact CD1-CG2 4.38Å; L353-T373 WeakPolarHBondContact CD1-OG1 3.36Å; L369-T373 VanDerWaalsContact O-CB 3.24Å; L369-T373 WeakPolarHBondContact O-CB 3.45Å; L369-T373 PolarHBondContact O-N 2.99Å; L369-T373 PolarHBondContact O-OG1 3.19Å; F370-T373 PolarHBondContact O-N 3.08Å
374	Y	88.1	Confident	83.9	Confident	41 Å²	41	65.2 Å²	65.2	16%	0.161	33%	0.33	C	S	.	.	H	α-helix	trans	-102.8	3.3	-170.8	-60.4	-75.6	0	0	0	114.1	R349 E352 L353 F370 I376	R349-Y374 HydrophobicContact CB-CD1 4.28Å; R349-Y374 HydrophobicContact CB-CD2 4.04Å; R349-Y374 HydrophobicContact CB-CE1 3.93Å; R349-Y374 HydrophobicContact CB-CE2 3.69Å; R349-Y374 HydrophobicContact CB-CG 4.34Å; R349-Y374 HydrophobicContact CG-CD1 3.82Å; R349-Y374 HydrophobicContact CG-CD2 4.45Å; R349-Y374 HydrophobicContact CG-CE1 3.58Å; R349-Y374 HydrophobicContact CG-CE2 4.27Å; R349-Y374 HydrophobicContact CG-CG 4.26Å; R349-Y374 VanDerWaalsContact O-CE2 3.3Å; R349-Y374 WeakPolarHBondContact O-CE2 3.47Å; R349-Y374 PolarHBondContact O-OH 3.33Å; E352-Y374 WeakPolarHBondContact CB-OH 3.25Å; E352-Y374 PolarHBondContact OE2-OH 3.06Å; L353-Y374 HydrophobicContact CB-CE2 4.42Å; F370-Y374 AromaticContact CD2-CD2 3.83Å; F370-Y374 HydrophobicContact CD2-CD2 3.83Å; F370-Y374 HydrophobicContact CD2-CE2 4.18Å; F370-Y374 HydrophobicContact CE1-CD2 4.48Å; F370-Y374 AromaticContact CE2-CD2 3.82Å; F370-Y374 HydrophobicContact CE2-CD2 3.82Å; F370-Y374 HydrophobicContact CE2-CE2 4.16Å; F370-Y374 HydrophobicContact CG-CD2 4.19Å; F370-Y374 HydrophobicContact CZ-CD2 4.14Å; F370-Y374 PolarHBondContact O-N 2.75Å; Y374-I376 PolarHBondContact O-N 2.95Å
375	K	87.3	Confident	83.7	Confident	164 Å²	164	64.2 Å²	64.2	71%	0.713	33%	0.328	S	S	*	.	S	Bend	trans	55.8	16.5	-179.3	-52.6	-49.8	-174.7	-165.5	0	115.1	Q371 D372	Q371-K375 WeakPolarHBondContact O-CA 3.32Å; Q371-K375 PolarHBondContact O-N 3.5Å; D372-K375 WeakPolarHBondContact O-CE 3.29Å; D372-K375 PolarHBondContact O-NZ 3.34Å
376	I	86.1	Confident	83.8	Confident	94 Å²	94	63.1 Å²	63.1	48%	0.482	32%	0.318	S	S	.	.	S	Bend	trans	-126.7	136	-179.2	-66.5	159.7	0	0	0	107.9	F370 Q371 Y374 L378	F370-I376 WeakPolarHBondContact CD1-O 3.5Å; Q371-I376 VanDerWaalsContact CA-O 3.31Å; Q371-I376 WeakPolarHBondContact CA-O 3.38Å; Y374-I376 PolarHBondContact O-N 2.95Å; I376-L378 PolarHBondContact O-N 2.84Å
377	K	81.8	Confident	83.4	Confident	150 Å²	150	70.2 Å²	70.2	65%	0.652	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-64.5	135.3	179	-70.5	-176.3	175.1	-177	0	111	Q371	Q371-K377 HydrophobicContact CG-CG 4.34Å
378	L	86.9	Confident	83.1	Confident	16 Å²	16	70.9 Å²	70.9	8%	0.084	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-62.1	134.4	167.3	-170.8	72.6	0	0	0	109.5	L346 L350 L366 P367 F370 I376 G380 V382	L346-L378 HydrophobicContact CD1-CD1 3.88Å; L350-L378 HydrophobicContact CD1-CD1 4.29Å; L350-L378 HydrophobicContact CD2-CD1 3.88Å; L350-L378 HydrophobicContact CG-CD1 4.43Å; L366-L378 HydrophobicContact CB-CD2 4.43Å; L366-L378 HydrophobicContact CD2-CD2 3.89Å; L366-L378 HydrophobicContact CG-CD2 3.95Å; P367-L378 HydrophobicContact CB-CB 4.07Å; P367-L378 HydrophobicContact CB-CD2 4.18Å; P367-L378 HydrophobicContact CG-CD2 4.03Å; F370-L378 HydrophobicContact CB-CB 4.21Å; F370-L378 HydrophobicContact CB-CD1 4.25Å; F370-L378 HydrophobicContact CD1-CB 4.03Å; F370-L378 HydrophobicContact CD1-CD1 3.91Å; F370-L378 HydrophobicContact CD2-CD1 4Å; F370-L378 HydrophobicContact CE1-CD1 4.26Å; F370-L378 HydrophobicContact CE2-CD1 4.33Å; F370-L378 HydrophobicContact CG-CB 4.27Å; F370-L378 HydrophobicContact CG-CD1 3.78Å; F370-L378 HydrophobicContact CZ-CD1 4.47Å; I376-L378 PolarHBondContact O-N 2.84Å; L378-G380 PolarHBondContact O-N 3.4Å; L378-V382 HydrophobicContact CD1-CG2 4.47Å; L378-V382 HydrophobicContact CD2-CB 4.33Å; L378-V382 HydrophobicContact CD2-CG1 4.41Å; L378-V382 HydrophobicContact CG-CB 4.36Å; L378-V382 HydrophobicContact CG-CG2 4.49Å
379	P	87.6	Confident	83	Confident	43 Å²	43	63.8 Å²	63.8	28%	0.279	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-63.3	132.2	173.4	-21.2	33.6	0	0	0	111.4	L346 Y381 V382	L346-P379 HydrophobicContact CD2-CG 3.89Å; P379-Y381 VanDerWaalsContact C-N 3.26Å; P379-Y381 HydrophobicContact CB-CD1 3.58Å; P379-Y381 HydrophobicContact CB-CE1 3.24Å; P379-Y381 HydrophobicContact CB-CG 4.45Å; P379-Y381 HydrophobicContact CG-CE1 4.03Å; P379-Y381 PolarHBondContact O-N 3.01Å; P379-V382 HydrophobicContact CB-CG2 4.23Å; P379-V382 WeakPolarHBondContact O-CB 3.4Å; P379-V382 WeakPolarHBondContact O-CG2 3.32Å; P379-V382 PolarHBondContact O-N 3.31Å; P379-V382 VanDerWaalsContact O-N 3.16Å
380	G	73.9	Confident	82.7	Confident	49 Å²	49	64.8 Å²	64.8	51%	0.505	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.7	-174.1	0	0	0	0	0	114.2	L378 V382 L383 E384	L378-G380 PolarHBondContact O-N 3.4Å; G380-V382 PolarHBondContact O-N 3.46Å; G380-L383 PolarHBondContact O-N 3.13Å; G380-E384 PolarHBondContact O-N 3.48Å
381	Y	82	Confident	82.1	Confident	59 Å²	59	68 Å²	68	23%	0.231	35%	0.349	C	S	.	.	H	α-helix	trans	-58.8	-21.4	-179.7	71.4	-103.8	0	0	0	113.9	P339 L342 P379 E384 N385 L388	P339-Y381 HydrophobicContact CG-CD1 4.07Å; P339-Y381 HydrophobicContact CG-CD2 4.45Å; P339-Y381 HydrophobicContact CG-CE1 3.85Å; P339-Y381 HydrophobicContact CG-CE2 4.29Å; P339-Y381 HydrophobicContact CG-CG 4.38Å; L342-Y381 HydrophobicContact CD2-CE2 4.06Å; P379-Y381 VanDerWaalsContact C-N 3.26Å; P379-Y381 HydrophobicContact CB-CD1 3.58Å; P379-Y381 HydrophobicContact CB-CE1 3.24Å; P379-Y381 HydrophobicContact CB-CG 4.45Å; P379-Y381 HydrophobicContact CG-CE1 4.03Å; P379-Y381 PolarHBondContact O-N 3.01Å; Y381-E384 PolarHBondContact O-N 3.46Å; Y381-N385 PolarHBondContact O-N 3.06Å; Y381-N385 PolarHBondContact O-ND2 3.15Å; Y381-L388 HydrophobicContact CD2-CD1 4.13Å; Y381-L388 HydrophobicContact CE2-CD1 4.26Å
382	V	82.1	Confident	81.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-68.2	-37.3	178.3	-176.4	0	0	0	0	111.2	L342 L346 L350 L378 P379 G380 N385 L386 L389	L342-V382 HydrophobicContact CD2-CG1 4.27Å; L342-V382 HydrophobicContact CD2-CG2 3.66Å; L346-V382 HydrophobicContact CD2-CG2 4.19Å; L350-V382 HydrophobicContact CD1-CG1 4.36Å; L378-V382 HydrophobicContact CD1-CG2 4.47Å; L378-V382 HydrophobicContact CD2-CB 4.33Å; L378-V382 HydrophobicContact CD2-CG1 4.41Å; L378-V382 HydrophobicContact CG-CB 4.36Å; L378-V382 HydrophobicContact CG-CG2 4.49Å; P379-V382 HydrophobicContact CB-CG2 4.23Å; P379-V382 WeakPolarHBondContact O-CB 3.4Å; P379-V382 WeakPolarHBondContact O-CG2 3.32Å; P379-V382 PolarHBondContact O-N 3.31Å; P379-V382 VanDerWaalsContact O-N 3.16Å; G380-V382 PolarHBondContact O-N 3.46Å; V382-N385 CarbonylContact O-C 3.57Å; V382-L386 PolarHBondContact O-N 2.95Å; V382-L389 HydrophobicContact CG1-CD1 4.06Å; V382-L389 HydrophobicContact CG1-CD2 4.05Å; V382-L389 HydrophobicContact CG1-CG 4.26Å
383	L	81.4	Confident	81.5	Confident	23 Å²	23	60.8 Å²	60.8	12%	0.12	31%	0.313	C	S	.	.	H	α-helix	trans	-79.9	-23	174.7	-71.4	-164.7	0	0	0	113.3	A363 L366 P367 G380 N385 L386 Q404	A363-L383 HydrophobicContact CB-CD2 4.32Å; A363-L383 VanDerWaalsContact O-CD2 3.25Å; A363-L383 WeakPolarHBondContact O-CD2 3.29Å; L366-L383 HydrophobicContact CB-CD2 4.37Å; L366-L383 HydrophobicContact CD2-CD2 4.23Å; P367-L383 HydrophobicContact CG-CD1 3.25Å; P367-L383 HydrophobicContact CG-CD2 4.38Å; P367-L383 HydrophobicContact CG-CG 3.91Å; G380-L383 PolarHBondContact O-N 3.13Å; L383-N385 VanDerWaalsContact C-N 3.32Å; L383-L386 HydrophobicContact CD2-CD2 3.93Å; L383-Q404 PolarHBondContact O-NE2 3.24Å
384	E	76.8	Confident	81.2	Confident	146 Å²	146	61.7 Å²	61.7	68%	0.682	32%	0.319	S	S	*	.	H	α-helix	trans	-77.9	-22.4	175.9	-65.2	168.7	175.9	0	0	111.4	G380 Y381	G380-E384 PolarHBondContact O-N 3.48Å; Y381-E384 PolarHBondContact O-N 3.46Å
385	N	78.8	Confident	81.1	Confident	84 Å²	84	61.3 Å²	61.3	45%	0.449	32%	0.319	S	S	.	.			trans	-135.2	63.8	-177.3	-53.6	-90.6	0	0	0	110.3	Y381 V382 L383 E387 L388	Y381-N385 PolarHBondContact O-N 3.06Å; Y381-N385 PolarHBondContact O-ND2 3.15Å; V382-N385 CarbonylContact O-C 3.57Å; L383-N385 VanDerWaalsContact C-N 3.32Å; N385-E387 PolarHBondContact O-N 2.92Å; N385-E387 VanDerWaalsContact O-N 3.08Å; N385-L388 HydrophobicContact CB-CD1 3.81Å; N385-L388 HydrophobicContact CB-CG 3.96Å; N385-L388 VanDerWaalsContact O-CB 3.31Å; N385-L388 WeakPolarHBondContact O-CB 3.32Å; N385-L388 VanDerWaalsContact O-CG 3.31Å; N385-L388 WeakPolarHBondContact O-CG 3.41Å; N385-L388 PolarHBondContact O-N 2.56Å
386	L	82.3	Confident	80.3	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-58.1	-24.7	-177.6	-69.2	175.5	0	0	0	113.4	A363 V382 L383 L388 L389 I395 P403 A406 L408	A363-L386 HydrophobicContact CB-CD1 3.74Å; A363-L386 HydrophobicContact CB-CD2 3.99Å; V382-L386 PolarHBondContact O-N 2.95Å; L383-L386 HydrophobicContact CD2-CD2 3.93Å; L386-L388 PolarHBondContact O-N 2.81Å; L386-L388 VanDerWaalsContact O-N 3.1Å; L386-L389 HydrophobicContact CD2-CD1 4.04Å; L386-L389 WeakPolarHBondContact O-CB 3.34Å; L386-L389 PolarHBondContact O-N 3.49Å; L386-I395 HydrophobicContact CB-CD1 4.24Å; L386-I395 WeakPolarHBondContact O-CD1 3.38Å; L386-P403 VanDerWaalsContact CD1-O 3.31Å; L386-P403 WeakPolarHBondContact CD1-O 3.42Å; L386-A406 HydrophobicContact CD1-CB 3.61Å; L386-L408 HydrophobicContact CD2-CD2 4.38Å
387	E	77.6	Confident	79.8	Confident	149 Å²	149	57 Å²	57	70%	0.696	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-53.9	-26	173.2	-62.8	179.1	-176.5	0	0	113.4	N385 L389 S390	N385-E387 PolarHBondContact O-N 2.92Å; N385-E387 VanDerWaalsContact O-N 3.08Å; E387-L389 PolarHBondContact O-N 3.17Å; E387-L389 VanDerWaalsContact O-N 3.13Å; E387-S390 WeakPolarHBondContact O-CB 3.48Å; E387-S390 PolarHBondContact O-N 2.77Å; E387-S390 PolarHBondContact O-OG 3.47Å
388	L	81	Confident	78.1	Confident	50 Å²	50	53 Å²	53	26%	0.262	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-62.2	-15.8	172.4	-63.7	176.4	0	0	0	113.8	L342 Y381 N385 L386	L342-L388 HydrophobicContact CD1-CB 4.09Å; L342-L388 WeakPolarHBondContact CD1-O 3.47Å; L342-L388 HydrophobicContact CG-CB 4.08Å; Y381-L388 HydrophobicContact CD2-CD1 4.13Å; Y381-L388 HydrophobicContact CE2-CD1 4.26Å; N385-L388 HydrophobicContact CB-CD1 3.81Å; N385-L388 HydrophobicContact CB-CG 3.96Å; N385-L388 VanDerWaalsContact O-CB 3.31Å; N385-L388 WeakPolarHBondContact O-CB 3.32Å; N385-L388 VanDerWaalsContact O-CG 3.31Å; N385-L388 WeakPolarHBondContact O-CG 3.41Å; N385-L388 PolarHBondContact O-N 2.56Å; L386-L388 PolarHBondContact O-N 2.81Å; L386-L388 VanDerWaalsContact O-N 3.1Å
389	L	78.7	Confident	76.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-100.2	-2.4	177.5	-53.4	171.3	0	0	0	112.7	L342 L350 L366 V382 L386 E387 D391 I392 C393 L408	L342-L389 HydrophobicContact CD1-CD2 3.54Å; L342-L389 HydrophobicContact CD1-CG 4.5Å; L350-L389 HydrophobicContact CD1-CD2 3.71Å; L366-L389 HydrophobicContact CD2-CD1 4.09Å; V382-L389 HydrophobicContact CG1-CD1 4.06Å; V382-L389 HydrophobicContact CG1-CD2 4.05Å; V382-L389 HydrophobicContact CG1-CG 4.26Å; L386-L389 HydrophobicContact CD2-CD1 4.04Å; L386-L389 WeakPolarHBondContact O-CB 3.34Å; L386-L389 PolarHBondContact O-N 3.49Å; E387-L389 PolarHBondContact O-N 3.17Å; E387-L389 VanDerWaalsContact O-N 3.13Å; L389-D391 PolarHBondContact O-N 2.78Å; L389-I392 HydrophobicContact CB-CG1 4.36Å; L389-I392 HydrophobicContact CD2-CD1 4.12Å; L389-I392 WeakPolarHBondContact O-CG1 3.35Å; L389-I392 PolarHBondContact O-N 3.47Å; L389-C393 PolarHBondContact O-N 3.16Å; L389-C393 PolarHBondContact O-SG 3.28Å; L389-L408 HydrophobicContact CD1-CD1 4.01Å
390	S	79.1	Confident	74.4	Confident	62 Å²	62	59 Å²	59	43%	0.434	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.8	-174.8	63.7	0	0	0	0	114.3	E387 C393 R411	E387-S390 WeakPolarHBondContact O-CB 3.48Å; E387-S390 PolarHBondContact O-N 2.77Å; E387-S390 PolarHBondContact O-OG 3.47Å; S390-C393 WeakPolarHBondContact CA-O 3.43Å; S390-R411 VanDerWaalsContact O-CZ 3.23Å; S390-R411 PolarHBondContact O-NH1 2.84Å; S390-R411 PolarHBondContact O-NH2 2.77Å
391	D	75.9	Confident	73.3	Confident	73 Å²	73	63.2 Å²	63.2	39%	0.39	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-34	173.7	57.9	-0.1	0	0	0	113	K347 L389 R411	K347-D391 WeakPolarHBondContact CE-OD2 3.35Å; K347-D391 IonicContact NZ-OD2 3.67Å; K347-D391 PolarHBondContact NZ-OD2 2.72Å; L389-D391 PolarHBondContact O-N 2.78Å; D391-R411 VanDerWaalsContact C-NH1 3.3Å; D391-R411 PolarHBondContact O-NH1 3.43Å
392	I	78	Confident	72.3	Confident	10 Å²	10	63.2 Å²	63.2	5%	0.051	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-17.2	179.2	59.6	171.2	0	0	0	114.4	K347 L350 E351 L354 L389 R411	K347-I392 HydrophobicContact CD-CG2 4.39Å; K347-I392 VanDerWaalsContact CE-CG2 3.42Å; K347-I392 HydrophobicContact CG-CD1 4.34Å; K347-I392 HydrophobicContact CG-CG2 4.04Å; L350-I392 HydrophobicContact CB-CD1 3.92Å; E351-I392 HydrophobicContact CB-CD1 4.41Å; E351-I392 HydrophobicContact CG-CB 4.45Å; E351-I392 HydrophobicContact CG-CG2 4.49Å; L354-I392 HydrophobicContact CD1-CD1 4.15Å; L354-I392 HydrophobicContact CD1-CG1 4.44Å; L389-I392 HydrophobicContact CB-CG1 4.36Å; L389-I392 HydrophobicContact CD2-CD1 4.12Å; L389-I392 WeakPolarHBondContact O-CG1 3.35Å; L389-I392 PolarHBondContact O-N 3.47Å; I392-R411 PolarHBondContact O-N 3.45Å
393	C	78.8	Confident	71.1	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.007	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154	179.5	74.3	0	0	0	0	113.8	L354 L389 S390 L408 Y409	L354-C393 HydrophobicContact CD1-CB 3.94Å; L389-C393 PolarHBondContact O-N 3.16Å; L389-C393 PolarHBondContact O-SG 3.28Å; S390-C393 WeakPolarHBondContact CA-O 3.43Å; C393-L408 HydrophobicContact CB-CB 4.44Å; C393-Y409 CarbonylContact C-O 3.57Å; C393-Y409 WeakPolarHBondContact CA-O 3.2Å; C393-Y409 WeakPolarHBondContact CB-O 3.45Å
394	T	81.6	Confident	69.9	Low	76 Å²	76	68.9 Å²	68.9	47%	0.466	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	126.1	166.2	-60.4	0	0	0	0	108.4	Y409	T394-Y409 PolarHBondContact N-O 3.37Å; T394-Y409 PolarHBondContact O-N 3.5Å
395	I	84.8	Confident	69.5	Low	33 Å²	33	67 Å²	67	17%	0.169	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	112.9	-175.2	-51	164.5	0	0	0	108.1	L386 Y397 A406 L408	L386-I395 HydrophobicContact CB-CD1 4.24Å; L386-I395 WeakPolarHBondContact O-CD1 3.38Å; I395-Y397 HydrophobicContact CB-CE2 4.35Å; I395-Y397 HydrophobicContact CG2-CD2 4.25Å; I395-Y397 HydrophobicContact CG2-CE1 4.21Å; I395-Y397 HydrophobicContact CG2-CE2 3.6Å; I395-A406 HydrophobicContact CG2-CB 3.78Å; I395-L408 HydrophobicContact CB-CD2 4.42Å; I395-L408 HydrophobicContact CG1-CD2 3.96Å; I395-L408 HydrophobicContact CG2-CD2 4.04Å
396	N	71.9	Confident	69.4	Low	75 Å²	75	63 Å²	63	40%	0.401	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.4	174.4	-171.5	-5.6	0	0	0	109.6	P398 A406 I407 Y409	N396-P398 VanDerWaalsContact C-CD 3.46Å; N396-P398 WeakPolarHBondContact O-CD 3.2Å; N396-A406 CarbonylContact O-C 3.56Å; N396-A406 WeakPolarHBondContact O-CA 3.46Å; N396-I407 PolarHBondContact N-O 3.41Å; N396-I407 PolarHBondContact O-N 2.97Å; N396-Y409 HydrophobicContact CB-CD2 4.27Å; N396-Y409 HydrophobicContact CB-CE2 3.76Å
397	Y	74.1	Confident	69.3	Low	91 Å²	91	63.7 Å²	63.7	36%	0.357	34%	0.342	S	S	.	.			trans	-110	82.5	175.4	-65.4	-82.6	0	0	0	110.1	I395 M399 P403 A406	I395-Y397 HydrophobicContact CB-CE2 4.35Å; I395-Y397 HydrophobicContact CG2-CD2 4.25Å; I395-Y397 HydrophobicContact CG2-CE1 4.21Å; I395-Y397 HydrophobicContact CG2-CE2 3.6Å; Y397-M399 PolarHBondContact O-N 3.47Å; Y397-M399 VanDerWaalsContact O-N 3.07Å; Y397-P403 HydrophobicContact CE1-CB 4.04Å; Y397-A406 HydrophobicContact CD1-CB 3.78Å; Y397-A406 HydrophobicContact CE1-CB 3.67Å
398	P	47.8	Very low	69.5	Low	66 Å²	66	56.6 Å²	56.6	43%	0.429	31%	0.309	S	S	.	.	S	Bend	trans	-64.8	-10.6	178.5	24.3	-32.8	0	0	0	114	W362 N396 I407	W362-P398 HydrophobicContact CH2-CG 4.2Å; W362-P398 HydrophobicContact CZ3-CG 4.12Å; N396-P398 VanDerWaalsContact C-CD 3.46Å; N396-P398 WeakPolarHBondContact O-CD 3.2Å; P398-I407 HydrophobicContact CG-CD1 4.11Å; P398-I407 HydrophobicContact CG-CG1 4.22Å
399	M	51.6	Low	69.4	Low	62 Å²	62	57.9 Å²	57.9	31%	0.305	31%	0.311	S	S	.	.	S	Bend	trans	-135.1	109.5	170.6	-81.3	160.2	-77.9	0	0	107.3	Y397 D401 N402 R405	Y397-M399 PolarHBondContact O-N 3.47Å; Y397-M399 VanDerWaalsContact O-N 3.07Å; M399-D401 WeakPolarHBondContact CB-OD1 3.44Å; M399-D401 PolarHBondContact O-N 2.79Å; M399-N402 PolarHBondContact O-N 2.93Å; M399-R405 HydrophobicContact CE-CB 3.98Å; M399-R405 HydrophobicContact CE-CG 4.47Å
400	S	44.4	Very low	69.3	Low	125 Å²	125	60 Å²	60	87%	0.874	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.6	-175.8	48.9	0	0	0	0	114.1
401	D	50.1	Low	68.9	Low	137 Å²	137	62.6 Å²	62.6	73%	0.733	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-3.7	179.4	66.1	-29.8	0	0	0	114	M399	M399-D401 WeakPolarHBondContact CB-OD1 3.44Å; M399-D401 PolarHBondContact O-N 2.79Å
402	N	60.6	Low	67.6	Low	59 Å²	59	62.3 Å²	62.3	32%	0.316	32%	0.323	S	S	.	.			trans	-141.4	92.8	-178.5	-167.8	-19.4	0	0	0	114	M399 Q404 R405	M399-N402 PolarHBondContact O-N 2.93Å; N402-Q404 PolarHBondContact O-N 3.27Å; N402-Q404 VanDerWaalsContact O-N 3.15Å; N402-Q404 WeakPolarHBondContact OD1-CB 3.4Å; N402-Q404 PolarHBondContact OD1-N 2.88Å; N402-R405 PolarHBondContact O-N 2.82Å
403	P	57.3	Low	65.9	Low	73 Å²	73	66.6 Å²	66.6	47%	0.474	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-64.9	-20.8	-177.9	24.7	-33.6	0	0	0	114.2	L386 Y397 R405 A406	L386-P403 VanDerWaalsContact CD1-O 3.31Å; L386-P403 WeakPolarHBondContact CD1-O 3.42Å; Y397-P403 HydrophobicContact CE1-CB 4.04Å; P403-R405 PolarHBondContact O-N 2.7Å; P403-A406 PolarHBondContact O-N 2.83Å
404	Q	56	Low	63.8	Low	68 Å²	68	72 Å²	72	32%	0.318	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-71.7	-11	174.7	-62	-60.8	-39.1	0	0	113.1	H364 L383 N402	H364-Q404 WeakPolarHBondContact CB-O 3.28Å; H364-Q404 PolarHBondContact N-O 2.86Å; L383-Q404 PolarHBondContact O-NE2 3.24Å; N402-Q404 PolarHBondContact O-N 3.27Å; N402-Q404 VanDerWaalsContact O-N 3.15Å; N402-Q404 WeakPolarHBondContact OD1-CB 3.4Å; N402-Q404 PolarHBondContact OD1-N 2.88Å
405	R	68.8	Low	61.6	Low	108 Å²	108	71.6 Å²	71.6	41%	0.408	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-105.7	27	174.4	-71.5	-173	158.6	-160.7	-6.3	113.1	W362 M399 N402 P403	W362-R405 HydrophobicContact CZ3-CB 4.31Å; W362-R405 VanDerWaalsContact CZ3-O 3.27Å; W362-R405 WeakPolarHBondContact CZ3-O 3.21Å; M399-R405 HydrophobicContact CE-CB 3.98Å; M399-R405 HydrophobicContact CE-CG 4.47Å; N402-R405 PolarHBondContact O-N 2.82Å; P403-R405 PolarHBondContact O-N 2.7Å
406	A	77.3	Confident	58.8	Low	0 Å²	0	73.5 Å²	73.5	0%	0	43%	0.426	C	S	.	.			trans	-67.4	154.2	165	0	0	0	0	0	112.1	A363 L386 I395 N396 Y397 P403	A363-A406 HydrophobicContact CB-CB 4.17Å; A363-A406 PolarHBondContact N-O 3.08Å; L386-A406 HydrophobicContact CD1-CB 3.61Å; I395-A406 HydrophobicContact CG2-CB 3.78Å; N396-A406 CarbonylContact O-C 3.56Å; N396-A406 WeakPolarHBondContact O-CA 3.46Å; Y397-A406 HydrophobicContact CD1-CB 3.78Å; Y397-A406 HydrophobicContact CE1-CB 3.67Å; P403-A406 PolarHBondContact O-N 2.83Å
407	I	80.4	Confident	56.8	Low	19 Å²	19	78.4 Å²	78.4	10%	0.097	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.3	169.5	-50.4	174.2	0	0	0	108.4	W362 N396 P398 Y409	W362-I407 HydrophobicContact CD2-CD1 4.4Å; W362-I407 HydrophobicContact CD2-CG1 3.82Å; W362-I407 HydrophobicContact CE3-CD1 4.39Å; W362-I407 HydrophobicContact CE3-CG1 3.64Å; W362-I407 HydrophobicContact CH2-CD1 3.73Å; W362-I407 HydrophobicContact CH2-CG1 3.88Å; W362-I407 HydrophobicContact CZ2-CD1 3.7Å; W362-I407 HydrophobicContact CZ2-CG1 4.02Å; W362-I407 HydrophobicContact CZ3-CD1 4.07Å; W362-I407 HydrophobicContact CZ3-CG1 3.68Å; N396-I407 PolarHBondContact N-O 3.41Å; N396-I407 PolarHBondContact O-N 2.97Å; P398-I407 HydrophobicContact CG-CD1 4.11Å; P398-I407 HydrophobicContact CG-CG1 4.22Å; I407-Y409 HydrophobicContact CB-CD2 4.47Å; I407-Y409 HydrophobicContact CB-CE2 3.75Å; I407-Y409 HydrophobicContact CG2-CD2 4.12Å; I407-Y409 HydrophobicContact CG2-CE1 4.27Å; I407-Y409 HydrophobicContact CG2-CE2 3.49Å; I407-Y409 VanDerWaalsContact CG2-CE2 3.49Å
408	L	81.9	Confident	54.8	Low	0 Å²	0	82.1 Å²	82.1	0%	0	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	106	-177.6	-50.9	176.4	0	0	0	108.9	L354 L361 A363 L366 L386 L389 C393 I395	L354-L408 HydrophobicContact CD2-CB 3.8Å; L361-L408 PolarHBondContact N-O 2.74Å; L361-L408 WeakPolarHBondContact O-CB 3.4Å; L361-L408 PolarHBondContact O-N 2.9Å; A363-L408 HydrophobicContact CB-CD1 4.38Å; A363-L408 HydrophobicContact CB-CG 4.41Å; L366-L408 HydrophobicContact CD1-CD1 4.45Å; L366-L408 HydrophobicContact CD2-CD1 3.85Å; L386-L408 HydrophobicContact CD2-CD2 4.38Å; L389-L408 HydrophobicContact CD1-CD1 4.01Å; C393-L408 HydrophobicContact CB-CB 4.44Å; I395-L408 HydrophobicContact CB-CD2 4.42Å; I395-L408 HydrophobicContact CG1-CD2 3.96Å; I395-L408 HydrophobicContact CG2-CD2 4.04Å
409	Y	78	Confident	53.9	Low	78 Å²	78	86 Å²	86	31%	0.306	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.7	175.5	-64.3	-90.5	0	0	0	109.2	S359 C393 T394 N396 I407 R411	S359-Y409 VanDerWaalsContact O-CE1 3.26Å; S359-Y409 WeakPolarHBondContact O-CE1 3.46Å; C393-Y409 CarbonylContact C-O 3.57Å; C393-Y409 WeakPolarHBondContact CA-O 3.2Å; C393-Y409 WeakPolarHBondContact CB-O 3.45Å; T394-Y409 PolarHBondContact N-O 3.37Å; T394-Y409 PolarHBondContact O-N 3.5Å; N396-Y409 HydrophobicContact CB-CD2 4.27Å; N396-Y409 HydrophobicContact CB-CE2 3.76Å; I407-Y409 HydrophobicContact CB-CD2 4.47Å; I407-Y409 HydrophobicContact CB-CE2 3.75Å; I407-Y409 HydrophobicContact CG2-CD2 4.12Å; I407-Y409 HydrophobicContact CG2-CE1 4.27Å; I407-Y409 HydrophobicContact CG2-CE2 3.49Å; I407-Y409 VanDerWaalsContact CG2-CE2 3.49Å; Y409-R411 PolarHBondContact O-N 3.26Å
410	R	77.3	Confident	52.7	Low	43 Å²	43	89.8 Å²	89.8	16%	0.162	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	128.8	175.1	-177.9	166.9	-177.6	-98	-6.3	109.4	E351 L354 M355 S412	E351-R410 IonicContact OE1-CZ 2.82Å; E351-R410 IonicContact OE1-NE 2.79Å; E351-R410 IonicContact OE1-NH2 3.22Å; E351-R410 PolarHBondContact OE1-NH2 3.24Å; L354-R410 HydrophobicContact CB-CB 4.07Å; L354-R410 HydrophobicContact CB-CG 4.46Å; M355-R410 PolarHBondContact SD-NH1 3.46Å; R410-S412 PolarHBondContact O-N 2.99Å
411	R	69.6	Low	51.9	Low	117 Å²	117	87.7 Å²	87.7	44%	0.442	49%	0.491	S	S	.	.			trans	-70.8	111.8	166.9	-171.8	170.8	-67.8	137.2	3.1	107.3	S390 D391 I392 Y409 S413	S390-R411 VanDerWaalsContact O-CZ 3.23Å; S390-R411 PolarHBondContact O-NH1 2.84Å; S390-R411 PolarHBondContact O-NH2 2.77Å; D391-R411 VanDerWaalsContact C-NH1 3.3Å; D391-R411 PolarHBondContact O-NH1 3.43Å; I392-R411 PolarHBondContact O-N 3.45Å; Y409-R411 PolarHBondContact O-N 3.26Å; R411-S413 PolarHBondContact O-N 3.17Å
412	S	48.7	Very low	50.8	Low	67 Å²	67	88.3 Å²	88.3	47%	0.469	49%	0.494	S	S	.	.			trans	-65.5	126.8	177.6	179.4	0	0	0	0	109.5	R410 V414	R410-S412 PolarHBondContact O-N 2.99Å; S412-V414 WeakPolarHBondContact CB-O 3.46Å; S412-V414 PolarHBondContact O-N 3.28Å; S412-V414 WeakPolarHBondContact OG-CB 3.48Å; S412-V414 PolarHBondContact OG-N 3.36Å; S412-V414 VanDerWaalsContact OG-N 3.07Å; S412-V414 PolarHBondContact OG-O 3.4Å
413	S	43.4	Very low	49.2	Very low	101 Å²	101	95 Å²	95	71%	0.706	52%	0.515	S	S	*	.	S	Bend	trans	-76.3	1.7	167.6	49.7	0	0	0	0	113.1	R411	R411-S413 PolarHBondContact O-N 3.17Å
414	V	33.3	Very low	47.7	Very low	113 Å²	113	102.9 Å²	102.9	69%	0.685	54%	0.535	S	S	*	.	S	Bend	trans	-95.3	115.7	161	-174.9	0	0	0	0	106.9	S412 G416	S412-V414 WeakPolarHBondContact CB-O 3.46Å; S412-V414 PolarHBondContact O-N 3.28Å; S412-V414 WeakPolarHBondContact OG-CB 3.48Å; S412-V414 PolarHBondContact OG-N 3.36Å; S412-V414 VanDerWaalsContact OG-N 3.07Å; S412-V414 PolarHBondContact OG-O 3.4Å; V414-G416 PolarHBondContact O-N 3.4Å
415	G	36.4	Very low	46.3	Very low	68 Å²	68	104.8 Å²	104.8	70%	0.701	56%	0.556	S	S	*	*			trans	-59	127.8	-167.4	0	0	0	0	0	114.1
416	G	26.2	Very low	44.3	Very low	74 Å²	74	105.5 Å²	105.5	76%	0.763	58%	0.578	S	S	*	*			trans	-79.5	126.3	147.7	0	0	0	0	0	107.6	V414 D418	V414-G416 PolarHBondContact O-N 3.4Å; G416-D418 PolarHBondContact O-N 3.36Å
417	E	29.5	Very low	42.4	Very low	177 Å²	177	111.5 Å²	111.5	83%	0.827	62%	0.62	S	S	*	*			trans	-72.5	91	-173.2	-67.4	166.8	152.7	0	0	111.7	E419	E417-E419 HydrophobicContact CB-CG 4.28Å; E417-E419 PolarHBondContact O-N 2.62Å
418	D	32.9	Very low	39.9	Very low	169 Å²	169	115 Å²	115	90%	0.904	65%	0.651	S	S	*	*			trans	-72.6	59.1	153.4	-84.6	-36.9	0	0	0	109.6	G416 N420	G416-D418 PolarHBondContact O-N 3.36Å; D418-N420 PolarHBondContact O-N 3.02Å
419	E	28.8	Very low	37.8	Very low	147 Å²	147	119.2 Å²	119.2	69%	0.687	68%	0.681	S	S	*	*			trans	-80.3	85.6	174.6	-83.6	-139.6	138.6	0	0	111.4	E417 C421	E417-E419 HydrophobicContact CB-CG 4.28Å; E417-E419 PolarHBondContact O-N 2.62Å; E419-C421 PolarHBondContact O-N 3.4Å
420	N	26.4	Very low	35.9	Very low	142 Å²	142	124.3 Å²	124.3	76%	0.759	71%	0.707	S	S	*	*			trans	-78.3	98.1	155.1	-168.4	15.8	0	0	0	110	D418	D418-N420 PolarHBondContact O-N 3.02Å
421	C	27.9	Very low	33.7	Very low	81 Å²	81	129.9 Å²	129.9	55%	0.547	74%	0.735	S	S	.	*	S	Bend	trans	74	105.3	165.1	-64.5	0	0	0	0	119.8	E419	E419-C421 PolarHBondContact O-N 3.4Å
422	N	26.8	Very low	32	Very low	150 Å²	150	129 Å²	129	80%	0.802	74%	0.736	S	S	*	*			trans	12.1	106.9	145.3	-76.8	-25.4	0	0	0	118.3
423	R	25.3	Very low	31.3	Very low	199 Å²	199	131.8 Å²	131.8	75%	0.751	75%	0.745	S	S	*	*			trans	-146.5	116.7	145.6	-137.7	178.6	-161.3	-128.2	8	112.4	S425 E532	R423-S425 PolarHBondContact O-N 3.44Å; R423-E532 IonicContact CZ-OE1 3.66Å; R423-E532 IonicContact NE-OE1 3.35Å; R423-E532 PolarHBondContact NE-OE1 3.31Å; R423-E532 IonicContact NH2-OE1 2.83Å; R423-E532 PolarHBondContact NH2-OE1 2.99Å
424	R	27.1	Very low	30.9	Very low	240 Å²	240	130.4 Å²	130.4	91%	0.906	74%	0.735	S	S	*	*			trans	-76.5	123.1	174.3	-101	-175.5	176.5	-178.2	-0.9	111.3
425	S	26.2	Very low	30.8	Very low	107 Å²	107	129 Å²	129	75%	0.748	73%	0.727	S	S	*	*			trans	53.1	93.2	145	63.3	0	0	0	0	119.7	R423	R423-S425 PolarHBondContact O-N 3.44Å
426	S	26.9	Very low	30.8	Very low	124 Å²	124	133.1 Å²	133.1	87%	0.867	72%	0.721	S	S	*	*				-162.6	150.7	123.7	54.9	0	0	0	0	110.7
427	S	37.9	Very low	31.2	Very low	126 Å²	126	134.6 Å²	134.6	88%	0.881	72%	0.716	S	S	*	*			trans	-84.7	130.4	-168.8	51.8	0	0	0	0	114
428	A	27.6	Very low	31.3	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	71%	0.712	S	S	*	*			trans	-144.8	153.4	163.4	0	0	0	0	0	110.1
429	S	38	Very low	31.3	Very low	90 Å²	90	132.8 Å²	132.8	63%	0.629	70%	0.703	S	S	*	*			trans	-90.8	163.3	-163.2	42.7	0	0	0	0	115.6	E431 E432	S429-E431 PolarHBondContact O-N 2.85Å; S429-E432 PolarHBondContact O-N 2.85Å
430	E	37.6	Very low	31.5	Very low	184 Å²	184	128.9 Å²	128.9	86%	0.86	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-12.5	-167.2	-62	177.5	135.5	0	0	116.2	E432 L433	E430-E432 PolarHBondContact O-N 3.31Å; E430-L433 PolarHBondContact O-N 3.47Å
431	E	31.8	Very low	31.8	Very low	161 Å²	161	133.1 Å²	133.1	75%	0.752	71%	0.708	S	S	*	*	H	α-helix	trans	-69	-16.2	178.1	-67.6	-177.3	141	0	0	113.8	S429 S434	S429-E431 PolarHBondContact O-N 2.85Å; E431-S434 PolarHBondContact O-OG 3.29Å
432	E	32.3	Very low	32.3	Very low	98 Å²	98	133.3 Å²	133.3	46%	0.458	71%	0.711	S	S	.	*	H	α-helix	trans	-79.9	-15.6	176.7	-134.2	-162.7	131.2	0	0	113.5	S429 E430 R436	S429-E432 PolarHBondContact O-N 2.85Å; E430-E432 PolarHBondContact O-N 3.31Å; E432-R436 WeakPolarHBondContact O-CG 3.47Å; E432-R436 PolarHBondContact O-N 3.2Å; E432-R436 IonicContact OE1-CZ 3.2Å; E432-R436 IonicContact OE1-NE 2.7Å; E432-R436 PolarHBondContact OE1-NE 3.03Å; E432-R436 IonicContact OE1-NH2 3.29Å; E432-R436 PolarHBondContact OE1-NH2 2.67Å; E432-R436 IonicContact OE2-NH2 3.49Å
433	L	35.5	Very low	32.9	Very low	125 Å²	125	133.2 Å²	133.2	65%	0.654	71%	0.709	S	S	*	*	H	α-helix	trans	-84.4	-32.4	-172.4	-143.8	79.8	0	0	0	113.3	E430 T437	E430-L433 PolarHBondContact O-N 3.47Å; L433-T437 PolarHBondContact O-N 2.81Å; L433-T437 PolarHBondContact O-OG1 3.17Å
434	S	33.7	Very low	33.7	Very low	72 Å²	72	127.7 Å²	127.7	50%	0.503	70%	0.701	S	S	.	*	H	α-helix	trans	-64.5	-47.2	172.5	50.9	0	0	0	0	110.8	E431 R436 T437 E438	E431-S434 PolarHBondContact O-OG 3.29Å; S434-R436 VanDerWaalsContact C-N 3.34Å; S434-R436 PolarHBondContact O-N 3.08Å; S434-T437 PolarHBondContact O-N 2.81Å; S434-E438 PolarHBondContact O-N 3.34Å
435	V	32.3	Very low	34.7	Very low	84 Å²	84	123.7 Å²	123.7	51%	0.509	70%	0.698	S	S	.	*	H	α-helix	trans	-58.4	-43.8	178.9	-177.3	0	0	0	0	111.4	T437 E438 M439	V435-T437 VanDerWaalsContact C-N 3.32Å; V435-T437 PolarHBondContact O-N 3.04Å; V435-E438 PolarHBondContact O-N 2.89Å; V435-M439 WeakPolarHBondContact O-CB 3.37Å; V435-M439 PolarHBondContact O-N 3.27Å
436	R	35.4	Very low	36.5	Very low	155 Å²	155	122.6 Å²	122.6	59%	0.585	68%	0.681	S	S	*	*	H	α-helix	trans	-66.6	-30.6	179.8	-71.9	175.4	-176.3	-162.7	5.2	113.7	E432 S434 G440	E432-R436 WeakPolarHBondContact O-CG 3.47Å; E432-R436 PolarHBondContact O-N 3.2Å; E432-R436 IonicContact OE1-CZ 3.2Å; E432-R436 IonicContact OE1-NE 2.7Å; E432-R436 PolarHBondContact OE1-NE 3.03Å; E432-R436 IonicContact OE1-NH2 3.29Å; E432-R436 PolarHBondContact OE1-NH2 2.67Å; E432-R436 IonicContact OE2-NH2 3.49Å; S434-R436 VanDerWaalsContact C-N 3.34Å; S434-R436 PolarHBondContact O-N 3.08Å; R436-G440 PolarHBondContact O-N 3.47Å
437	T	34.7	Very low	38.9	Very low	105 Å²	105	125.6 Å²	125.6	64%	0.644	68%	0.681	S	S	*	*	H	α-helix	trans	-76.7	-31.1	-179.3	-51	0	0	0	0	112	L433 S434 V435	L433-T437 PolarHBondContact O-N 2.81Å; L433-T437 PolarHBondContact O-OG1 3.17Å; S434-T437 PolarHBondContact O-N 2.81Å; V435-T437 VanDerWaalsContact C-N 3.32Å; V435-T437 PolarHBondContact O-N 3.04Å
438	E	32.7	Very low	41.3	Very low	161 Å²	161	121 Å²	121	75%	0.752	65%	0.647	S	S	*	*	H	α-helix	trans	-83.2	-31.4	174.2	-66.5	-170.2	138.1	0	0	112.9	S434 V435 G440	S434-E438 PolarHBondContact O-N 3.34Å; V435-E438 PolarHBondContact O-N 2.89Å; E438-G440 VanDerWaalsContact C-N 3.35Å; E438-G440 PolarHBondContact O-N 3.36Å
439	M	32.1	Very low	44.3	Very low	146 Å²	146	119.7 Å²	119.7	72%	0.719	63%	0.632	S	S	*	*	H	α-helix	trans	-72.1	-22.8	180	-125.6	69.6	-174.7	0	0	114.5	V435 R441	V435-M439 WeakPolarHBondContact O-CB 3.37Å; V435-M439 PolarHBondContact O-N 3.27Å; M439-R441 VanDerWaalsContact C-N 3.26Å; M439-R441 PolarHBondContact O-N 3.09Å
440	G	33.6	Very low	46.8	Very low	66 Å²	66	120.5 Å²	120.5	68%	0.68	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-4.7	-178.7	0	0	0	0	0	115.7	R436 E438	R436-G440 PolarHBondContact O-N 3.47Å; E438-G440 VanDerWaalsContact C-N 3.35Å; E438-G440 PolarHBondContact O-N 3.36Å
441	R	32.6	Very low	49.5	Very low	230 Å²	230	113.4 Å²	113.4	87%	0.868	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	9.7	179.3	-74.1	-170.5	173.5	-158.6	-1.5	114.4	M439	M439-R441 VanDerWaalsContact C-N 3.26Å; M439-R441 PolarHBondContact O-N 3.09Å
442	S	37.8	Very low	52.4	Low	86 Å²	86	111.7 Å²	111.7	60%	0.601	59%	0.592	S	S	*	*	S	Bend	trans	-125.8	133.5	175.3	-165.3	0	0	0	0	109.7
443	L	39.8	Very low	55.2	Low	148 Å²	148	109 Å²	109	78%	0.775	58%	0.581	S	S	*	*	S	Bend	trans	87.6	116.9	-175.7	-48.4	170.6	0	0	0	114.6
444	S	42.6	Very low	57.8	Low	83 Å²	83	103.3 Å²	103.3	58%	0.58	55%	0.552	S	S	*	*			trans	67.9	92.1	-174.4	71.1	0	0	0	0	118.8	H446	S444-H446 PolarHBondContact O-N 3.33Å
445	N	46.7	Very low	60.2	Low	156 Å²	156	109.6 Å²	109.6	83%	0.834	57%	0.57	S	S	*	*			trans	-79.1	48.6	174.2	-69.3	-26.8	0	0	0	113.1
446	H	64.3	Low	62.6	Low	83 Å²	83	111.3 Å²	111.3	38%	0.384	57%	0.572	S	S	.	*			trans	-122.8	106.6	-173.4	-64.7	-15.8	0	0	0	112.2	S444 E561 F564	S444-H446 PolarHBondContact O-N 3.33Å; H446-E561 WeakPolarHBondContact NE2-CB 3.3Å; H446-F564 HydrophobicContact CB-CB 4.41Å; H446-F564 HydrophobicContact CB-CD1 3.63Å; H446-F564 HydrophobicContact CB-CD2 4.27Å; H446-F564 HydrophobicContact CB-CE1 3.88Å; H446-F564 HydrophobicContact CB-CE2 4.44Å; H446-F564 HydrophobicContact CB-CG 3.86Å; H446-F564 HydrophobicContact CB-CZ 4.28Å
447	E	78.2	Confident	64.3	Low	187 Å²	187	110 Å²	110	87%	0.874	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-85.6	125.8	178.9	-169.7	171.7	-164.7	0	0	110.4
448	V	87.9	Confident	66.6	Low	29 Å²	29	108.2 Å²	108.2	18%	0.176	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-88.4	130	179.3	179.8	0	0	0	0	109.6	F564 F568	V448-F564 HydrophobicContact CG2-CB 4.34Å; V448-F564 HydrophobicContact CG2-CD1 3.56Å; V448-F564 HydrophobicContact CG2-CE1 4.36Å; V448-F564 HydrophobicContact CG2-CG 4.37Å; V448-F568 HydrophobicContact CB-CE2 4.3Å; V448-F568 HydrophobicContact CB-CZ 4.15Å; V448-F568 HydrophobicContact CG1-CD1 4.05Å; V448-F568 HydrophobicContact CG1-CD2 4.24Å; V448-F568 HydrophobicContact CG1-CE1 3.91Å; V448-F568 HydrophobicContact CG1-CE2 4.11Å; V448-F568 HydrophobicContact CG1-CG 4.22Å; V448-F568 HydrophobicContact CG1-CZ 3.96Å; V448-F568 HydrophobicContact CG2-CE1 4.06Å; V448-F568 HydrophobicContact CG2-CE2 4.23Å; V448-F568 HydrophobicContact CG2-CZ 3.65Å
449	P	91.2	Very high	69.4	Low	65 Å²	65	100.6 Å²	100.6	42%	0.422	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-61.9	145.4	177.4	-23.7	35	0	0	0	112.9	F564 P567	P449-F564 WeakPolarHBondContact CD-O 3.49Å; P449-P567 HydrophobicContact CB-CG 4.23Å; P449-P567 WeakPolarHBondContact O-CA 3.34Å; P449-P567 WeakPolarHBondContact O-CB 3.17Å
450	T	90.6	Very high	72	Confident	107 Å²	107	94.6 Å²	94.6	66%	0.656	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-74.4	136.4	178.5	52	0	0	0	0	111.9	Q452	T450-Q452 PolarHBondContact O-N 2.84Å; T450-Q452 PolarHBondContact O-NE2 3.43Å; T450-Q452 PolarHBondContact OG1-NE2 3Å
451	L	93.4	Very high	74.7	Confident	35 Å²	35	91.5 Å²	91.5	18%	0.183	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-64	117.3	178.5	-172.6	70.9	0	0	0	110.1	Y476 Y481 P567 T571	L451-Y476 HydrophobicContact CD2-CD2 3.98Å; L451-Y476 HydrophobicContact CD2-CE2 4.05Å; L451-Y481 HydrophobicContact CD1-CD1 3.94Å; L451-Y481 HydrophobicContact CD1-CE1 3.96Å; L451-Y481 HydrophobicContact CG-CE1 4.47Å; L451-P567 HydrophobicContact CB-CB 4.05Å; L451-P567 HydrophobicContact CD1-CB 3.85Å; L451-T571 HydrophobicContact CD2-CG2 3.81Å
452	Q	92.8	Very high	77.2	Confident	124 Å²	124	80.7 Å²	80.7	58%	0.579	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-77.3	129.8	178.9	-60.1	-56.7	-61.5	0	0	110.1	T450 Y481	T450-Q452 PolarHBondContact O-N 2.84Å; T450-Q452 PolarHBondContact O-NE2 3.43Å; T450-Q452 PolarHBondContact OG1-NE2 3Å; Q452-Y481 VanDerWaalsContact O-CE1 3.26Å; Q452-Y481 WeakPolarHBondContact O-CE1 3.42Å; Q452-Y481 PolarHBondContact O-OH 2.58Å
453	I	92.3	Very high	79.6	Confident	42 Å²	42	76.6 Å²	76.6	22%	0.215	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-67.4	130.4	174.1	-58.5	175.2	0	0	0	108.4	K455 I604 R607 G608 P611	I453-K455 PolarHBondContact O-N 2.84Å; I453-I604 HydrophobicContact CG2-CD1 3.48Å; I453-I604 VanDerWaalsContact CG2-CD1 3.48Å; I453-R607 HydrophobicContact CD1-CB 4.44Å; I453-G608 WeakPolarHBondContact CD1-O 3.39Å; I453-P611 HydrophobicContact CD1-CB 4.16Å; I453-P611 HydrophobicContact CD1-CG 4.14Å
454	P	90	Very high	81.6	Confident	6 Å²	6	70 Å²	70	4%	0.039	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-54.7	136	-178.6	-22	28	0	0	0	111.6	E456 P459 Y476 Y481 R607	P454-E456 PolarHBondContact O-N 2.82Å; P454-P459 HydrophobicContact CB-CB 3.76Å; P454-P459 HydrophobicContact CB-CG 4.06Å; P454-P459 HydrophobicContact CG-CB 3.74Å; P454-P459 HydrophobicContact CG-CG 4.05Å; P454-Y476 VanDerWaalsContact CD-CE1 3.43Å; P454-Y476 VanDerWaalsContact CD-CZ 3.47Å; P454-Y476 HydrophobicContact CG-CD1 3.37Å; P454-Y476 HydrophobicContact CG-CD2 4.06Å; P454-Y476 HydrophobicContact CG-CE1 3.77Å; P454-Y476 HydrophobicContact CG-CE2 4.4Å; P454-Y476 HydrophobicContact CG-CG 3.55Å; P454-Y481 VanDerWaalsContact CA-OH 3.32Å; P454-Y481 WeakPolarHBondContact CA-OH 3.21Å; P454-Y481 HydrophobicContact CB-CE2 4.17Å; P454-Y481 WeakPolarHBondContact CD-OH 3.27Å; P454-Y481 HydrophobicContact CG-CE1 4.47Å; P454-Y481 HydrophobicContact CG-CE2 3.74Å; P454-R607 PolarHBondContact O-NH1 3.3Å; P454-R607 PolarHBondContact O-NH2 2.96Å
455	K	84.3	Confident	83.3	Confident	203 Å²	203	69.7 Å²	69.7	88%	0.883	35%	0.345	S	S	*	.	S	Bend	trans	-68.1	-22.3	-179.5	-67.9	-177.4	-179.1	177.2	0	113.3	I453 R607	I453-K455 PolarHBondContact O-N 2.84Å; K455-R607 PolarHBondContact O-NH2 3.06Å
456	E	81.1	Confident	85.1	Confident	121 Å²	121	63.5 Å²	63.5	57%	0.565	32%	0.315	S	S	*	.	S	Bend	trans	-49.8	145	170.8	-67.3	161.7	-158.3	0	0	111.1	P454 P459 R607	P454-E456 PolarHBondContact O-N 2.82Å; E456-P459 HydrophobicContact CB-CB 4.4Å; E456-P459 WeakPolarHBondContact O-CD 3.47Å; E456-R607 PolarHBondContact O-NH2 2.76Å
457	E	71.8	Confident	85.9	Confident	127 Å²	127	64.5 Å²	64.5	59%	0.593	33%	0.328	S	S	*	.	S	Bend	trans	-73.6	-34.1	175.2	-171.7	174.9	-153.9	0	0	111.5	P459 I604	E457-P459 VanDerWaalsContact C-CD 3.47Å; E457-I604 PolarHBondContact O-N 3.44Å
458	Y	83.6	Confident	86.6	Confident	67 Å²	67	57.2 Å²	57.2	26%	0.263	29%	0.294	S	S	.	.	S	Bend	trans	-127.5	57.6	-174.8	-64.2	-83.1	0	0	0	112.8	M105 L601 A602 E603	M105-Y458 HydrophobicContact CE-CE1 4.37Å; M105-Y458 HydrophobicContact SD-CE1 4.4Å; Y458-L601 HydrophobicContact CD1-CD2 3.96Å; Y458-L601 HydrophobicContact CD1-CG 4.39Å; Y458-L601 HydrophobicContact CG-CD2 4.21Å; Y458-L601 WeakPolarHBondContact O-CD1 3.29Å; Y458-A602 WeakPolarHBondContact CA-O 3.35Å; Y458-E603 HydrophobicContact CD1-CB 3.86Å; Y458-E603 HydrophobicContact CD1-CG 4.34Å; Y458-E603 HydrophobicContact CE1-CB 3.62Å; Y458-E603 HydrophobicContact CE1-CG 3.69Å
459	P	89.7	Confident	86.9	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	29%	0.286	C	S	.	.			trans	-61.1	147.9	177.1	23.9	-34.6	0	0	0	112.8	P454 E456 E457 Y476 A602 I604	P454-P459 HydrophobicContact CB-CB 3.76Å; P454-P459 HydrophobicContact CB-CG 4.06Å; P454-P459 HydrophobicContact CG-CB 3.74Å; P454-P459 HydrophobicContact CG-CG 4.05Å; E456-P459 HydrophobicContact CB-CB 4.4Å; E456-P459 WeakPolarHBondContact O-CD 3.47Å; E457-P459 VanDerWaalsContact C-CD 3.47Å; P459-Y476 HydrophobicContact CB-CD1 4.35Å; P459-Y476 HydrophobicContact CG-CD1 4.46Å; P459-Y476 HydrophobicContact CG-CE1 4.41Å; P459-A602 VanDerWaalsContact CD-O 3.25Å; P459-A602 WeakPolarHBondContact CD-O 3.31Å; P459-A602 PolarHBondContact O-N 3.43Å; P459-I604 HydrophobicContact CG-CD1 3.68Å; P459-I604 HydrophobicContact CG-CG1 4.19Å
460	S	86.8	Confident	87.1	Confident	21 Å²	21	54.7 Å²	54.7	15%	0.147	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	133.3	169.3	-68.7	0	0	0	0	110.6	I477 L600	S460-I477 PolarHBondContact O-N 3.48Å; S460-L600 WeakPolarHBondContact CA-O 3.32Å
461	V	90.3	Very high	87.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.3	179.8	-63.6	0	0	0	0	111.5	V463 L474 R475 Y476 I599 L600 A602 L615	V461-V463 HydrophobicContact CG2-CG2 4.46Å; V461-L474 HydrophobicContact CB-CB 4.49Å; V461-L474 HydrophobicContact CB-CD1 4.34Å; V461-L474 HydrophobicContact CB-CD2 4.17Å; V461-L474 HydrophobicContact CG1-CD1 4.03Å; V461-L474 HydrophobicContact CG1-CD2 4.15Å; V461-L474 HydrophobicContact CG2-CD2 4.24Å; V461-R475 CarbonylContact C-O 3.57Å; V461-R475 VanDerWaalsContact CA-O 3.23Å; V461-R475 WeakPolarHBondContact CA-O 3.49Å; V461-Y476 HydrophobicContact CG1-CD1 3.61Å; V461-Y476 HydrophobicContact CG1-CE1 3.9Å; V461-I599 CarbonylContact O-C 3.54Å; V461-I599 VanDerWaalsContact O-CA 3.26Å; V461-I599 WeakPolarHBondContact O-CA 3.39Å; V461-L600 HydrophobicContact CG2-CB 4.38Å; V461-L600 PolarHBondContact N-O 3.02Å; V461-L600 PolarHBondContact O-N 3.48Å; V461-A602 HydrophobicContact CG1-CB 3.85Å; V461-A602 HydrophobicContact CG2-CB 3.81Å; V461-L615 HydrophobicContact CG2-CD2 3.75Å
462	L	86	Confident	87.2	Confident	4 Å²	4	49 Å²	49	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	116.8	163.4	177.4	69.3	0	0	0	108.5	A87 M464 L474 R475 I477 R598 I599	A87-L462 HydrophobicContact CB-CD2 4.01Å; L462-M464 HydrophobicContact CD2-SD 3.72Å; L462-M464 HydrophobicContact CG-SD 4.02Å; L462-L474 CarbonylContact O-C 3.57Å; L462-L474 WeakPolarHBondContact O-CA 3.16Å; L462-L474 WeakPolarHBondContact O-CB 3.47Å; L462-R475 PolarHBondContact N-O 3.42Å; L462-R475 PolarHBondContact O-N 3.19Å; L462-I477 HydrophobicContact CB-CD1 4.05Å; L462-R598 WeakPolarHBondContact CA-O 3.41Å; L462-I599 HydrophobicContact CB-CG1 4.41Å; L462-I599 HydrophobicContact CD1-CG1 4.02Å
463	V	88.6	Confident	87.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	128.2	172.7	175	0	0	0	0	109.2	V461 V472 F591 A595 G597 R598 L600 L615	V461-V463 HydrophobicContact CG2-CG2 4.46Å; V463-V472 HydrophobicContact CG1-CG1 4.03Å; V463-F591 HydrophobicContact CG1-CE1 3.98Å; V463-F591 HydrophobicContact CG1-CZ 3.64Å; V463-A595 HydrophobicContact CB-CB 4.42Å; V463-A595 WeakPolarHBondContact CB-O 3.3Å; V463-A595 HydrophobicContact CG1-CB 4.08Å; V463-A595 HydrophobicContact CG2-CB 4.46Å; V463-G597 WeakPolarHBondContact O-CA 3.34Å; V463-G597 PolarHBondContact O-N 3.41Å; V463-R598 PolarHBondContact N-O 2.92Å; V463-L600 HydrophobicContact CG2-CD1 4.03Å; V463-L615 HydrophobicContact CG2-CD1 3.96Å
464	M	81.5	Confident	87.2	Confident	9 Å²	9	42 Å²	42	4%	0.044	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-72.1	-177.3	-62.5	-60.3	-51.4	0	0	110.8	A87 L462 I473 R475 H545	A87-M464 HydrophobicContact CB-CE 3.32Å; A87-M464 HydrophobicContact CB-SD 3.72Å; L462-M464 HydrophobicContact CD2-SD 3.72Å; L462-M464 HydrophobicContact CG-SD 4.02Å; M464-I473 HydrophobicContact CB-CB 4.34Å; M464-I473 HydrophobicContact CB-CG2 4.14Å; M464-I473 WeakPolarHBondContact CB-O 3.31Å; M464-I473 HydrophobicContact CG-CG2 4.36Å; M464-I473 PolarHBondContact N-O 3.18Å; M464-R475 HydrophobicContact CG-CG 4.47Å; M464-H545 WeakPolarHBondContact CE-O 3.37Å; M464-H545 WeakPolarHBondContact CG-O 3.23Å
465	E	78.9	Confident	87.3	Confident	77 Å²	77	42.3 Å²	42.3	36%	0.36	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	165.5	179.6	63.3	174.2	-159.4	0	0	110.6	I473	E465-I473 HydrophobicContact CG-CD1 4.15Å; E465-I473 PolarHBondContact O-N 3.02Å
466	A	83.2	Confident	87.7	Confident	25 Å²	25	32.8 Å²	32.8	21%	0.207	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	121.6	171.1	0	0	0	0	0	110.5	V472 F591	A466-V472 HydrophobicContact CB-CB 4.24Å; A466-V472 HydrophobicContact CB-CG1 4.36Å; A466-V472 HydrophobicContact CB-CG2 3.83Å; A466-F591 HydrophobicContact CB-CD1 3.82Å; A466-F591 HydrophobicContact CB-CE1 3.49Å; A466-F591 VanDerWaalsContact CB-CE1 3.49Å; A466-F591 HydrophobicContact CB-CZ 4.44Å
467	T	81.5	Confident	87.9	Confident	105 Å²	105	29.5 Å²	29.5	64%	0.644	16%	0.155	S	C	*	.	S	Bend	trans	-82.6	-22.6	167.7	55.8	0	0	0	0	111.9
468	N	92.9	Very high	88.5	Confident	33 Å²	33	24.6 Å²	24.6	18%	0.176	14%	0.139	C	C	.	.	S	Bend	trans	-154.1	154.1	169.9	67.6	85.5	0	0	0	109.6	N470 S471 C582 Q583	N468-N470 PolarHBondContact O-N 2.91Å; N468-N470 WeakPolarHBondContact OD1-CA 3.14Å; N468-N470 WeakPolarHBondContact OD1-CB 3.28Å; N468-N470 PolarHBondContact OD1-N 3.48Å; N468-S471 CarbonylContact O-C 3.51Å; N468-S471 PolarHBondContact O-N 2.88Å; N468-S471 VanDerWaalsContact O-N 3.16Å; N468-S471 PolarHBondContact OD1-N 3.01Å; N468-C582 CarbonylContact C-O 3.54Å; N468-C582 WeakPolarHBondContact CA-O 3.46Å; N468-C582 VanDerWaalsContact CB-O 3.25Å; N468-C582 WeakPolarHBondContact CB-O 3.44Å; N468-Q583 HydrophobicContact CB-CG 4.18Å
469	T	95	Very high	88.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-2.4	-177.4	68	0	0	0	0	114.6	K574 L575 L578 C582 V587 L588	T469-K574 WeakPolarHBondContact O-CA 3.44Å; T469-L575 HydrophobicContact CG2-CD1 4.03Å; T469-L575 PolarHBondContact O-N 3.39Å; T469-L578 HydrophobicContact CG2-CD1 4.33Å; T469-L578 PolarHBondContact OG1-O 2.91Å; T469-C582 PolarHBondContact N-O 2.69Å; T469-C582 WeakPolarHBondContact OG1-CA 3.17Å; T469-C582 VanDerWaalsContact OG1-CB 3.3Å; T469-C582 WeakPolarHBondContact OG1-CB 3.28Å; T469-V587 HydrophobicContact CG2-CG1 3.62Å; T469-L588 HydrophobicContact CG2-CD2 3.86Å
470	N	95.3	Very high	88.4	Confident	42 Å²	42	32 Å²	32	23%	0.225	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.7	171.8	-75.2	-23.7	0	0	0	112.8	N468 C573 K574 E579 C582	N468-N470 PolarHBondContact O-N 2.91Å; N468-N470 WeakPolarHBondContact OD1-CA 3.14Å; N468-N470 WeakPolarHBondContact OD1-CB 3.28Å; N468-N470 PolarHBondContact OD1-N 3.48Å; N470-C573 CarbonylContact C-O 3.53Å; N470-K574 HydrophobicContact CB-CG 4.18Å; N470-K574 VanDerWaalsContact O-CG 3.27Å; N470-K574 WeakPolarHBondContact O-CG 3.38Å; N470-E579 PolarHBondContact ND2-O 3.37Å; N470-E579 WeakPolarHBondContact OD1-CA 3.42Å; N470-C582 HydrophobicContact CB-CB 4.15Å; N470-C582 WeakPolarHBondContact ND2-CB 3.48Å; N470-C582 PolarHBondContact ND2-SG 2.73Å
471	S	92.1	Very high	88.7	Confident	21 Å²	21	32.7 Å²	32.7	15%	0.147	19%	0.189	C	C	.	.	S	Bend	trans	-148.5	50.2	-179.6	175	0	0	0	0	110.1	N468 K572 C573	N468-S471 CarbonylContact O-C 3.51Å; N468-S471 PolarHBondContact O-N 2.88Å; N468-S471 VanDerWaalsContact O-N 3.16Å; N468-S471 PolarHBondContact OD1-N 3.01Å; S471-K572 VanDerWaalsContact OG-CD 3.32Å; S471-K572 WeakPolarHBondContact OG-CD 3.47Å; S471-K572 WeakPolarHBondContact OG-CE 3.45Å; S471-K572 PolarHBondContact OG-NZ 2.85Å; S471-C573 PolarHBondContact N-O 3.36Å
472	V	94.5	Very high	88.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	128.8	172	176	0	0	0	0	108.8	V463 A466 K572 C573 L575 F591	V463-V472 HydrophobicContact CG1-CG1 4.03Å; A466-V472 HydrophobicContact CB-CB 4.24Å; A466-V472 HydrophobicContact CB-CG1 4.36Å; A466-V472 HydrophobicContact CB-CG2 3.83Å; V472-K572 CarbonylContact O-C 3.51Å; V472-K572 VanDerWaalsContact O-CA 3.25Å; V472-K572 WeakPolarHBondContact O-CA 3.37Å; V472-C573 PolarHBondContact N-O 3.29Å; V472-C573 PolarHBondContact O-N 2.83Å; V472-L575 HydrophobicContact CG2-CD1 4Å; V472-L575 HydrophobicContact CG2-CD2 4.07Å; V472-L575 HydrophobicContact CG2-CG 3.79Å; V472-F591 HydrophobicContact CB-CZ 4.42Å; V472-F591 HydrophobicContact CG1-CE1 4.06Å; V472-F591 HydrophobicContact CG1-CZ 3.56Å; V472-F591 HydrophobicContact CG2-CE1 4.25Å; V472-F591 HydrophobicContact CG2-CE2 4.46Å; V472-F591 HydrophobicContact CG2-CZ 3.93Å
473	I	91.1	Very high	88.4	Confident	17 Å²	17	37.1 Å²	37.1	9%	0.087	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.9	177.6	-56.2	179.8	0	0	0	109.1	M464 E465 G546 A570 T571 K572	M464-I473 HydrophobicContact CB-CB 4.34Å; M464-I473 HydrophobicContact CB-CG2 4.14Å; M464-I473 WeakPolarHBondContact CB-O 3.31Å; M464-I473 HydrophobicContact CG-CG2 4.36Å; M464-I473 PolarHBondContact N-O 3.18Å; E465-I473 HydrophobicContact CG-CD1 4.15Å; E465-I473 PolarHBondContact O-N 3.02Å; I473-G546 WeakPolarHBondContact CD1-O 3.5Å; I473-A570 HydrophobicContact CG2-CB 4.4Å; I473-T571 WeakPolarHBondContact CA-O 3.14Å; I473-K572 HydrophobicContact CG1-CG 4.45Å
474	L	93.6	Very high	88.6	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	167.3	177.9	64.4	74.3	0	0	0	112.5	V461 L462 Y476 T571 C573	V461-L474 HydrophobicContact CB-CB 4.49Å; V461-L474 HydrophobicContact CB-CD1 4.34Å; V461-L474 HydrophobicContact CB-CD2 4.17Å; V461-L474 HydrophobicContact CG1-CD1 4.03Å; V461-L474 HydrophobicContact CG1-CD2 4.15Å; V461-L474 HydrophobicContact CG2-CD2 4.24Å; L462-L474 CarbonylContact O-C 3.57Å; L462-L474 WeakPolarHBondContact O-CA 3.16Å; L462-L474 WeakPolarHBondContact O-CB 3.47Å; L474-Y476 HydrophobicContact CD1-CD1 4.46Å; L474-Y476 HydrophobicContact CD1-CE1 4.18Å; L474-T571 HydrophobicContact CD1-CG2 3.67Å; L474-T571 PolarHBondContact N-O 3.03Å; L474-T571 PolarHBondContact O-N 3.45Å; L474-C573 HydrophobicContact CD2-CB 4.13Å; L474-C573 WeakPolarHBondContact CD2-SG 3.21Å
475	R	91.8	Very high	89.1	Confident	13 Å²	13	38 Å²	38	5%	0.049	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.2	168.4	-53.9	-170.8	-62.2	169.2	-7.7	109.5	A87 V461 L462 M464 D544	A87-R475 PolarHBondContact O-NH2 3.08Å; V461-R475 CarbonylContact C-O 3.57Å; V461-R475 VanDerWaalsContact CA-O 3.23Å; V461-R475 WeakPolarHBondContact CA-O 3.49Å; L462-R475 PolarHBondContact N-O 3.42Å; L462-R475 PolarHBondContact O-N 3.19Å; M464-R475 HydrophobicContact CG-CG 4.47Å; R475-D544 WeakPolarHBondContact CD-O 3.29Å
476	Y	93.1	Very high	89.5	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	148	169	-61	-67.6	0	0	0	110.5	L451 P454 P459 V461 L474 Y481 T571 I604	L451-Y476 HydrophobicContact CD2-CD2 3.98Å; L451-Y476 HydrophobicContact CD2-CE2 4.05Å; P454-Y476 VanDerWaalsContact CD-CE1 3.43Å; P454-Y476 VanDerWaalsContact CD-CZ 3.47Å; P454-Y476 HydrophobicContact CG-CD1 3.37Å; P454-Y476 HydrophobicContact CG-CD2 4.06Å; P454-Y476 HydrophobicContact CG-CE1 3.77Å; P454-Y476 HydrophobicContact CG-CE2 4.4Å; P454-Y476 HydrophobicContact CG-CG 3.55Å; P459-Y476 HydrophobicContact CB-CD1 4.35Å; P459-Y476 HydrophobicContact CG-CD1 4.46Å; P459-Y476 HydrophobicContact CG-CE1 4.41Å; V461-Y476 HydrophobicContact CG1-CD1 3.61Å; V461-Y476 HydrophobicContact CG1-CE1 3.9Å; L474-Y476 HydrophobicContact CD1-CD1 4.46Å; L474-Y476 HydrophobicContact CD1-CE1 4.18Å; Y476-Y481 HydrophobicContact CD2-CD1 4.11Å; Y476-Y481 AromaticContact CD2-CE1 3.93Å; Y476-Y481 HydrophobicContact CD2-CE1 3.93Å; Y476-Y481 HydrophobicContact CG-CD1 4.33Å; Y476-Y481 HydrophobicContact CG-CE1 4.34Å; Y476-Y481 VanDerWaalsContact O-CB 3.27Å; Y476-Y481 WeakPolarHBondContact O-CB 3.36Å; Y476-T571 HydrophobicContact CD2-CG2 4.43Å; Y476-T571 HydrophobicContact CE2-CG2 3.8Å; Y476-I604 HydrophobicContact CE1-CD1 4.5Å
477	I	85.2	Confident	89.9	Confident	52 Å²	52	38.6 Å²	38.6	27%	0.267	23%	0.232	S	C	.	.			trans	-109.4	127.9	177.5	-57.5	-58.1	0	0	0	108.6	S460 L462 I599	S460-I477 PolarHBondContact O-N 3.48Å; L462-I477 HydrophobicContact CB-CD1 4.05Å; I477-I599 HydrophobicContact CG1-CG2 4.41Å
478	G	83.1	Confident	90.5	Very high	24 Å²	24	34.2 Å²	34.2	25%	0.247	21%	0.205	C	C	.	.	S	Bend	trans	155.6	179.2	-178.5	0	0	0	0	0	113.6	Y481 S482 V483	G478-Y481 CarbonylContact O-C 3.53Å; G478-Y481 PolarHBondContact O-N 2.88Å; G478-Y481 VanDerWaalsContact O-N 3.14Å; G478-S482 PolarHBondContact N-OG 3Å; G478-S482 VanDerWaalsContact N-OG 3.12Å; G478-S482 PolarHBondContact O-N 3.42Å; G478-S482 PolarHBondContact O-OG 3.39Å; G478-V483 PolarHBondContact O-N 3.13Å; G478-V483 VanDerWaalsContact O-N 3.11Å
479	E	86.2	Confident	90.5	Very high	171 Å²	171	33.5 Å²	33.5	80%	0.799	20%	0.2	S	C	*	.	I	π-helix	trans	-59.5	-51.3	-175.1	-171.6	176.3	-174.7	0	0	112.4	Y481 A484	E479-Y481 PolarHBondContact O-N 2.9Å; E479-A484 WeakPolarHBondContact O-CB 3.38Å; E479-A484 PolarHBondContact O-N 3.29Å
480	G	86.3	Confident	90.2	Very high	51 Å²	51	37 Å²	37	53%	0.526	22%	0.219	S	C	.	.	I	π-helix	trans	-76.9	6.7	177.1	0	0	0	0	0	115.4
481	Y	92.4	Very high	90.1	Very high	37 Å²	37	39.2 Å²	39.2	15%	0.145	23%	0.228	C	C	.	.	I	π-helix	trans	-129.4	-104.9	-172.8	-56.7	-72.5	0	0	0	111	L451 Q452 P454 Y476 G478 E479 V483 A484 Q485 Q569	L451-Y481 HydrophobicContact CD1-CD1 3.94Å; L451-Y481 HydrophobicContact CD1-CE1 3.96Å; L451-Y481 HydrophobicContact CG-CE1 4.47Å; Q452-Y481 VanDerWaalsContact O-CE1 3.26Å; Q452-Y481 WeakPolarHBondContact O-CE1 3.42Å; Q452-Y481 PolarHBondContact O-OH 2.58Å; P454-Y481 VanDerWaalsContact CA-OH 3.32Å; P454-Y481 WeakPolarHBondContact CA-OH 3.21Å; P454-Y481 HydrophobicContact CB-CE2 4.17Å; P454-Y481 WeakPolarHBondContact CD-OH 3.27Å; P454-Y481 HydrophobicContact CG-CE1 4.47Å; P454-Y481 HydrophobicContact CG-CE2 3.74Å; Y476-Y481 HydrophobicContact CD2-CD1 4.11Å; Y476-Y481 AromaticContact CD2-CE1 3.93Å; Y476-Y481 HydrophobicContact CD2-CE1 3.93Å; Y476-Y481 HydrophobicContact CG-CD1 4.33Å; Y476-Y481 HydrophobicContact CG-CE1 4.34Å; Y476-Y481 VanDerWaalsContact O-CB 3.27Å; Y476-Y481 WeakPolarHBondContact O-CB 3.36Å; G478-Y481 CarbonylContact O-C 3.53Å; G478-Y481 PolarHBondContact O-N 2.88Å; G478-Y481 VanDerWaalsContact O-N 3.14Å; E479-Y481 PolarHBondContact O-N 2.9Å; Y481-V483 VanDerWaalsContact C-N 3.3Å; Y481-V483 PolarHBondContact O-N 3.48Å; Y481-A484 PolarHBondContact O-N 3.04Å; Y481-A484 VanDerWaalsContact O-N 3.12Å; Y481-Q485 PolarHBondContact O-N 3Å; Y481-Q569 VanDerWaalsContact CA-OE1 3.31Å
482	S	84.9	Confident	90.1	Very high	15 Å²	15	38.2 Å²	38.2	11%	0.105	22%	0.221	C	C	.	.	I	π-helix	trans	-54.2	-39.8	180	59.3	0	0	0	0	113.9	G478 Q485 D486	G478-S482 PolarHBondContact N-OG 3Å; G478-S482 VanDerWaalsContact N-OG 3.12Å; G478-S482 PolarHBondContact O-N 3.42Å; G478-S482 PolarHBondContact O-OG 3.39Å; S482-Q485 WeakPolarHBondContact O-CB 3.48Å; S482-Q485 PolarHBondContact O-N 3.11Å; S482-D486 PolarHBondContact O-N 3.35Å
483	V	86.1	Confident	89.8	Confident	81 Å²	81	44.5 Å²	44.5	49%	0.491	25%	0.245	S	C	.	.	I	π-helix	trans	-71.2	-38.3	179.7	-177.8	0	0	0	0	111.4	G478 Y481 Q485 D486 S487	G478-V483 PolarHBondContact O-N 3.13Å; G478-V483 VanDerWaalsContact O-N 3.11Å; Y481-V483 VanDerWaalsContact C-N 3.3Å; Y481-V483 PolarHBondContact O-N 3.48Å; V483-Q485 VanDerWaalsContact C-N 3.32Å; V483-D486 PolarHBondContact O-N 2.89Å; V483-S487 WeakPolarHBondContact O-CB 3.46Å; V483-S487 PolarHBondContact O-N 3.32Å
484	A	91.2	Very high	89.7	Confident	26 Å²	26	50.4 Å²	50.4	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-32.6	173.5	0	0	0	0	0	112.2	E479 Y481 M488 L566	E479-A484 WeakPolarHBondContact O-CB 3.38Å; E479-A484 PolarHBondContact O-N 3.29Å; Y481-A484 PolarHBondContact O-N 3.04Å; Y481-A484 VanDerWaalsContact O-N 3.12Å; A484-M488 VanDerWaalsContact O-CB 3.27Å; A484-M488 WeakPolarHBondContact O-CB 3.43Å; A484-M488 PolarHBondContact O-N 2.9Å; A484-M488 VanDerWaalsContact O-N 3.12Å; A484-L566 HydrophobicContact CB-CD1 3.68Å
485	Q	92.8	Very high	89.5	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-62.2	-55.5	169.7	-175.6	173.2	-12.4	0	0	111.1	Y481 S482 V483 S487 M488 E489 D544 H545 Q569	Y481-Q485 PolarHBondContact O-N 3Å; S482-Q485 WeakPolarHBondContact O-CB 3.48Å; S482-Q485 PolarHBondContact O-N 3.11Å; V483-Q485 VanDerWaalsContact C-N 3.32Å; Q485-S487 VanDerWaalsContact C-N 3.28Å; Q485-S487 PolarHBondContact O-N 2.69Å; Q485-M488 WeakPolarHBondContact O-CB 3.3Å; Q485-M488 PolarHBondContact O-N 3.08Å; Q485-E489 HydrophobicContact CG-CG 4.44Å; Q485-E489 WeakPolarHBondContact CG-OE1 3.35Å; Q485-E489 PolarHBondContact NE2-OE1 3.28Å; Q485-E489 PolarHBondContact O-N 3.03Å; Q485-D544 HydrophobicContact CG-CB 4.3Å; Q485-D544 PolarHBondContact NE2-O 3.49Å; Q485-D544 PolarHBondContact OE1-O 3.08Å; Q485-H545 PolarHBondContact NE2-CE1 3.1Å; Q485-Q569 HydrophobicContact CB-CG 4.08Å; Q485-Q569 HydrophobicContact CG-CG 4.34Å
486	D	87.6	Confident	89.3	Confident	49 Å²	49	53 Å²	53	26%	0.262	28%	0.284	S	S	.	.	H	α-helix	trans	-56.5	-42.8	-178.7	-62.5	-26.3	0	0	0	110.9	S91 S482 V483 M488 E489 D490	S91-D486 WeakPolarHBondContact CB-OD1 3.47Å; S482-D486 PolarHBondContact O-N 3.35Å; V483-D486 PolarHBondContact O-N 2.89Å; D486-M488 VanDerWaalsContact C-N 3.35Å; D486-M488 PolarHBondContact O-N 3.34Å; D486-E489 PolarHBondContact O-N 3.17Å; D486-D490 WeakPolarHBondContact O-CB 3.3Å; D486-D490 PolarHBondContact O-N 2.9Å
487	S	91.6	Very high	88.6	Confident	66 Å²	66	55.3 Å²	55.3	46%	0.462	31%	0.308	S	S	.	.	H	α-helix	trans	-63.8	-36.2	175.7	-171.1	0	0	0	0	113.3	V483 Q485 E491	V483-S487 WeakPolarHBondContact O-CB 3.46Å; V483-S487 PolarHBondContact O-N 3.32Å; Q485-S487 VanDerWaalsContact C-N 3.28Å; Q485-S487 PolarHBondContact O-N 2.69Å; S487-E491 PolarHBondContact O-N 2.95Å; S487-E491 VanDerWaalsContact O-N 3.13Å
488	M	94.1	Very high	87.8	Confident	13 Å²	13	57.5 Å²	57.5	6%	0.064	33%	0.328	C	S	.	.	H	α-helix	trans	-75	-38	179.7	-176.2	-77.4	-53.2	0	0	111.2	A484 Q485 D486 E491 M492 R527 F563 L566	A484-M488 VanDerWaalsContact O-CB 3.27Å; A484-M488 WeakPolarHBondContact O-CB 3.43Å; A484-M488 PolarHBondContact O-N 2.9Å; A484-M488 VanDerWaalsContact O-N 3.12Å; Q485-M488 WeakPolarHBondContact O-CB 3.3Å; Q485-M488 PolarHBondContact O-N 3.08Å; D486-M488 VanDerWaalsContact C-N 3.35Å; D486-M488 PolarHBondContact O-N 3.34Å; M488-E491 PolarHBondContact O-N 2.86Å; M488-M492 HydrophobicContact CE-SD 4.33Å; M488-M492 WeakPolarHBondContact O-CG 3.36Å; M488-M492 PolarHBondContact O-N 2.92Å; M488-M492 HydrophobicContact SD-CG 3.82Å; M488-M492 HydrophobicContact SD-SD 3.49Å; M488-R527 HydrophobicContact CE-CG 4.1Å; M488-R527 HydrophobicContact SD-CG 4.04Å; M488-F563 HydrophobicContact CG-CD1 4.22Å; M488-F563 HydrophobicContact SD-CD1 4.04Å; M488-L566 HydrophobicContact CB-CD2 3.89Å; M488-L566 HydrophobicContact CE-CD2 4.29Å; M488-L566 HydrophobicContact CG-CB 4.46Å; M488-L566 HydrophobicContact CG-CD2 4.06Å
489	E	91.8	Very high	86.5	Confident	18 Å²	18	59.8 Å²	59.8	8%	0.084	34%	0.335	C	S	.	.	H	α-helix	trans	-65.5	-39.7	172.3	-72.6	173.8	-163.3	0	0	111.8	Q485 D486 M492 R493 L526 H545	Q485-E489 HydrophobicContact CG-CG 4.44Å; Q485-E489 WeakPolarHBondContact CG-OE1 3.35Å; Q485-E489 PolarHBondContact NE2-OE1 3.28Å; Q485-E489 PolarHBondContact O-N 3.03Å; D486-E489 PolarHBondContact O-N 3.17Å; E489-M492 PolarHBondContact O-N 2.74Å; E489-R493 WeakPolarHBondContact O-CB 3.46Å; E489-R493 PolarHBondContact O-N 2.86Å; E489-L526 HydrophobicContact CG-CD2 4.14Å; E489-H545 IonicContact OE1-CE1 3.28Å; E489-H545 PolarHBondContact OE1-CE1 2.63Å; E489-H545 IonicContact OE1-NE2 2.61Å; E489-H545 PolarHBondContact OE1-NE2 2.94Å; E489-H545 VanDerWaalsContact OE1-NE2 3.13Å; E489-H545 IonicContact OE2-CE1 2.83Å
490	D	90.1	Very high	85.1	Confident	75 Å²	75	60.4 Å²	60.4	40%	0.401	34%	0.335	S	S	.	.	H	α-helix	trans	-57.9	-47.1	171	-87.4	5.9	0	0	0	111.7	D486 R493 E494	D486-D490 WeakPolarHBondContact O-CB 3.3Å; D486-D490 PolarHBondContact O-N 2.9Å; D490-R493 PolarHBondContact O-N 3.18Å; D490-R493 IonicContact OD1-CZ 3.31Å; D490-R493 IonicContact OD1-NH1 3.36Å; D490-R493 PolarHBondContact OD1-NH1 2.84Å; D490-R493 IonicContact OD1-NH2 3.87Å; D490-R493 PolarHBondContact OD1-NH2 2.61Å; D490-R493 IonicContact OD2-NH2 3.73Å; D490-E494 PolarHBondContact O-N 3.42Å; D490-E494 VanDerWaalsContact O-N 3.1Å
491	E	92.2	Very high	83.4	Confident	88 Å²	88	62.5 Å²	62.5	41%	0.411	34%	0.341	S	S	.	.	H	α-helix	trans	-65.5	-36.6	175	-79.9	-168.4	-133.3	0	0	113.7	S487 M488 F495 K562 F563	S487-E491 PolarHBondContact O-N 2.95Å; S487-E491 VanDerWaalsContact O-N 3.13Å; M488-E491 PolarHBondContact O-N 2.86Å; E491-F495 WeakPolarHBondContact O-CB 3.21Å; E491-F495 PolarHBondContact O-N 2.85Å; E491-K562 IonicContact OE2-NZ 2.67Å; E491-K562 PolarHBondContact OE2-NZ 3.16Å; E491-F563 HydrophobicContact CB-CE1 3.95Å
492	M	91.8	Very high	81.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-64.3	-45.3	174.7	-77	-171.3	80.2	0	0	110.7	M488 E489 E494 F495 Y496 A516 I525 R527 L559 F563	M488-M492 HydrophobicContact CE-SD 4.33Å; M488-M492 WeakPolarHBondContact O-CG 3.36Å; M488-M492 PolarHBondContact O-N 2.92Å; M488-M492 HydrophobicContact SD-CG 3.82Å; M488-M492 HydrophobicContact SD-SD 3.49Å; E489-M492 PolarHBondContact O-N 2.74Å; M492-E494 PolarHBondContact O-N 2.96Å; M492-F495 PolarHBondContact O-N 3.06Å; M492-Y496 HydrophobicContact CB-CD2 4.27Å; M492-Y496 HydrophobicContact CE-CD2 4.26Å; M492-Y496 HydrophobicContact CE-CE2 3.72Å; M492-Y496 HydrophobicContact CG-CE2 4.41Å; M492-Y496 VanDerWaalsContact O-CD2 3.32Å; M492-Y496 WeakPolarHBondContact O-CD2 3.17Å; M492-Y496 PolarHBondContact O-N 2.99Å; M492-A516 HydrophobicContact CE-CB 3.72Å; M492-I525 HydrophobicContact CE-CG2 4.2Å; M492-R527 HydrophobicContact CE-CG 3.97Å; M492-R527 HydrophobicContact SD-CG 3.51Å; M492-R527 VanDerWaalsContact SD-CG 3.51Å; M492-L559 HydrophobicContact CE-CD1 3.89Å; M492-F563 HydrophobicContact CB-CE1 4.13Å; M492-F563 HydrophobicContact CB-CZ 4.11Å; M492-F563 HydrophobicContact CG-CD1 3.48Å; M492-F563 VanDerWaalsContact CG-CD1 3.48Å; M492-F563 HydrophobicContact CG-CD2 4.12Å; M492-F563 HydrophobicContact CG-CE1 3.27Å; M492-F563 HydrophobicContact CG-CE2 3.96Å; M492-F563 HydrophobicContact CG-CG 3.91Å; M492-F563 HydrophobicContact CG-CZ 3.52Å; M492-F563 HydrophobicContact SD-CD1 4.4Å; M492-F563 HydrophobicContact SD-CG 4.47Å
493	R	88.6	Confident	80.5	Confident	131 Å²	131	68.3 Å²	68.3	49%	0.494	37%	0.368	S	S	.	.	H	α-helix	trans	-62.4	-41.9	179.8	-172.9	179.1	63.1	-110.7	-5.9	112.1	E489 D490 G497	E489-R493 WeakPolarHBondContact O-CB 3.46Å; E489-R493 PolarHBondContact O-N 2.86Å; D490-R493 PolarHBondContact O-N 3.18Å; D490-R493 IonicContact OD1-CZ 3.31Å; D490-R493 IonicContact OD1-NH1 3.36Å; D490-R493 PolarHBondContact OD1-NH1 2.84Å; D490-R493 IonicContact OD1-NH2 3.87Å; D490-R493 PolarHBondContact OD1-NH2 2.61Å; D490-R493 IonicContact OD2-NH2 3.73Å; R493-G497 WeakPolarHBondContact O-CA 3.34Å; R493-G497 PolarHBondContact O-N 3.14Å
494	E	89.3	Confident	79.5	Confident	142 Å²	142	68 Å²	68	66%	0.664	37%	0.374	S	S	*	.	H	α-helix	trans	-66.4	-47.8	174.9	-174.8	174.6	-164.6	0	0	111.8	D490 M492 S498	D490-E494 PolarHBondContact O-N 3.42Å; D490-E494 VanDerWaalsContact O-N 3.1Å; M492-E494 PolarHBondContact O-N 2.96Å; E494-S498 WeakPolarHBondContact O-CB 3.25Å; E494-S498 PolarHBondContact O-N 3.48Å; E494-S498 PolarHBondContact O-OG 3.25Å
495	F	90.1	Very high	78.5	Confident	59 Å²	59	70 Å²	70	26%	0.259	39%	0.385	S	S	.	.	H	α-helix	trans	-62.9	-54.7	-177.1	-178.9	-95.6	0	0	0	112.5	E491 M492 H560 F563	E491-F495 WeakPolarHBondContact O-CB 3.21Å; E491-F495 PolarHBondContact O-N 2.85Å; M492-F495 PolarHBondContact O-N 3.06Å; F495-H560 HydrophobicContact CE1-CB 3.82Å; F495-H560 HydrophobicContact CZ-CB 4.05Å; F495-H560 AromaticContact CZ-CD2 3.42Å; F495-H560 VanDerWaalsContact CZ-CD2 3.42Å; F495-H560 WeakPolarHBondContact CZ-CD2 3.47Å; F495-H560 AromaticContact CZ-CG 3.7Å; F495-F563 HydrophobicContact CB-CE2 4.38Å; F495-F563 HydrophobicContact CB-CZ 3.94Å; F495-F563 AromaticContact CD1-CE2 3.81Å; F495-F563 HydrophobicContact CD1-CE2 3.81Å; F495-F563 HydrophobicContact CD1-CZ 4.24Å; F495-F563 HydrophobicContact CE1-CE2 4.38Å; F495-F563 HydrophobicContact CG-CE2 4.14Å; F495-F563 HydrophobicContact CG-CZ 4.15Å
496	Y	87	Confident	77.8	Confident	11 Å²	11	71.7 Å²	71.7	4%	0.043	39%	0.394	C	S	.	.	H	α-helix	trans	-81.9	-13	-177.8	-67.5	-76.5	0	0	0	113.6	M492 Q503 A516 I525 L557 E558 L559 H560 F563	M492-Y496 HydrophobicContact CB-CD2 4.27Å; M492-Y496 HydrophobicContact CE-CD2 4.26Å; M492-Y496 HydrophobicContact CE-CE2 3.72Å; M492-Y496 HydrophobicContact CG-CE2 4.41Å; M492-Y496 VanDerWaalsContact O-CD2 3.32Å; M492-Y496 WeakPolarHBondContact O-CD2 3.17Å; M492-Y496 PolarHBondContact O-N 2.99Å; Y496-Q503 PolarHBondContact O-NE2 2.97Å; Y496-A516 HydrophobicContact CD2-CB 4.49Å; Y496-A516 HydrophobicContact CE1-CB 4.13Å; Y496-A516 HydrophobicContact CE2-CB 3.82Å; Y496-I525 HydrophobicContact CD2-CG2 3.77Å; Y496-I525 HydrophobicContact CE2-CG2 4.39Å; Y496-I525 HydrophobicContact CG-CD1 4.38Å; Y496-I525 HydrophobicContact CG-CG2 4.02Å; Y496-L557 HydrophobicContact CD1-CD1 4Å; Y496-L557 HydrophobicContact CE1-CB 4.39Å; Y496-E558 WeakPolarHBondContact CE1-O 3.43Å; Y496-E558 PolarHBondContact OH-O 3.27Å; Y496-L559 WeakPolarHBondContact OH-CA 3.43Å; Y496-H560 PolarHBondContact OH-N 2.88Å; Y496-F563 HydrophobicContact CD2-CE2 4.28Å; Y496-F563 AromaticContact CE2-CD2 3.99Å; Y496-F563 HydrophobicContact CE2-CD2 3.99Å; Y496-F563 AromaticContact CE2-CE2 3.49Å; Y496-F563 HydrophobicContact CE2-CE2 3.49Å; Y496-F563 VanDerWaalsContact CE2-CE2 3.49Å; Y496-F563 HydrophobicContact CE2-CZ 4.27Å
497	G	78.9	Confident	76.9	Confident	51 Å²	51	75.2 Å²	75.2	53%	0.526	42%	0.422	S	S	.	.	H	α-helix	trans	-79.4	-28.9	176.9	0	0	0	0	0	114.2	R493	R493-G497 WeakPolarHBondContact O-CA 3.34Å; R493-G497 PolarHBondContact O-N 3.14Å
498	S	67.2	Low	76.3	Confident	98 Å²	98	75.6 Å²	75.6	69%	0.685	43%	0.425	S	S	*	.	H	α-helix	trans	-91.9	-24.6	-161.7	-59.2	0	0	0	0	116	E494	E494-S498 WeakPolarHBondContact O-CB 3.25Å; E494-S498 PolarHBondContact O-N 3.48Å; E494-S498 PolarHBondContact O-OG 3.25Å
499	D	55.5	Low	75.9	Confident	72 Å²	72	76.4 Å²	76.4	39%	0.385	43%	0.431	S	S	.	.			trans	-129.4	114.7	-170	-166.1	-10.7	0	0	0	113.2	S501 Q503	D499-S501 VanDerWaalsContact CG-OG 3.25Å; D499-S501 PolarHBondContact O-N 3.24Å; D499-S501 PolarHBondContact OD1-N 2.9Å; D499-S501 PolarHBondContact OD1-OG 3.05Å; D499-S501 PolarHBondContact OD2-OG 3.01Å; D499-Q503 WeakPolarHBondContact O-CG 3.4Å
500	K	57.3	Low	75.8	Confident	185 Å²	185	78.7 Å²	78.7	80%	0.804	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-70.3	-18.3	-179.5	-69.1	-174.7	178.1	-179.1	0	113.5
501	S	51.2	Low	75.8	Confident	95 Å²	95	79.1 Å²	79.1	66%	0.664	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-79.1	-18.7	-177	63.7	0	0	0	0	113.9	D499	D499-S501 VanDerWaalsContact CG-OG 3.25Å; D499-S501 PolarHBondContact O-N 3.24Å; D499-S501 PolarHBondContact OD1-N 2.9Å; D499-S501 PolarHBondContact OD1-OG 3.05Å; D499-S501 PolarHBondContact OD2-OG 3.01Å
502	Q	53.8	Low	75.6	Confident	118 Å²	118	76.6 Å²	76.6	55%	0.551	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-100.6	5.9	175.2	-58	-166.9	13.8	0	0	113.7
503	Q	62.3	Low	75.6	Confident	55 Å²	55	78.6 Å²	78.6	26%	0.257	46%	0.464	S	S	.	.			trans	-94.2	17.6	-176	-71	171.6	-1.6	0	0	114	Y496 D499 P505	Y496-Q503 PolarHBondContact O-NE2 2.97Å; D499-Q503 WeakPolarHBondContact O-CG 3.4Å; Q503-P505 WeakPolarHBondContact O-CD 3.16Å
504	A	64.9	Low	75.9	Confident	74 Å²	74	74.9 Å²	74.9	61%	0.612	45%	0.452	S	S	*	.			trans	-63.6	127.4	175.1	0	0	0	0	0	109.9
505	P	70.6	Confident	76.1	Confident	70 Å²	70	68.1 Å²	68.1	46%	0.455	42%	0.42	S	S	.	.			trans	-58	143.7	174.4	-24.8	34.5	0	0	0	111.3	Q503 S507 V556	Q503-P505 WeakPolarHBondContact O-CD 3.16Å; P505-S507 PolarHBondContact O-N 3.15Å; P505-S507 VanDerWaalsContact O-N 3.08Å; P505-V556 WeakPolarHBondContact CA-O 3.18Å
506	L	77.4	Confident	76.2	Confident	35 Å²	35	65.3 Å²	65.3	18%	0.183	41%	0.408	C	S	.	.			trans	-54.4	115.7	178.9	-104.3	163.6	0	0	0	111	S508 T509 V515 V556 L557 E558	L506-S508 VanDerWaalsContact C-N 3.26Å; L506-S508 PolarHBondContact O-N 3.21Å; L506-T509 HydrophobicContact CB-CG2 4.27Å; L506-V515 HydrophobicContact CD1-CB 4.28Å; L506-V515 HydrophobicContact CD1-CG1 3.49Å; L506-V515 VanDerWaalsContact CD1-CG1 3.49Å; L506-V556 HydrophobicContact CB-CG1 4.46Å; L506-V556 HydrophobicContact CD1-CG1 3.97Å; L506-V556 PolarHBondContact N-O 3.47Å; L506-L557 WeakPolarHBondContact CD1-O 3.2Å; L506-E558 HydrophobicContact CG-CB 4.48Å
507	S	69.8	Low	76.5	Confident	124 Å²	124	64.8 Å²	64.8	87%	0.867	41%	0.406	S	S	*	.	S	Bend	trans	-68.6	-23.8	-173.4	52.2	0	0	0	0	113.5	P505	P505-S507 PolarHBondContact O-N 3.15Å; P505-S507 VanDerWaalsContact O-N 3.08Å
508	S	78.9	Confident	77	Confident	74 Å²	74	64.9 Å²	64.9	52%	0.517	39%	0.39	S	S	.	.	S	Bend	trans	-133.9	138	168.4	55.7	0	0	0	0	109.8	L506	L506-S508 VanDerWaalsContact C-N 3.26Å; L506-S508 PolarHBondContact O-N 3.21Å
509	T	86.4	Confident	77.6	Confident	30 Å²	30	60.2 Å²	60.2	18%	0.184	36%	0.358	C	S	.	.			trans	-123.8	126.7	178.3	42.2	0	0	0	0	109	L506 I530 V556	L506-T509 HydrophobicContact CB-CG2 4.27Å; T509-I530 HydrophobicContact CG2-CD1 3.79Å; T509-V556 HydrophobicContact CG2-CG1 4.41Å
510	S	88.7	Confident	78.3	Confident	66 Å²	66	61.2 Å²	61.2	46%	0.462	36%	0.36	S	S	.	.			trans	-119.9	152	175.4	57.4	0	0	0	0	111.6	Q513 I530	S510-Q513 VanDerWaalsContact O-CB 3.27Å; S510-Q513 WeakPolarHBondContact O-CB 3.44Å; S510-Q513 PolarHBondContact O-N 3.39Å; S510-Q513 PolarHBondContact OG-OE1 3.4Å; S510-I530 WeakPolarHBondContact O-CB 3.34Å; S510-I530 WeakPolarHBondContact O-CG2 3.44Å
511	S	90.6	Very high	78.3	Confident	84 Å²	84	56.6 Å²	56.6	59%	0.587	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	140.7	171.1	179.3	0	0	0	0	109.8	Q513 C531	S511-Q513 VanDerWaalsContact C-N 3.33Å; S511-C531 PolarHBondContact OG-O 3.03Å
512	G	88.6	Confident	78.8	Confident	34 Å²	34	56.3 Å²	56.3	35%	0.351	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-17.9	-173.6	0	0	0	0	0	114.8	Q529 I530	G512-Q529 WeakPolarHBondContact O-CG 3.4Å; G512-Q529 PolarHBondContact O-NE2 2.98Å; G512-I530 PolarHBondContact N-O 3.18Å
513	Q	90.9	Very high	79.6	Confident	42 Å²	42	55.1 Å²	55.1	20%	0.196	32%	0.324	C	S	.	.			trans	-66.9	133.6	-176.2	-170.8	178.8	4.2	0	0	112.5	S510 S511 V515 Q529 I530	S510-Q513 VanDerWaalsContact O-CB 3.27Å; S510-Q513 WeakPolarHBondContact O-CB 3.44Å; S510-Q513 PolarHBondContact O-N 3.39Å; S510-Q513 PolarHBondContact OG-OE1 3.4Å; S511-Q513 VanDerWaalsContact C-N 3.33Å; Q513-V515 HydrophobicContact CG-CG1 4.11Å; Q513-Q529 WeakPolarHBondContact O-CA 3.43Å; Q513-I530 HydrophobicContact CB-CD1 4.39Å; Q513-I530 PolarHBondContact O-N 2.86Å
514	F	94	Very high	80.6	Confident	53 Å²	53	54.8 Å²	54.8	23%	0.232	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	135	171.1	-60.1	-64	0	0	0	111.2	A528 Q529 V543 L559 F564 F568	F514-A528 WeakPolarHBondContact CA-O 3.25Å; F514-Q529 HydrophobicContact CD1-CB 3.81Å; F514-Q529 HydrophobicContact CD1-CG 3.86Å; F514-Q529 HydrophobicContact CE1-CB 3.8Å; F514-Q529 VanDerWaalsContact CE1-CD 3.49Å; F514-Q529 HydrophobicContact CE1-CG 3.66Å; F514-Q529 HydrophobicContact CZ-CG 4.46Å; F514-V543 HydrophobicContact CD1-CG1 4.49Å; F514-V543 HydrophobicContact CE1-CG1 4.32Å; F514-L559 HydrophobicContact CB-CD2 4.1Å; F514-F564 HydrophobicContact CB-CE1 4.2Å; F514-F564 HydrophobicContact CB-CZ 4.35Å; F514-F564 HydrophobicContact CD2-CE1 4.3Å; F514-F568 HydrophobicContact CD1-CE1 4.5Å; F514-F568 HydrophobicContact CD1-CE2 4.12Å; F514-F568 AromaticContact CD1-CZ 3.58Å; F514-F568 HydrophobicContact CD1-CZ 3.58Å; F514-F568 HydrophobicContact CD2-CZ 4.4Å; F514-F568 AromaticContact CE1-CE2 3.41Å; F514-F568 HydrophobicContact CE1-CE2 3.41Å; F514-F568 VanDerWaalsContact CE1-CE2 3.41Å; F514-F568 AromaticContact CE1-CZ 3.36Å; F514-F568 HydrophobicContact CE1-CZ 3.36Å; F514-F568 HydrophobicContact CE2-CE2 4.35Å; F514-F568 HydrophobicContact CE2-CZ 4.22Å; F514-F568 HydrophobicContact CG-CZ 4.11Å; F514-F568 AromaticContact CZ-CE2 3.55Å; F514-F568 HydrophobicContact CZ-CE2 3.55Å; F514-F568 AromaticContact CZ-CZ 3.72Å; F514-F568 HydrophobicContact CZ-CZ 3.72Å
515	V	93.6	Very high	81.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	158.8	-169.9	-63.8	0	0	0	0	110.8	L506 Q513 A528 I530 V556 L557	L506-V515 HydrophobicContact CD1-CB 4.28Å; L506-V515 HydrophobicContact CD1-CG1 3.49Å; L506-V515 VanDerWaalsContact CD1-CG1 3.49Å; Q513-V515 HydrophobicContact CG-CG1 4.11Å; V515-A528 HydrophobicContact CG2-CB 4.22Å; V515-A528 PolarHBondContact N-O 3.26Å; V515-A528 PolarHBondContact O-N 3.43Å; V515-I530 HydrophobicContact CG1-CD1 3.86Å; V515-I530 HydrophobicContact CG1-CG1 4.09Å; V515-I530 HydrophobicContact CG2-CG1 3.99Å; V515-V556 HydrophobicContact CB-CG1 3.76Å; V515-V556 HydrophobicContact CG1-CG1 3.75Å; V515-V556 HydrophobicContact CG2-CG1 3.88Å; V515-L557 WeakPolarHBondContact CB-O 3.48Å
516	A	93.8	Very high	82.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.9	160.6	0	0	0	0	0	108.3	M492 Y496 I525 L526 L557 L559	M492-A516 HydrophobicContact CE-CB 3.72Å; Y496-A516 HydrophobicContact CD2-CB 4.49Å; Y496-A516 HydrophobicContact CE1-CB 4.13Å; Y496-A516 HydrophobicContact CE2-CB 3.82Å; A516-I525 HydrophobicContact CB-CG2 4Å; A516-L526 WeakPolarHBondContact CA-O 3.37Å; A516-L557 HydrophobicContact CB-CB 4.12Å; A516-L557 PolarHBondContact N-O 3.16Å; A516-L557 PolarHBondContact O-N 2.88Å; A516-L559 HydrophobicContact CB-CD1 4.2Å
517	A	92	Very high	83.6	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.7	-173.2	0	0	0	0	0	111.3	A519 L526 A528 Y542 I551	A517-A519 PolarHBondContact O-N 3.38Å; A517-L526 PolarHBondContact N-O 2.82Å; A517-L526 PolarHBondContact O-N 3.49Å; A517-A528 HydrophobicContact CB-CB 3.89Å; A517-Y542 HydrophobicContact CB-CE1 3.94Å; A517-I551 HydrophobicContact CB-CD1 3.78Å
518	R	89.7	Confident	84.8	Confident	54 Å²	54	41.1 Å²	41.1	20%	0.204	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	117.7	168.9	-74.1	172	-169.1	-84	-3.3	109.7	E524 I525 K555	R518-E524 CarbonylContact C-O 3.57Å; R518-E524 VanDerWaalsContact CA-O 3.31Å; R518-E524 WeakPolarHBondContact CA-O 3.45Å; R518-I525 HydrophobicContact CG-CD1 4.38Å; R518-I525 HydrophobicContact CG-CG1 3.79Å; R518-K555 HydrophobicContact CB-CB 4Å; R518-K555 HydrophobicContact CB-CD 4.2Å; R518-K555 HydrophobicContact CB-CG 4.15Å; R518-K555 PolarHBondContact N-O 2.85Å
519	A	80.1	Confident	85.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.214	C	C	.	.			trans	-66.5	152.1	174.8	0	0	0	0	0	111.8	A517 E523 E524 L526 Y542 K555	A517-A519 PolarHBondContact O-N 3.38Å; A519-E523 PolarHBondContact O-N 2.93Å; A519-E524 PolarHBondContact N-O 2.72Å; A519-L526 HydrophobicContact CB-CD1 4.47Å; A519-Y542 WeakPolarHBondContact CA-OH 3.39Å; A519-K555 PolarHBondContact O-NZ 2.93Å
520	E	69.3	Low	86	Confident	93 Å²	93	39 Å²	39	44%	0.435	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-31.4	-176.2	-80.9	-167.4	165.6	0	0	115.2	E549 I551 K555	E520-E549 PolarHBondContact N-OE2 3.37Å; E520-I551 HydrophobicContact CG-CG2 4.15Å; E520-K555 HydrophobicContact CG-CD 4.41Å
521	E	57.4	Low	86.1	Confident	88 Å²	88	38 Å²	38	41%	0.411	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-28.4	-172.1	-71.9	155.8	155.6	0	0	114.1	H81 K84 R88	H81-E521 IonicContact CE1-OE1 2.68Å; H81-E521 PolarHBondContact CE1-OE1 2.78Å; H81-E521 VanDerWaalsContact CE1-OE1 3.28Å; H81-E521 IonicContact ND1-OE1 3.55Å; H81-E521 PolarHBondContact ND1-OE1 3.2Å; K84-E521 WeakPolarHBondContact CE-OE2 3.2Å; K84-E521 IonicContact NZ-OE1 2.73Å; K84-E521 PolarHBondContact NZ-OE1 3.03Å; K84-E521 IonicContact NZ-OE2 3.57Å; K84-E521 PolarHBondContact NZ-OE2 3.48Å; R88-E521 IonicContact CZ-OE2 3.76Å; R88-E521 IonicContact NH1-OE2 2.72Å; R88-E521 PolarHBondContact NH1-OE2 3.44Å; R88-E521 IonicContact NH2-OE2 3.15Å; R88-E521 PolarHBondContact NH2-OE2 3.22Å
522	E	62.9	Low	86.2	Confident	88 Å²	88	36.7 Å²	36.7	41%	0.411	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-1.4	-167.7	-66	173.6	-113.8	0	0	113.5	R88 E524	R88-E522 WeakPolarHBondContact CD-OE1 3.47Å; R88-E522 IonicContact CZ-OE1 3.44Å; R88-E522 IonicContact NE-OE1 3.36Å; R88-E522 IonicContact NH1-OE1 2.68Å; R88-E522 PolarHBondContact NH1-OE1 3.05Å; E522-E524 HydrophobicContact CB-CG 4.02Å; E522-E524 PolarHBondContact O-N 3.16Å
523	E	70.9	Confident	86.4	Confident	94 Å²	94	37.5 Å²	37.5	44%	0.439	18%	0.18	S	C	.	.			trans	54.5	12.4	-175.1	-69.4	-68.5	150.8	0	0	115.5	A519 K555	A519-E523 PolarHBondContact O-N 2.93Å; E523-K555 VanDerWaalsContact OE1-CE 3.26Å; E523-K555 WeakPolarHBondContact OE1-CE 3.34Å; E523-K555 IonicContact OE1-NZ 2.81Å; E523-K555 PolarHBondContact OE1-NZ 2.91Å; E523-K555 IonicContact OE2-NZ 2.74Å
524	E	82.9	Confident	86.5	Confident	48 Å²	48	39.8 Å²	39.8	22%	0.224	19%	0.192	C	C	.	.			trans	-61.2	146	171.3	-64.4	-170.2	136.8	0	0	111.7	R518 A519 E522 L526	R518-E524 CarbonylContact C-O 3.57Å; R518-E524 VanDerWaalsContact CA-O 3.31Å; R518-E524 WeakPolarHBondContact CA-O 3.45Å; A519-E524 PolarHBondContact N-O 2.72Å; E522-E524 HydrophobicContact CB-CG 4.02Å; E522-E524 PolarHBondContact O-N 3.16Å; E524-L526 HydrophobicContact CB-CD2 4.28Å; E524-L526 HydrophobicContact CB-CG 4.34Å
525	I	89.3	Confident	86.2	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.062	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	105.1	-174.3	-55.8	174.4	0	0	0	108.2	M492 Y496 A516 R518	M492-I525 HydrophobicContact CE-CG2 4.2Å; Y496-I525 HydrophobicContact CD2-CG2 3.77Å; Y496-I525 HydrophobicContact CE2-CG2 4.39Å; Y496-I525 HydrophobicContact CG-CD1 4.38Å; Y496-I525 HydrophobicContact CG-CG2 4.02Å; A516-I525 HydrophobicContact CB-CG2 4Å; R518-I525 HydrophobicContact CG-CD1 4.38Å; R518-I525 HydrophobicContact CG-CG1 3.79Å
526	L	91.8	Very high	86	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	156.4	-169.2	-54.7	174.8	0	0	0	110.5	E489 A516 A517 A519 E524 Y542	E489-L526 HydrophobicContact CG-CD2 4.14Å; A516-L526 WeakPolarHBondContact CA-O 3.37Å; A517-L526 PolarHBondContact N-O 2.82Å; A517-L526 PolarHBondContact O-N 3.49Å; A519-L526 HydrophobicContact CB-CD1 4.47Å; E524-L526 HydrophobicContact CB-CD2 4.28Å; E524-L526 HydrophobicContact CB-CG 4.34Å; L526-Y542 HydrophobicContact CB-CD1 3.64Å; L526-Y542 HydrophobicContact CB-CE1 3.84Å; L526-Y542 HydrophobicContact CD1-CD1 3.88Å; L526-Y542 HydrophobicContact CD1-CE1 3.98Å; L526-Y542 HydrophobicContact CG-CD1 4.4Å; L526-Y542 HydrophobicContact CG-CE1 4.43Å
527	R	94.7	Very high	85.9	Confident	1 Å²	1	51.4 Å²	51.4	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	134.7	170.1	-55.3	-167.1	-62.4	175.2	-0.6	109.5	M488 M492 V543 D544 L559 F563 L566 P567	M488-R527 HydrophobicContact CE-CG 4.1Å; M488-R527 HydrophobicContact SD-CG 4.04Å; M492-R527 HydrophobicContact CE-CG 3.97Å; M492-R527 HydrophobicContact SD-CG 3.51Å; M492-R527 VanDerWaalsContact SD-CG 3.51Å; R527-V543 HydrophobicContact CB-CG2 3.62Å; R527-V543 PolarHBondContact O-N 2.87Å; R527-D544 IonicContact CZ-OD1 2.63Å; R527-D544 IonicContact CZ-OD2 3.96Å; R527-D544 VanDerWaalsContact CZ-OD2 3.29Å; R527-D544 IonicContact NE-OD1 3.68Å; R527-D544 IonicContact NE-OD2 3.13Å; R527-D544 PolarHBondContact NE-OD2 3.07Å; R527-D544 IonicContact NH2-OD1 3.13Å; R527-D544 PolarHBondContact NH2-OD1 3.22Å; R527-D544 IonicContact NH2-OD2 3.94Å; R527-D544 PolarHBondContact NH2-OD2 3.23Å; R527-L559 HydrophobicContact CG-CD1 4.01Å; R527-L559 HydrophobicContact CG-CD2 4.5Å; R527-F563 WeakPolarHBondContact CD-O 3.48Å; R527-F563 PolarHBondContact NH1-O 3.22Å; R527-L566 PolarHBondContact NH1-O 3.07Å; R527-L566 PolarHBondContact NH2-O 2.88Å; R527-P567 PolarHBondContact NH2-O 2.64Å
528	A	94.4	Very high	85.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.4	177.7	0	0	0	0	0	112.3	F514 V515 A517 V540 Y541 Y542	F514-A528 WeakPolarHBondContact CA-O 3.25Å; V515-A528 HydrophobicContact CG2-CB 4.22Å; V515-A528 PolarHBondContact N-O 3.26Å; V515-A528 PolarHBondContact O-N 3.43Å; A517-A528 HydrophobicContact CB-CB 3.89Å; A528-V540 HydrophobicContact CB-CB 4.03Å; A528-V540 HydrophobicContact CB-CG2 4.45Å; A528-Y541 CarbonylContact C-O 3.46Å; A528-Y541 VanDerWaalsContact CA-O 3.23Å; A528-Y541 WeakPolarHBondContact CA-O 3.25Å; A528-Y542 HydrophobicContact CB-CD1 3.92Å; A528-Y542 HydrophobicContact CB-CE1 4.2Å
529	Q	95.1	Very high	86.1	Confident	60 Å²	60	51.5 Å²	51.5	28%	0.28	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	134.7	169.5	-168.6	176	28.2	0	0	109.4	G512 Q513 F514 C531 V540 Y541 V543	G512-Q529 WeakPolarHBondContact O-CG 3.4Å; G512-Q529 PolarHBondContact O-NE2 2.98Å; Q513-Q529 WeakPolarHBondContact O-CA 3.43Å; F514-Q529 HydrophobicContact CD1-CB 3.81Å; F514-Q529 HydrophobicContact CD1-CG 3.86Å; F514-Q529 HydrophobicContact CE1-CB 3.8Å; F514-Q529 VanDerWaalsContact CE1-CD 3.49Å; F514-Q529 HydrophobicContact CE1-CG 3.66Å; F514-Q529 HydrophobicContact CZ-CG 4.46Å; Q529-C531 PolarHBondContact O-N 3.1Å; Q529-V540 CarbonylContact O-C 3.46Å; Q529-V540 VanDerWaalsContact O-CA 3.25Å; Q529-V540 WeakPolarHBondContact O-CA 3.43Å; Q529-Y541 PolarHBondContact N-O 3.38Å; Q529-Y541 PolarHBondContact O-N 3.42Å; Q529-V543 HydrophobicContact CB-CG1 4Å
530	I	94.6	Very high	86.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	114.1	172.8	-60.8	-179.7	0	0	0	108.8	T509 S510 G512 Q513 V515 V533 V538 V540 V556	T509-I530 HydrophobicContact CG2-CD1 3.79Å; S510-I530 WeakPolarHBondContact O-CB 3.34Å; S510-I530 WeakPolarHBondContact O-CG2 3.44Å; G512-I530 PolarHBondContact N-O 3.18Å; Q513-I530 HydrophobicContact CB-CD1 4.39Å; Q513-I530 PolarHBondContact O-N 2.86Å; V515-I530 HydrophobicContact CG1-CD1 3.86Å; V515-I530 HydrophobicContact CG1-CG1 4.09Å; V515-I530 HydrophobicContact CG2-CG1 3.99Å; I530-V533 HydrophobicContact CG2-CG2 3.69Å; I530-V538 HydrophobicContact CG2-CB 4.33Å; I530-V538 HydrophobicContact CG2-CG1 4.25Å; I530-V540 HydrophobicContact CG1-CG1 4.38Å; I530-V556 HydrophobicContact CD1-CG1 4.28Å
531	C	90.9	Very high	87.8	Confident	44 Å²	44	49.3 Å²	49.3	30%	0.297	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-50.5	176.1	-59.9	0	0	0	0	111.1	S511 Q529 K539 Y541	S511-C531 PolarHBondContact OG-O 3.03Å; Q529-C531 PolarHBondContact O-N 3.1Å; C531-K539 HydrophobicContact CB-CD 4.42Å; C531-K539 HydrophobicContact CB-CG 4.37Å; C531-K539 PolarHBondContact N-O 3.32Å; C531-Y541 WeakPolarHBondContact SG-CB 3.39Å
532	E	93.4	Very high	89.5	Confident	58 Å²	58	45.1 Å²	45.1	27%	0.271	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	136.2	-177.1	-173.6	176.8	-167.2	0	0	110.4	R423 V538 K539	R423-E532 IonicContact CZ-OE1 3.66Å; R423-E532 IonicContact NE-OE1 3.35Å; R423-E532 PolarHBondContact NE-OE1 3.31Å; R423-E532 IonicContact NH2-OE1 2.83Å; R423-E532 PolarHBondContact NH2-OE1 2.99Å; E532-V538 CarbonylContact O-C 3.6Å; E532-V538 WeakPolarHBondContact O-CA 3.5Å; E532-K539 HydrophobicContact CB-CB 3.98Å; E532-K539 PolarHBondContact N-O 3.29Å; E532-K539 PolarHBondContact O-N 2.97Å
533	V	93.5	Very high	91	Very high	51 Å²	51	41.1 Å²	41.1	31%	0.309	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.2	175.6	-178	0	0	0	0	109	I530 V538	I530-V533 HydrophobicContact CG2-CG2 3.69Å; V533-V538 HydrophobicContact CG1-CG1 4.4Å; V533-V538 HydrophobicContact CG2-CG1 4.35Å
534	M	93.1	Very high	92	Very high	90 Å²	90	36.7 Å²	36.7	44%	0.443	19%	0.193	S	C	.	.			trans	-103.5	-173.1	173.9	-49.1	178.5	76.1	0	0	109.5	K537 V550 K553	M534-K537 CarbonylContact C-O 3.53Å; M534-K537 WeakPolarHBondContact CA-O 3Å; M534-K537 HydrophobicContact CB-CB 4.39Å; M534-K537 VanDerWaalsContact CB-O 3.31Å; M534-K537 WeakPolarHBondContact CB-O 3.35Å; M534-K537 PolarHBondContact N-O 3.06Å; M534-K537 HydrophobicContact SD-CB 4.3Å; M534-V550 HydrophobicContact SD-CG1 4Å; M534-K553 WeakPolarHBondContact O-CE 2.94Å; M534-K553 PolarHBondContact O-NZ 2.77Å
535	S	86.8	Confident	92.1	Very high	113 Å²	113	34.5 Å²	34.5	79%	0.79	18%	0.183	S	C	*	.	S	Bend	trans	-64.2	-59.9	-177.7	-53.3	0	0	0	0	112.6	K553	S535-K553 PolarHBondContact O-NZ 3.13Å
536	D	88.4	Confident	91.9	Very high	100 Å²	100	34 Å²	34	54%	0.535	18%	0.18	S	C	.	.	S	Bend	trans	-106.4	-18.1	-178.6	63.5	-41.2	0	0	0	113.1	K553	D536-K553 WeakPolarHBondContact O-CB 3.25Å; D536-K553 WeakPolarHBondContact O-CG 3.21Å; D536-K553 PolarHBondContact O-N 3.37Å
537	K	92.7	Very high	91.5	Very high	83 Å²	83	34.7 Å²	34.7	36%	0.361	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	167.7	-176.4	-61.3	-172.7	-174.9	-163.9	0	112.9	M534 V550 I551	M534-K537 CarbonylContact C-O 3.53Å; M534-K537 WeakPolarHBondContact CA-O 3Å; M534-K537 HydrophobicContact CB-CB 4.39Å; M534-K537 VanDerWaalsContact CB-O 3.31Å; M534-K537 WeakPolarHBondContact CB-O 3.35Å; M534-K537 PolarHBondContact N-O 3.06Å; M534-K537 HydrophobicContact SD-CB 4.3Å; K537-V550 HydrophobicContact CB-CG1 3.95Å; K537-V550 HydrophobicContact CD-CG1 3.97Å; K537-I551 CarbonylContact C-O 3.51Å; K537-I551 VanDerWaalsContact CA-O 3.23Å; K537-I551 WeakPolarHBondContact CA-O 3.33Å; K537-I551 VanDerWaalsContact CB-O 3.32Å; K537-I551 WeakPolarHBondContact CB-O 3.39Å
538	V	92.9	Very high	91.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144	166.6	-71	0	0	0	0	109.3	I530 E532 V533 V540 V550 I551 K553 V556	I530-V538 HydrophobicContact CG2-CB 4.33Å; I530-V538 HydrophobicContact CG2-CG1 4.25Å; E532-V538 CarbonylContact O-C 3.6Å; E532-V538 WeakPolarHBondContact O-CA 3.5Å; V533-V538 HydrophobicContact CG1-CG1 4.4Å; V533-V538 HydrophobicContact CG2-CG1 4.35Å; V538-V540 HydrophobicContact CB-CG1 4.42Å; V538-V540 HydrophobicContact CG2-CG1 3.78Å; V538-V550 CarbonylContact O-C 3.53Å; V538-V550 WeakPolarHBondContact O-CA 3.45Å; V538-I551 HydrophobicContact CG2-CD1 4.47Å; V538-I551 HydrophobicContact CG2-CG1 3.8Å; V538-I551 PolarHBondContact N-O 2.89Å; V538-I551 PolarHBondContact O-N 3.15Å; V538-K553 HydrophobicContact CG1-CG 3.93Å; V538-V556 HydrophobicContact CG2-CG2 3.53Å
539	K	93.9	Very high	90.8	Very high	56 Å²	56	38.4 Å²	38.4	24%	0.243	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	121.7	163.3	-173.7	-176.3	177.2	-171.3	0	107.8	C531 E532 E549 V550	C531-K539 HydrophobicContact CB-CD 4.42Å; C531-K539 HydrophobicContact CB-CG 4.37Å; C531-K539 PolarHBondContact N-O 3.32Å; E532-K539 HydrophobicContact CB-CB 3.98Å; E532-K539 PolarHBondContact N-O 3.29Å; E532-K539 PolarHBondContact O-N 2.97Å; K539-E549 CarbonylContact C-O 3.44Å; K539-E549 WeakPolarHBondContact CA-O 3.34Å; K539-V550 HydrophobicContact CB-CG2 4.15Å; K539-V550 HydrophobicContact CG-CG2 4.1Å
540	V	92.6	Very high	90.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	148.5	178.2	-62.8	0	0	0	0	110.9	A528 Q529 I530 V538 Y542 S548 E549 I551	A528-V540 HydrophobicContact CB-CB 4.03Å; A528-V540 HydrophobicContact CB-CG2 4.45Å; Q529-V540 CarbonylContact O-C 3.46Å; Q529-V540 VanDerWaalsContact O-CA 3.25Å; Q529-V540 WeakPolarHBondContact O-CA 3.43Å; I530-V540 HydrophobicContact CG1-CG1 4.38Å; V538-V540 HydrophobicContact CB-CG1 4.42Å; V538-V540 HydrophobicContact CG2-CG1 3.78Å; V540-Y542 HydrophobicContact CG2-CD2 4.49Å; V540-Y542 HydrophobicContact CG2-CE2 3.91Å; V540-S548 CarbonylContact O-C 3.48Å; V540-S548 WeakPolarHBondContact O-CA 3.42Å; V540-E549 HydrophobicContact CG2-CB 4.47Å; V540-E549 PolarHBondContact N-O 3.23Å; V540-E549 PolarHBondContact O-N 3.33Å; V540-I551 HydrophobicContact CG1-CD1 4.04Å; V540-I551 HydrophobicContact CG1-CG1 4.21Å; V540-I551 HydrophobicContact CG2-CD1 3.89Å; V540-I551 HydrophobicContact CG2-CG1 4.11Å; V540-I551 HydrophobicContact CG2-CG2 4.44Å
541	Y	91.8	Very high	90.5	Very high	48 Å²	48	38.5 Å²	38.5	19%	0.188	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.9	167.9	173.4	-102.1	0	0	0	108.9	A528 Q529 C531 V543 G546	A528-Y541 CarbonylContact C-O 3.46Å; A528-Y541 VanDerWaalsContact CA-O 3.23Å; A528-Y541 WeakPolarHBondContact CA-O 3.25Å; Q529-Y541 PolarHBondContact N-O 3.38Å; Q529-Y541 PolarHBondContact O-N 3.42Å; C531-Y541 WeakPolarHBondContact SG-CB 3.39Å; Y541-V543 HydrophobicContact CD1-CG1 4.03Å; Y541-V543 HydrophobicContact CE1-CG1 4.4Å; Y541-V543 PolarHBondContact O-N 3.14Å; Y541-V543 VanDerWaalsContact O-N 3.16Å; Y541-G546 VanDerWaalsContact CE2-C 3.49Å
542	Y	92.4	Very high	90.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.			trans	-78.8	100.8	179.6	-69.1	-79.9	0	0	0	109.5	A517 A519 L526 A528 V540 D544 H545 G546 F547 E549	A517-Y542 HydrophobicContact CB-CE1 3.94Å; A519-Y542 WeakPolarHBondContact CA-OH 3.39Å; L526-Y542 HydrophobicContact CB-CD1 3.64Å; L526-Y542 HydrophobicContact CB-CE1 3.84Å; L526-Y542 HydrophobicContact CD1-CD1 3.88Å; L526-Y542 HydrophobicContact CD1-CE1 3.98Å; L526-Y542 HydrophobicContact CG-CD1 4.4Å; L526-Y542 HydrophobicContact CG-CE1 4.43Å; A528-Y542 HydrophobicContact CB-CD1 3.92Å; A528-Y542 HydrophobicContact CB-CE1 4.2Å; V540-Y542 HydrophobicContact CG2-CD2 4.49Å; V540-Y542 HydrophobicContact CG2-CE2 3.91Å; Y542-D544 PolarHBondContact O-N 3.02Å; Y542-H545 PolarHBondContact O-N 2.87Å; Y542-G546 PolarHBondContact O-N 3.42Å; Y542-F547 AromaticContact CD2-CD2 3.81Å; Y542-F547 HydrophobicContact CD2-CD2 3.81Å; Y542-F547 HydrophobicContact CD2-CE1 4.02Å; Y542-F547 AromaticContact CD2-CE2 3.21Å; Y542-F547 HydrophobicContact CD2-CE2 3.21Å; Y542-F547 HydrophobicContact CD2-CG 4.42Å; Y542-F547 AromaticContact CD2-CZ 3.3Å; Y542-F547 HydrophobicContact CD2-CZ 3.3Å; Y542-F547 HydrophobicContact CE2-CD2 4.33Å; Y542-F547 AromaticContact CE2-CE2 3.46Å; Y542-F547 HydrophobicContact CE2-CE2 3.46Å; Y542-F547 VanDerWaalsContact CE2-CE2 3.46Å; Y542-F547 AromaticContact CE2-CZ 3.72Å; Y542-F547 HydrophobicContact CE2-CZ 3.72Å; Y542-F547 HydrophobicContact CG-CE1 4.28Å; Y542-F547 HydrophobicContact CG-CE2 4.21Å; Y542-F547 AromaticContact CG-CZ 3.88Å; Y542-F547 HydrophobicContact CG-CZ 3.88Å; Y542-F547 PolarHBondContact N-O 3.02Å; Y542-E549 HydrophobicContact CD2-CB 4.49Å; Y542-E549 HydrophobicContact CE2-CB 3.7Å; Y542-E549 PolarHBondContact OH-OE2 2.61Å
543	V	94	Very high	90.4	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.024	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.8	-167.6	-65.3	0	0	0	0	114.3	F514 R527 Q529 Y541 F568 A570	F514-V543 HydrophobicContact CD1-CG1 4.49Å; F514-V543 HydrophobicContact CE1-CG1 4.32Å; R527-V543 HydrophobicContact CB-CG2 3.62Å; R527-V543 PolarHBondContact O-N 2.87Å; Q529-V543 HydrophobicContact CB-CG1 4Å; Y541-V543 HydrophobicContact CD1-CG1 4.03Å; Y541-V543 HydrophobicContact CE1-CG1 4.4Å; Y541-V543 PolarHBondContact O-N 3.14Å; Y541-V543 VanDerWaalsContact O-N 3.16Å; V543-F568 HydrophobicContact CB-CB 4.07Å; V543-F568 HydrophobicContact CB-CD1 3.65Å; V543-F568 HydrophobicContact CB-CD2 4.17Å; V543-F568 HydrophobicContact CB-CE1 4.07Å; V543-F568 HydrophobicContact CB-CG 3.71Å; V543-F568 HydrophobicContact CB-CZ 4.47Å; V543-F568 HydrophobicContact CG1-CD1 4.37Å; V543-F568 HydrophobicContact CG1-CD2 4.34Å; V543-F568 HydrophobicContact CG1-CE1 4.37Å; V543-F568 HydrophobicContact CG1-CE2 4.33Å; V543-F568 HydrophobicContact CG1-CG 4.36Å; V543-F568 HydrophobicContact CG1-CZ 4.33Å; V543-F568 HydrophobicContact CG2-CD1 3.32Å; V543-F568 HydrophobicContact CG2-CE1 3.55Å; V543-F568 HydrophobicContact CG2-CG 3.95Å; V543-F568 HydrophobicContact CG2-CZ 4.3Å; V543-A570 VanDerWaalsContact O-CB 3.32Å; V543-A570 WeakPolarHBondContact O-CB 3.37Å; V543-A570 PolarHBondContact O-N 3.26Å; V543-A570 VanDerWaalsContact O-N 3.1Å
544	D	91.8	Very high	90.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-7.4	178.6	-61.6	-50.1	0	0	0	114.5	R475 Q485 R527 Y542 F568 Q569	R475-D544 WeakPolarHBondContact CD-O 3.29Å; Q485-D544 HydrophobicContact CG-CB 4.3Å; Q485-D544 PolarHBondContact NE2-O 3.49Å; Q485-D544 PolarHBondContact OE1-O 3.08Å; R527-D544 IonicContact CZ-OD1 2.63Å; R527-D544 IonicContact CZ-OD2 3.96Å; R527-D544 VanDerWaalsContact CZ-OD2 3.29Å; R527-D544 IonicContact NE-OD1 3.68Å; R527-D544 IonicContact NE-OD2 3.13Å; R527-D544 PolarHBondContact NE-OD2 3.07Å; R527-D544 IonicContact NH2-OD1 3.13Å; R527-D544 PolarHBondContact NH2-OD1 3.22Å; R527-D544 IonicContact NH2-OD2 3.94Å; R527-D544 PolarHBondContact NH2-OD2 3.23Å; Y542-D544 PolarHBondContact O-N 3.02Å; D544-F568 WeakPolarHBondContact OD1-CA 3.19Å; D544-Q569 HydrophobicContact CB-CB 4.1Å; D544-Q569 HydrophobicContact CB-CG 4.45Å; D544-Q569 WeakPolarHBondContact OD1-CG 3.34Å; D544-Q569 PolarHBondContact OD1-N 3.32Å
545	H	86.2	Confident	90.1	Very high	3 Å²	3	36.5 Å²	36.5	1%	0.014	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-21	-179.1	-52.7	-98.4	0	0	0	112.8	M464 Q485 E489 Y542 F547	M464-H545 WeakPolarHBondContact CE-O 3.37Å; M464-H545 WeakPolarHBondContact CG-O 3.23Å; Q485-H545 PolarHBondContact NE2-CE1 3.1Å; E489-H545 IonicContact OE1-CE1 3.28Å; E489-H545 PolarHBondContact OE1-CE1 2.63Å; E489-H545 IonicContact OE1-NE2 2.61Å; E489-H545 PolarHBondContact OE1-NE2 2.94Å; E489-H545 VanDerWaalsContact OE1-NE2 3.13Å; E489-H545 IonicContact OE2-CE1 2.83Å; Y542-H545 PolarHBondContact O-N 2.87Å; H545-F547 HydrophobicContact CB-CD1 3.53Å; H545-F547 HydrophobicContact CB-CE1 3.41Å; H545-F547 VanDerWaalsContact CB-CE1 3.41Å; H545-F547 AromaticContact CG-CE1 3.98Å
546	G	85.1	Confident	90.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.			trans	83.2	16.3	171.1	0	0	0	0	0	115.7	I473 Y541 Y542 A570	I473-G546 WeakPolarHBondContact CD1-O 3.5Å; Y541-G546 VanDerWaalsContact CE2-C 3.49Å; Y542-G546 PolarHBondContact O-N 3.42Å; G546-A570 VanDerWaalsContact CA-CB 3.44Å
547	F	84.1	Confident	90.4	Very high	18 Å²	18	26.6 Å²	26.6	8%	0.079	14%	0.142	C	C	.	.			trans	-119	158.2	176.4	71.5	-88.4	0	0	0	111.9	Y542 H545 E549	Y542-F547 AromaticContact CD2-CD2 3.81Å; Y542-F547 HydrophobicContact CD2-CD2 3.81Å; Y542-F547 HydrophobicContact CD2-CE1 4.02Å; Y542-F547 AromaticContact CD2-CE2 3.21Å; Y542-F547 HydrophobicContact CD2-CE2 3.21Å; Y542-F547 HydrophobicContact CD2-CG 4.42Å; Y542-F547 AromaticContact CD2-CZ 3.3Å; Y542-F547 HydrophobicContact CD2-CZ 3.3Å; Y542-F547 HydrophobicContact CE2-CD2 4.33Å; Y542-F547 AromaticContact CE2-CE2 3.46Å; Y542-F547 HydrophobicContact CE2-CE2 3.46Å; Y542-F547 VanDerWaalsContact CE2-CE2 3.46Å; Y542-F547 AromaticContact CE2-CZ 3.72Å; Y542-F547 HydrophobicContact CE2-CZ 3.72Å; Y542-F547 HydrophobicContact CG-CE1 4.28Å; Y542-F547 HydrophobicContact CG-CE2 4.21Å; Y542-F547 AromaticContact CG-CZ 3.88Å; Y542-F547 HydrophobicContact CG-CZ 3.88Å; Y542-F547 PolarHBondContact N-O 3.02Å; H545-F547 HydrophobicContact CB-CD1 3.53Å; H545-F547 HydrophobicContact CB-CE1 3.41Å; H545-F547 VanDerWaalsContact CB-CE1 3.41Å; H545-F547 AromaticContact CG-CE1 3.98Å; F547-E549 HydrophobicContact CE2-CB 4.36Å
548	S	85.7	Confident	90.3	Very high	58 Å²	58	29.7 Å²	29.7	41%	0.406	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	146.8	172.7	-60.4	0	0	0	0	112.3	V540	V540-S548 CarbonylContact O-C 3.48Å; V540-S548 WeakPolarHBondContact O-CA 3.42Å
549	E	88.2	Confident	90.3	Very high	20 Å²	20	30.1 Å²	30.1	9%	0.093	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	159.9	174.5	-167.3	159.6	-103.9	0	0	110.3	K84 E520 K539 V540 Y542 F547 I551	K84-E549 WeakPolarHBondContact CE-OE1 3.43Å; K84-E549 IonicContact NZ-OE1 2.84Å; K84-E549 PolarHBondContact NZ-OE1 2.65Å; E520-E549 PolarHBondContact N-OE2 3.37Å; K539-E549 CarbonylContact C-O 3.44Å; K539-E549 WeakPolarHBondContact CA-O 3.34Å; V540-E549 HydrophobicContact CG2-CB 4.47Å; V540-E549 PolarHBondContact N-O 3.23Å; V540-E549 PolarHBondContact O-N 3.33Å; Y542-E549 HydrophobicContact CD2-CB 4.49Å; Y542-E549 HydrophobicContact CE2-CB 3.7Å; Y542-E549 PolarHBondContact OH-OE2 2.61Å; F547-E549 HydrophobicContact CE2-CB 4.36Å; E549-I551 HydrophobicContact CB-CG2 4.3Å; E549-I551 HydrophobicContact CG-CG2 3.83Å
550	V	92.1	Very high	90.2	Very high	62 Å²	62	30.7 Å²	30.7	38%	0.376	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	109	173.5	-178.9	0	0	0	0	108.2	M534 K537 V538 K539	M534-V550 HydrophobicContact SD-CG1 4Å; K537-V550 HydrophobicContact CB-CG1 3.95Å; K537-V550 HydrophobicContact CD-CG1 3.97Å; V538-V550 CarbonylContact O-C 3.53Å; V538-V550 WeakPolarHBondContact O-CA 3.45Å; K539-V550 HydrophobicContact CB-CG2 4.15Å; K539-V550 HydrophobicContact CG-CG2 4.1Å
551	I	91.4	Very high	90	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	159	-173	66	174.6	0	0	0	111.6	A517 E520 K537 V538 V540 E549 K555 V556	A517-I551 HydrophobicContact CB-CD1 3.78Å; E520-I551 HydrophobicContact CG-CG2 4.15Å; K537-I551 CarbonylContact C-O 3.51Å; K537-I551 VanDerWaalsContact CA-O 3.23Å; K537-I551 WeakPolarHBondContact CA-O 3.33Å; K537-I551 VanDerWaalsContact CB-O 3.32Å; K537-I551 WeakPolarHBondContact CB-O 3.39Å; V538-I551 HydrophobicContact CG2-CD1 4.47Å; V538-I551 HydrophobicContact CG2-CG1 3.8Å; V538-I551 PolarHBondContact N-O 2.89Å; V538-I551 PolarHBondContact O-N 3.15Å; V540-I551 HydrophobicContact CG1-CD1 4.04Å; V540-I551 HydrophobicContact CG1-CG1 4.21Å; V540-I551 HydrophobicContact CG2-CD1 3.89Å; V540-I551 HydrophobicContact CG2-CG1 4.11Å; V540-I551 HydrophobicContact CG2-CG2 4.44Å; E549-I551 HydrophobicContact CB-CG2 4.3Å; E549-I551 HydrophobicContact CG-CG2 3.83Å; I551-K555 HydrophobicContact CD1-CB 4.24Å; I551-V556 HydrophobicContact CD1-CG2 4.11Å; I551-V556 HydrophobicContact CG1-CG2 4.46Å
552	S	91.9	Very high	90	Very high	38 Å²	38	37.1 Å²	37.1	27%	0.266	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	142.1	170.4	177.5	0	0	0	0	111.8	S554 K555	S552-S554 WeakPolarHBondContact CB-OG 3.18Å; S552-S554 PolarHBondContact O-N 2.98Å; S552-S554 VanDerWaalsContact O-N 3.14Å; S552-S554 PolarHBondContact OG-N 2.84Å; S552-S554 PolarHBondContact OG-OG 2.89Å; S552-K555 WeakPolarHBondContact O-CB 3.43Å; S552-K555 PolarHBondContact O-N 2.93Å
553	K	90.9	Very high	90.1	Very high	57 Å²	57	37.3 Å²	37.3	25%	0.248	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-55.8	-28.4	171.1	-77.4	176.5	178.1	174.8	0	113.3	M534 S535 D536 V538 K555 V556	M534-K553 WeakPolarHBondContact O-CE 2.94Å; M534-K553 PolarHBondContact O-NZ 2.77Å; S535-K553 PolarHBondContact O-NZ 3.13Å; D536-K553 WeakPolarHBondContact O-CB 3.25Å; D536-K553 WeakPolarHBondContact O-CG 3.21Å; D536-K553 PolarHBondContact O-N 3.37Å; V538-K553 HydrophobicContact CG1-CG 3.93Å; K553-K555 PolarHBondContact O-N 3.03Å; K553-V556 WeakPolarHBondContact O-CB 3.27Å; K553-V556 PolarHBondContact O-N 3.26Å
554	S	88.9	Confident	90.1	Very high	75 Å²	75	37.8 Å²	37.8	52%	0.524	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-64.9	-16.4	175.5	63.1	0	0	0	0	114.2	S552	S552-S554 WeakPolarHBondContact CB-OG 3.18Å; S552-S554 PolarHBondContact O-N 2.98Å; S552-S554 VanDerWaalsContact O-N 3.14Å; S552-S554 PolarHBondContact OG-N 2.84Å; S552-S554 PolarHBondContact OG-OG 2.89Å
555	K	90.1	Very high	90.1	Very high	32 Å²	32	45.5 Å²	45.5	14%	0.139	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-92.3	3.5	178	-71.6	-168.4	161.5	-158.1	0	113.5	R518 A519 E520 E523 I551 S552 K553	R518-K555 HydrophobicContact CB-CB 4Å; R518-K555 HydrophobicContact CB-CD 4.2Å; R518-K555 HydrophobicContact CB-CG 4.15Å; R518-K555 PolarHBondContact N-O 2.85Å; A519-K555 PolarHBondContact O-NZ 2.93Å; E520-K555 HydrophobicContact CG-CD 4.41Å; E523-K555 VanDerWaalsContact OE1-CE 3.26Å; E523-K555 WeakPolarHBondContact OE1-CE 3.34Å; E523-K555 IonicContact OE1-NZ 2.81Å; E523-K555 PolarHBondContact OE1-NZ 2.91Å; E523-K555 IonicContact OE2-NZ 2.74Å; I551-K555 HydrophobicContact CD1-CB 4.24Å; S552-K555 WeakPolarHBondContact O-CB 3.43Å; S552-K555 PolarHBondContact O-N 2.93Å; K553-K555 PolarHBondContact O-N 3.03Å
556	V	91.1	Very high	90.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.6	-174.5	-169.1	0	0	0	0	110.1	P505 L506 T509 V515 I530 V538 I551 K553	P505-V556 WeakPolarHBondContact CA-O 3.18Å; L506-V556 HydrophobicContact CB-CG1 4.46Å; L506-V556 HydrophobicContact CD1-CG1 3.97Å; L506-V556 PolarHBondContact N-O 3.47Å; T509-V556 HydrophobicContact CG2-CG1 4.41Å; V515-V556 HydrophobicContact CB-CG1 3.76Å; V515-V556 HydrophobicContact CG1-CG1 3.75Å; V515-V556 HydrophobicContact CG2-CG1 3.88Å; I530-V556 HydrophobicContact CD1-CG1 4.28Å; V538-V556 HydrophobicContact CG2-CG2 3.53Å; I551-V556 HydrophobicContact CD1-CG2 4.11Å; I551-V556 HydrophobicContact CG1-CG2 4.46Å; K553-V556 WeakPolarHBondContact O-CB 3.27Å; K553-V556 PolarHBondContact O-N 3.26Å
557	L	91.1	Very high	91	Very high	5 Å²	5	48 Å²	48	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	154.5	-175.9	-59.3	173.8	0	0	0	110.2	Y496 L506 V515 A516 L559	Y496-L557 HydrophobicContact CD1-CD1 4Å; Y496-L557 HydrophobicContact CE1-CB 4.39Å; L506-L557 WeakPolarHBondContact CD1-O 3.2Å; V515-L557 WeakPolarHBondContact CB-O 3.48Å; A516-L557 HydrophobicContact CB-CB 4.12Å; A516-L557 PolarHBondContact N-O 3.16Å; A516-L557 PolarHBondContact O-N 2.88Å; L557-L559 PolarHBondContact O-N 3.49Å
558	E	90.9	Very high	91.5	Very high	147 Å²	147	49.3 Å²	49.3	69%	0.687	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.5	131.7	173.7	-175.5	170.6	-165.8	0	0	110.7	Y496 L506 H560	Y496-E558 WeakPolarHBondContact CE1-O 3.43Å; Y496-E558 PolarHBondContact OH-O 3.27Å; L506-E558 HydrophobicContact CG-CB 4.48Å; E558-H560 PolarHBondContact O-N 2.98Å
559	L	91.9	Very high	91.9	Very high	10 Å²	10	46.6 Å²	46.6	5%	0.052	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-77.6	118.7	174.8	-172.2	59.4	0	0	0	109.1	M492 Y496 F514 A516 R527 L557 F563 F564	M492-L559 HydrophobicContact CE-CD1 3.89Å; Y496-L559 WeakPolarHBondContact OH-CA 3.43Å; F514-L559 HydrophobicContact CB-CD2 4.1Å; A516-L559 HydrophobicContact CB-CD1 4.2Å; R527-L559 HydrophobicContact CG-CD1 4.01Å; R527-L559 HydrophobicContact CG-CD2 4.5Å; L557-L559 PolarHBondContact O-N 3.49Å; L559-F563 HydrophobicContact CD1-CB 3.79Å; L559-F563 HydrophobicContact CD1-CD2 4.24Å; L559-F563 HydrophobicContact CD1-CG 4.39Å; L559-F563 HydrophobicContact CG-CB 4.34Å; L559-F564 HydrophobicContact CB-CE2 3.9Å; L559-F564 HydrophobicContact CB-CZ 4.07Å; L559-F564 HydrophobicContact CD2-CD2 4.24Å; L559-F564 HydrophobicContact CD2-CE1 4.23Å; L559-F564 HydrophobicContact CD2-CE2 3.76Å; L559-F564 HydrophobicContact CD2-CZ 3.75Å; L559-F564 HydrophobicContact CG-CD2 4.21Å; L559-F564 HydrophobicContact CG-CE2 3.63Å; L559-F564 HydrophobicContact CG-CZ 4.03Å; L559-F564 WeakPolarHBondContact O-CE2 3.01Å
560	H	91.4	Very high	92.1	Very high	67 Å²	67	46.3 Å²	46.3	31%	0.31	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-73.9	140.3	-177.6	-175.4	-81.3	0	0	0	111.3	F495 Y496 E558 K562 F563	F495-H560 HydrophobicContact CE1-CB 3.82Å; F495-H560 HydrophobicContact CZ-CB 4.05Å; F495-H560 AromaticContact CZ-CD2 3.42Å; F495-H560 VanDerWaalsContact CZ-CD2 3.42Å; F495-H560 WeakPolarHBondContact CZ-CD2 3.47Å; F495-H560 AromaticContact CZ-CG 3.7Å; Y496-H560 PolarHBondContact OH-N 2.88Å; E558-H560 PolarHBondContact O-N 2.98Å; H560-K562 PolarHBondContact ND1-N 3.03Å; H560-K562 PolarHBondContact O-N 3.31Å; H560-F563 HydrophobicContact CB-CD2 3.85Å; H560-F563 HydrophobicContact CB-CE2 4.03Å; H560-F563 PolarHBondContact O-N 3.43Å
561	E	90	Very high	92.2	Very high	124 Å²	124	44.9 Å²	44.9	58%	0.579	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-47.1	-38.7	-172.2	55.1	162	-148.4	0	0	114.8	H446 F563 F564	H446-E561 WeakPolarHBondContact NE2-CB 3.3Å; E561-F563 PolarHBondContact O-N 2.89Å; E561-F563 VanDerWaalsContact O-N 3.14Å; E561-F564 PolarHBondContact O-N 3.28Å; E561-F564 VanDerWaalsContact O-N 3.09Å
562	K	91.4	Very high	92.3	Very high	60 Å²	60	49 Å²	49	26%	0.261	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-58.7	-28.5	-180	80.9	176.6	-174.8	138.1	0	113.6	E491 H560 F564 K565	E491-K562 IonicContact OE2-NZ 2.67Å; E491-K562 PolarHBondContact OE2-NZ 3.16Å; H560-K562 PolarHBondContact ND1-N 3.03Å; H560-K562 PolarHBondContact O-N 3.31Å; K562-F564 VanDerWaalsContact C-N 3.33Å; K562-K565 WeakPolarHBondContact O-CG 3.24Å
563	F	94.1	Very high	92.5	Very high	3 Å²	3	47.2 Å²	47.2	1%	0.013	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-84.3	-2.4	-178.4	-58.7	-61.3	0	0	0	113.8	M488 E491 M492 F495 Y496 R527 L559 H560 E561 K565	M488-F563 HydrophobicContact CG-CD1 4.22Å; M488-F563 HydrophobicContact SD-CD1 4.04Å; E491-F563 HydrophobicContact CB-CE1 3.95Å; M492-F563 HydrophobicContact CB-CE1 4.13Å; M492-F563 HydrophobicContact CB-CZ 4.11Å; M492-F563 HydrophobicContact CG-CD1 3.48Å; M492-F563 VanDerWaalsContact CG-CD1 3.48Å; M492-F563 HydrophobicContact CG-CD2 4.12Å; M492-F563 HydrophobicContact CG-CE1 3.27Å; M492-F563 HydrophobicContact CG-CE2 3.96Å; M492-F563 HydrophobicContact CG-CG 3.91Å; M492-F563 HydrophobicContact CG-CZ 3.52Å; M492-F563 HydrophobicContact SD-CD1 4.4Å; M492-F563 HydrophobicContact SD-CG 4.47Å; F495-F563 HydrophobicContact CB-CE2 4.38Å; F495-F563 HydrophobicContact CB-CZ 3.94Å; F495-F563 AromaticContact CD1-CE2 3.81Å; F495-F563 HydrophobicContact CD1-CE2 3.81Å; F495-F563 HydrophobicContact CD1-CZ 4.24Å; F495-F563 HydrophobicContact CE1-CE2 4.38Å; F495-F563 HydrophobicContact CG-CE2 4.14Å; F495-F563 HydrophobicContact CG-CZ 4.15Å; Y496-F563 HydrophobicContact CD2-CE2 4.28Å; Y496-F563 AromaticContact CE2-CD2 3.99Å; Y496-F563 HydrophobicContact CE2-CD2 3.99Å; Y496-F563 AromaticContact CE2-CE2 3.49Å; Y496-F563 HydrophobicContact CE2-CE2 3.49Å; Y496-F563 VanDerWaalsContact CE2-CE2 3.49Å; Y496-F563 HydrophobicContact CE2-CZ 4.27Å; R527-F563 WeakPolarHBondContact CD-O 3.48Å; R527-F563 PolarHBondContact NH1-O 3.22Å; L559-F563 HydrophobicContact CD1-CB 3.79Å; L559-F563 HydrophobicContact CD1-CD2 4.24Å; L559-F563 HydrophobicContact CD1-CG 4.39Å; L559-F563 HydrophobicContact CG-CB 4.34Å; H560-F563 HydrophobicContact CB-CD2 3.85Å; H560-F563 HydrophobicContact CB-CE2 4.03Å; H560-F563 PolarHBondContact O-N 3.43Å; E561-F563 PolarHBondContact O-N 2.89Å; E561-F563 VanDerWaalsContact O-N 3.14Å; F563-K565 VanDerWaalsContact C-N 3.31Å
564	F	93.5	Very high	92.8	Very high	14 Å²	14	48.8 Å²	48.8	6%	0.061	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-81.1	-10.6	170.4	-70	-104.8	0	0	0	112.7	H446 V448 P449 F514 L559 E561 K562	H446-F564 HydrophobicContact CB-CB 4.41Å; H446-F564 HydrophobicContact CB-CD1 3.63Å; H446-F564 HydrophobicContact CB-CD2 4.27Å; H446-F564 HydrophobicContact CB-CE1 3.88Å; H446-F564 HydrophobicContact CB-CE2 4.44Å; H446-F564 HydrophobicContact CB-CG 3.86Å; H446-F564 HydrophobicContact CB-CZ 4.28Å; V448-F564 HydrophobicContact CG2-CB 4.34Å; V448-F564 HydrophobicContact CG2-CD1 3.56Å; V448-F564 HydrophobicContact CG2-CE1 4.36Å; V448-F564 HydrophobicContact CG2-CG 4.37Å; P449-F564 WeakPolarHBondContact CD-O 3.49Å; F514-F564 HydrophobicContact CB-CE1 4.2Å; F514-F564 HydrophobicContact CB-CZ 4.35Å; F514-F564 HydrophobicContact CD2-CE1 4.3Å; L559-F564 HydrophobicContact CB-CE2 3.9Å; L559-F564 HydrophobicContact CB-CZ 4.07Å; L559-F564 HydrophobicContact CD2-CD2 4.24Å; L559-F564 HydrophobicContact CD2-CE1 4.23Å; L559-F564 HydrophobicContact CD2-CE2 3.76Å; L559-F564 HydrophobicContact CD2-CZ 3.75Å; L559-F564 HydrophobicContact CG-CD2 4.21Å; L559-F564 HydrophobicContact CG-CE2 3.63Å; L559-F564 HydrophobicContact CG-CZ 4.03Å; L559-F564 WeakPolarHBondContact O-CE2 3.01Å; E561-F564 PolarHBondContact O-N 3.28Å; E561-F564 VanDerWaalsContact O-N 3.09Å; K562-F564 VanDerWaalsContact C-N 3.33Å
565	K	92.6	Very high	93.3	Very high	163 Å²	163	45.2 Å²	45.2	71%	0.709	21%	0.212	S	C	*	.	S	Bend	trans	-69.5	-32.2	-174.6	-66.9	177.9	-178.5	176.3	0	114.6	K562 F563	K562-K565 WeakPolarHBondContact O-CG 3.24Å; F563-K565 VanDerWaalsContact C-N 3.31Å
566	L	94	Very high	93.5	Very high	29 Å²	29	43.8 Å²	43.8	15%	0.152	21%	0.205	C	C	.	.	S	Bend	trans	-84.5	134.8	177.3	-172.3	71.6	0	0	0	109	A484 M488 R527 Q569	A484-L566 HydrophobicContact CB-CD1 3.68Å; M488-L566 HydrophobicContact CB-CD2 3.89Å; M488-L566 HydrophobicContact CE-CD2 4.29Å; M488-L566 HydrophobicContact CG-CB 4.46Å; M488-L566 HydrophobicContact CG-CD2 4.06Å; R527-L566 PolarHBondContact NH1-O 3.07Å; R527-L566 PolarHBondContact NH2-O 2.88Å; L566-Q569 HydrophobicContact CD2-CG 4.25Å
567	P	95.4	Very high	93.6	Very high	26 Å²	26	44.7 Å²	44.7	17%	0.169	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-54.4	156.4	168.2	-22.9	31.7	0	0	0	112.3	P449 L451 R527 Q569	P449-P567 HydrophobicContact CB-CG 4.23Å; P449-P567 WeakPolarHBondContact O-CA 3.34Å; P449-P567 WeakPolarHBondContact O-CB 3.17Å; L451-P567 HydrophobicContact CB-CB 4.05Å; L451-P567 HydrophobicContact CD1-CB 3.85Å; R527-P567 PolarHBondContact NH2-O 2.64Å; P567-Q569 PolarHBondContact O-NE2 2.77Å
568	F	95.4	Very high	93.9	Very high	46 Å²	46	44.5 Å²	44.5	20%	0.202	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-68.4	130.5	168.3	-60.8	-34.6	0	0	0	110.5	V448 F514 V543 D544	V448-F568 HydrophobicContact CB-CE2 4.3Å; V448-F568 HydrophobicContact CB-CZ 4.15Å; V448-F568 HydrophobicContact CG1-CD1 4.05Å; V448-F568 HydrophobicContact CG1-CD2 4.24Å; V448-F568 HydrophobicContact CG1-CE1 3.91Å; V448-F568 HydrophobicContact CG1-CE2 4.11Å; V448-F568 HydrophobicContact CG1-CG 4.22Å; V448-F568 HydrophobicContact CG1-CZ 3.96Å; V448-F568 HydrophobicContact CG2-CE1 4.06Å; V448-F568 HydrophobicContact CG2-CE2 4.23Å; V448-F568 HydrophobicContact CG2-CZ 3.65Å; F514-F568 HydrophobicContact CD1-CE1 4.5Å; F514-F568 HydrophobicContact CD1-CE2 4.12Å; F514-F568 AromaticContact CD1-CZ 3.58Å; F514-F568 HydrophobicContact CD1-CZ 3.58Å; F514-F568 HydrophobicContact CD2-CZ 4.4Å; F514-F568 AromaticContact CE1-CE2 3.41Å; F514-F568 HydrophobicContact CE1-CE2 3.41Å; F514-F568 VanDerWaalsContact CE1-CE2 3.41Å; F514-F568 AromaticContact CE1-CZ 3.36Å; F514-F568 HydrophobicContact CE1-CZ 3.36Å; F514-F568 HydrophobicContact CE2-CE2 4.35Å; F514-F568 HydrophobicContact CE2-CZ 4.22Å; F514-F568 HydrophobicContact CG-CZ 4.11Å; F514-F568 AromaticContact CZ-CE2 3.55Å; F514-F568 HydrophobicContact CZ-CE2 3.55Å; F514-F568 AromaticContact CZ-CZ 3.72Å; F514-F568 HydrophobicContact CZ-CZ 3.72Å; V543-F568 HydrophobicContact CB-CB 4.07Å; V543-F568 HydrophobicContact CB-CD1 3.65Å; V543-F568 HydrophobicContact CB-CD2 4.17Å; V543-F568 HydrophobicContact CB-CE1 4.07Å; V543-F568 HydrophobicContact CB-CG 3.71Å; V543-F568 HydrophobicContact CB-CZ 4.47Å; V543-F568 HydrophobicContact CG1-CD1 4.37Å; V543-F568 HydrophobicContact CG1-CD2 4.34Å; V543-F568 HydrophobicContact CG1-CE1 4.37Å; V543-F568 HydrophobicContact CG1-CE2 4.33Å; V543-F568 HydrophobicContact CG1-CG 4.36Å; V543-F568 HydrophobicContact CG1-CZ 4.33Å; V543-F568 HydrophobicContact CG2-CD1 3.32Å; V543-F568 HydrophobicContact CG2-CE1 3.55Å; V543-F568 HydrophobicContact CG2-CG 3.95Å; V543-F568 HydrophobicContact CG2-CZ 4.3Å; D544-F568 WeakPolarHBondContact OD1-CA 3.19Å
569	Q	94	Very high	94	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.197	C	C	.	.	S	Bend	trans	-90.2	-20.3	-166.1	-61.3	-63.7	-45	0	0	114.2	Y481 Q485 D544 L566 P567	Y481-Q569 VanDerWaalsContact CA-OE1 3.31Å; Q485-Q569 HydrophobicContact CB-CG 4.08Å; Q485-Q569 HydrophobicContact CG-CG 4.34Å; D544-Q569 HydrophobicContact CB-CB 4.1Å; D544-Q569 HydrophobicContact CB-CG 4.45Å; D544-Q569 WeakPolarHBondContact OD1-CG 3.34Å; D544-Q569 PolarHBondContact OD1-N 3.32Å; L566-Q569 HydrophobicContact CD2-CG 4.25Å; P567-Q569 PolarHBondContact O-NE2 2.77Å
570	A	92.3	Very high	94.2	Very high	13 Å²	13	44.2 Å²	44.2	11%	0.107	22%	0.22	C	C	.	.			trans	-84.8	124.9	171.4	0	0	0	0	0	110.7	I473 V543 G546	I473-A570 HydrophobicContact CG2-CB 4.4Å; V543-A570 VanDerWaalsContact O-CB 3.32Å; V543-A570 WeakPolarHBondContact O-CB 3.37Å; V543-A570 PolarHBondContact O-N 3.26Å; V543-A570 VanDerWaalsContact O-N 3.1Å; G546-A570 VanDerWaalsContact CA-CB 3.44Å
571	T	93.8	Very high	94.4	Very high	32 Å²	32	41.4 Å²	41.4	20%	0.196	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	171.7	179.5	-169	0	0	0	0	111.6	L451 I473 L474 Y476	L451-T571 HydrophobicContact CD2-CG2 3.81Å; I473-T571 WeakPolarHBondContact CA-O 3.14Å; L474-T571 HydrophobicContact CD1-CG2 3.67Å; L474-T571 PolarHBondContact N-O 3.03Å; L474-T571 PolarHBondContact O-N 3.45Å; Y476-T571 HydrophobicContact CD2-CG2 4.43Å; Y476-T571 HydrophobicContact CE2-CG2 3.8Å
572	K	94.6	Very high	94.6	Very high	87 Å²	87	36.5 Å²	36.5	38%	0.378	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	145	-176.5	-69.4	177.3	171.4	-163.1	0	111.3	S471 V472 I473 V610 P611	S471-K572 VanDerWaalsContact OG-CD 3.32Å; S471-K572 WeakPolarHBondContact OG-CD 3.47Å; S471-K572 WeakPolarHBondContact OG-CE 3.45Å; S471-K572 PolarHBondContact OG-NZ 2.85Å; V472-K572 CarbonylContact O-C 3.51Å; V472-K572 VanDerWaalsContact O-CA 3.25Å; V472-K572 WeakPolarHBondContact O-CA 3.37Å; I473-K572 HydrophobicContact CG1-CG 4.45Å; K572-V610 HydrophobicContact CB-CG1 4.24Å; K572-P611 WeakPolarHBondContact O-CD 3.43Å
573	C	95.9	Very high	94.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.007	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	166.5	168.6	72.7	0	0	0	0	112.6	N470 S471 V472 L474 P611 V613	N470-C573 CarbonylContact C-O 3.53Å; S471-C573 PolarHBondContact N-O 3.36Å; V472-C573 PolarHBondContact N-O 3.29Å; V472-C573 PolarHBondContact O-N 2.83Å; L474-C573 HydrophobicContact CD2-CB 4.13Å; L474-C573 WeakPolarHBondContact CD2-SG 3.21Å; C573-P611 CarbonylContact C-O 3.52Å; C573-P611 WeakPolarHBondContact CA-O 3.34Å; C573-P611 HydrophobicContact CB-CG 4.16Å; C573-P611 WeakPolarHBondContact CB-O 3.46Å; C573-V613 HydrophobicContact CB-CG1 4.23Å; C573-V613 HydrophobicContact CB-CG2 3.99Å; C573-V613 VanDerWaalsContact SG-CG2 3.55Å
574	K	97.3	Very high	94.9	Very high	90 Å²	90	42.8 Å²	42.8	39%	0.391	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	139.3	170.4	-68.8	170.1	-179.7	-179.7	0	109.4	T469 N470 V610 P611 L612 V613	T469-K574 WeakPolarHBondContact O-CA 3.44Å; N470-K574 HydrophobicContact CB-CG 4.18Å; N470-K574 VanDerWaalsContact O-CG 3.27Å; N470-K574 WeakPolarHBondContact O-CG 3.38Å; K574-V610 HydrophobicContact CD-CG1 4.43Å; K574-V610 HydrophobicContact CG-CG1 3.91Å; K574-P611 PolarHBondContact N-O 2.93Å; K574-L612 HydrophobicContact CB-CD1 3.65Å; K574-L612 WeakPolarHBondContact O-CA 3.31Å; K574-V613 PolarHBondContact O-N 3.09Å
575	L	97.6	Very high	95	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	118	173.7	-55.6	-174.9	0	0	0	110.9	T469 V472 G577 L578 F591 V613 L615	T469-L575 HydrophobicContact CG2-CD1 4.03Å; T469-L575 PolarHBondContact O-N 3.39Å; V472-L575 HydrophobicContact CG2-CD1 4Å; V472-L575 HydrophobicContact CG2-CD2 4.07Å; V472-L575 HydrophobicContact CG2-CG 3.79Å; L575-G577 PolarHBondContact O-N 2.82Å; L575-L578 HydrophobicContact CB-CB 4.31Å; L575-L578 HydrophobicContact CB-CD1 3.83Å; L575-L578 HydrophobicContact CD1-CD1 3.86Å; L575-L578 PolarHBondContact O-N 3.47Å; L575-F591 HydrophobicContact CD1-CD2 3.54Å; L575-F591 HydrophobicContact CD1-CE2 3.46Å; L575-F591 VanDerWaalsContact CD1-CE2 3.46Å; L575-F591 HydrophobicContact CD1-CG 4.45Å; L575-F591 HydrophobicContact CD1-CZ 4.3Å; L575-F591 HydrophobicContact CD2-CE2 4.48Å; L575-V613 HydrophobicContact CD2-CG2 3.92Å; L575-L615 HydrophobicContact CD2-CD1 3.61Å; L575-L615 HydrophobicContact CD2-CG 4.02Å
576	A	95.8	Very high	95.1	Very high	1 Å²	1	41 Å²	41	1%	0.008	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	133.3	179	0	0	0	0	0	112.9	L578 E579 L605 L612 V613 V614 N627 F700	A576-L578 VanDerWaalsContact C-N 3.27Å; A576-L578 PolarHBondContact O-N 3.23Å; A576-E579 WeakPolarHBondContact CA-OE1 3.46Å; A576-L605 HydrophobicContact CB-CD1 3.57Å; A576-L612 HydrophobicContact CB-CD1 4.16Å; A576-L612 HydrophobicContact CB-CD2 4.33Å; A576-L612 HydrophobicContact CB-CG 3.99Å; A576-V613 PolarHBondContact N-O 3.27Å; A576-V614 HydrophobicContact CB-CG2 4.03Å; A576-N627 PolarHBondContact N-ND2 2.82Å; A576-N627 PolarHBondContact O-ND2 2.97Å; A576-F700 HydrophobicContact CB-CD1 4.19Å; A576-F700 HydrophobicContact CB-CE1 3.7Å; A576-F700 HydrophobicContact CB-CE2 4.31Å; A576-F700 HydrophobicContact CB-CZ 3.78Å
577	G	93.5	Very high	95.3	Very high	20 Å²	20	39.6 Å²	39.6	21%	0.206	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	-12.2	180	0	0	0	0	0	115.3	L575 E579 M631	L575-G577 PolarHBondContact O-N 2.82Å; G577-E579 WeakPolarHBondContact CA-OE2 3.4Å; G577-E579 VanDerWaalsContact N-CD 3.3Å; G577-E579 PolarHBondContact N-OE1 2.84Å; G577-E579 VanDerWaalsContact N-OE1 3.13Å; G577-E579 PolarHBondContact N-OE2 3.24Å; G577-M631 VanDerWaalsContact O-SD 3.32Å
578	L	96.4	Very high	95.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.22	C	C	.	.			trans	-101.6	1.7	179.6	-68.3	168.1	0	0	0	113.1	T469 L575 A576 F581 C582 V587 N627 C630 M631	T469-L578 HydrophobicContact CG2-CD1 4.33Å; T469-L578 PolarHBondContact OG1-O 2.91Å; L575-L578 HydrophobicContact CB-CB 4.31Å; L575-L578 HydrophobicContact CB-CD1 3.83Å; L575-L578 HydrophobicContact CD1-CD1 3.86Å; L575-L578 PolarHBondContact O-N 3.47Å; A576-L578 VanDerWaalsContact C-N 3.27Å; A576-L578 PolarHBondContact O-N 3.23Å; L578-F581 CarbonylContact O-C 3.55Å; L578-F581 WeakPolarHBondContact O-CA 3.38Å; L578-F581 PolarHBondContact O-N 2.86Å; L578-C582 PolarHBondContact O-N 3.27Å; L578-C582 VanDerWaalsContact O-N 3.09Å; L578-V587 HydrophobicContact CD1-CG1 4.37Å; L578-V587 HydrophobicContact CD2-CG1 3.9Å; L578-V587 HydrophobicContact CD2-CG2 4.16Å; L578-N627 HydrophobicContact CD1-CB 4.37Å; L578-C630 HydrophobicContact CD1-CB 3.59Å; L578-C630 HydrophobicContact CD2-CB 3.86Å; L578-C630 HydrophobicContact CG-CB 4.37Å; L578-M631 HydrophobicContact CD2-CG 3.69Å; L578-M631 HydrophobicContact CD2-SD 3.66Å; L578-M631 HydrophobicContact CG-CG 4.32Å; L578-M631 HydrophobicContact CG-SD 4.49Å
579	E	93.5	Very high	95.2	Very high	69 Å²	69	45.2 Å²	45.2	32%	0.322	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-57.7	-41.7	-173.8	-46.6	85.8	160.3	0	0	113	N470 A576 G577 F581	N470-E579 PolarHBondContact ND2-O 3.37Å; N470-E579 WeakPolarHBondContact OD1-CA 3.42Å; A576-E579 WeakPolarHBondContact CA-OE1 3.46Å; G577-E579 WeakPolarHBondContact CA-OE2 3.4Å; G577-E579 VanDerWaalsContact N-CD 3.3Å; G577-E579 PolarHBondContact N-OE1 2.84Å; G577-E579 VanDerWaalsContact N-OE1 3.13Å; G577-E579 PolarHBondContact N-OE2 3.24Å; E579-F581 PolarHBondContact O-N 2.74Å
580	P	94.9	Very high	95.2	Very high	82 Å²	82	47 Å²	47	53%	0.532	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-73.7	-11.2	175.2	-18	34.7	0	0	0	114.3	L753	P580-L753 HydrophobicContact CB-CD2 4.06Å; P580-L753 HydrophobicContact CG-CD2 3.77Å
581	F	96.3	Very high	95.4	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.035	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-119.2	16.3	-172.8	-57.9	-62.2	0	0	0	112.4	L578 E579 Q583 E584 V587 M631 L634 L753 R754 V757	L578-F581 CarbonylContact O-C 3.55Å; L578-F581 WeakPolarHBondContact O-CA 3.38Å; L578-F581 PolarHBondContact O-N 2.86Å; E579-F581 PolarHBondContact O-N 2.74Å; F581-Q583 PolarHBondContact O-N 2.97Å; F581-E584 HydrophobicContact CB-CB 4.48Å; F581-E584 HydrophobicContact CB-CG 3.86Å; F581-E584 HydrophobicContact CD1-CG 4.08Å; F581-E584 HydrophobicContact CG-CG 4.46Å; F581-E584 WeakPolarHBondContact O-CB 3.47Å; F581-E584 WeakPolarHBondContact O-CG 3.21Å; F581-E584 PolarHBondContact O-N 3.1Å; F581-V587 HydrophobicContact CB-CG2 4.34Å; F581-M631 HydrophobicContact CD2-CE 4.4Å; F581-M631 HydrophobicContact CD2-SD 3.8Å; F581-M631 HydrophobicContact CE2-CE 4.04Å; F581-M631 HydrophobicContact CE2-SD 4.05Å; F581-L634 HydrophobicContact CB-CD1 3.97Å; F581-L634 HydrophobicContact CD1-CD1 3.8Å; F581-L634 HydrophobicContact CD1-CD2 4.44Å; F581-L634 HydrophobicContact CD2-CD1 3.58Å; F581-L634 HydrophobicContact CE1-CD1 4.15Å; F581-L634 HydrophobicContact CE2-CD1 3.94Å; F581-L634 HydrophobicContact CG-CD1 3.49Å; F581-L634 VanDerWaalsContact CG-CD1 3.49Å; F581-L634 HydrophobicContact CZ-CD1 4.2Å; F581-L753 HydrophobicContact CE2-CD2 4Å; F581-L753 HydrophobicContact CE2-CG 4.15Å; F581-L753 HydrophobicContact CZ-CD2 4.05Å; F581-L753 HydrophobicContact CZ-CG 3.95Å; F581-R754 HydrophobicContact CE1-CB 4.27Å; F581-R754 HydrophobicContact CE1-CG 4.02Å; F581-V757 HydrophobicContact CE2-CG2 4.43Å; F581-V757 HydrophobicContact CZ-CB 4.49Å; F581-V757 HydrophobicContact CZ-CG2 4.45Å
582	C	94.6	Very high	95.2	Very high	22 Å²	22	49.4 Å²	49.4	15%	0.149	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.6	-162.5	64.7	0	0	0	0	116.1	N468 T469 N470 L578	N468-C582 CarbonylContact C-O 3.54Å; N468-C582 WeakPolarHBondContact CA-O 3.46Å; N468-C582 VanDerWaalsContact CB-O 3.25Å; N468-C582 WeakPolarHBondContact CB-O 3.44Å; T469-C582 PolarHBondContact N-O 2.69Å; T469-C582 WeakPolarHBondContact OG1-CA 3.17Å; T469-C582 VanDerWaalsContact OG1-CB 3.3Å; T469-C582 WeakPolarHBondContact OG1-CB 3.28Å; N470-C582 HydrophobicContact CB-CB 4.15Å; N470-C582 WeakPolarHBondContact ND2-CB 3.48Å; N470-C582 PolarHBondContact ND2-SG 2.73Å; L578-C582 PolarHBondContact O-N 3.27Å; L578-C582 VanDerWaalsContact O-N 3.09Å
583	Q	95.5	Very high	94.9	Very high	148 Å²	148	48.6 Å²	48.6	69%	0.692	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	5	176	-63.2	-178.4	0.9	0	0	113.2	N468 F581 P585	N468-Q583 HydrophobicContact CB-CG 4.18Å; F581-Q583 PolarHBondContact O-N 2.97Å; Q583-P585 WeakPolarHBondContact O-CD 3.39Å
584	E	96.1	Very high	94.6	Very high	46 Å²	46	50.8 Å²	50.8	22%	0.215	28%	0.28	C	S	.	.			trans	-66	123.2	-177.5	-70.1	-71.7	174.5	0	0	110.8	F581 A586 V587 L588 L634 R754	F581-E584 HydrophobicContact CB-CB 4.48Å; F581-E584 HydrophobicContact CB-CG 3.86Å; F581-E584 HydrophobicContact CD1-CG 4.08Å; F581-E584 HydrophobicContact CG-CG 4.46Å; F581-E584 WeakPolarHBondContact O-CB 3.47Å; F581-E584 WeakPolarHBondContact O-CG 3.21Å; F581-E584 PolarHBondContact O-N 3.1Å; E584-A586 PolarHBondContact O-N 3.33Å; E584-A586 VanDerWaalsContact O-N 3.14Å; E584-V587 HydrophobicContact CB-CB 4.06Å; E584-V587 HydrophobicContact CB-CG2 3.96Å; E584-V587 WeakPolarHBondContact O-CB 3.5Å; E584-V587 PolarHBondContact O-N 3.01Å; E584-L588 PolarHBondContact O-N 3.15Å; E584-L634 HydrophobicContact CB-CD2 3.98Å; E584-L634 HydrophobicContact CG-CD2 3.96Å; E584-R754 IonicContact OE1-CZ 3.21Å; E584-R754 IonicContact OE1-NE 2.88Å; E584-R754 PolarHBondContact OE1-NE 3.12Å; E584-R754 IonicContact OE1-NH2 3.97Å; E584-R754 PolarHBondContact OE1-NH2 2.98Å; E584-R754 IonicContact OE2-NH2 3.47Å; E584-R754 PolarHBondContact OE2-NH2 3.29Å
585	P	96.1	Very high	94.2	Very high	97 Å²	97	46.5 Å²	46.5	63%	0.63	26%	0.261	S	S	*	.	H	α-helix	trans	-59.8	-31.5	-174.5	-27.5	35.5	0	0	0	114.3	Q583 K589	Q583-P585 WeakPolarHBondContact O-CD 3.39Å; P585-K589 WeakPolarHBondContact O-CB 3.42Å; P585-K589 PolarHBondContact O-N 3.21Å
586	A	95.4	Very high	93.6	Very high	42 Å²	42	48 Å²	48	35%	0.347	27%	0.271	S	S	.	.	H	α-helix	trans	-67.3	-41.4	175.7	0	0	0	0	0	112.2	E584 T590 S633	E584-A586 PolarHBondContact O-N 3.33Å; E584-A586 VanDerWaalsContact O-N 3.14Å; A586-T590 WeakPolarHBondContact O-CB 3.35Å; A586-T590 PolarHBondContact O-N 2.89Å; A586-T590 VanDerWaalsContact O-N 3.08Å; A586-T590 PolarHBondContact O-OG1 3.4Å; A586-S633 PolarHBondContact O-OG 3.37Å
587	V	96.3	Very high	92.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-50	177.1	165.5	0	0	0	0	110.2	T469 L578 F581 E584 T590 F591 C630 S633 L634	T469-V587 HydrophobicContact CG2-CG1 3.62Å; L578-V587 HydrophobicContact CD1-CG1 4.37Å; L578-V587 HydrophobicContact CD2-CG1 3.9Å; L578-V587 HydrophobicContact CD2-CG2 4.16Å; F581-V587 HydrophobicContact CB-CG2 4.34Å; E584-V587 HydrophobicContact CB-CB 4.06Å; E584-V587 HydrophobicContact CB-CG2 3.96Å; E584-V587 WeakPolarHBondContact O-CB 3.5Å; E584-V587 PolarHBondContact O-N 3.01Å; V587-T590 PolarHBondContact O-N 3.08Å; V587-F591 WeakPolarHBondContact O-CB 3.25Å; V587-F591 PolarHBondContact O-N 3.05Å; V587-C630 HydrophobicContact CG1-CB 4.23Å; V587-S633 PolarHBondContact N-OG 2.88Å; V587-L634 HydrophobicContact CG2-CD1 3.99Å; V587-L634 HydrophobicContact CG2-CD2 3.71Å; V587-L634 HydrophobicContact CG2-CG 3.74Å
588	L	94.9	Very high	92.2	Very high	37 Å²	37	51.9 Å²	51.9	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-65.1	-41.8	-178	-65.1	177.5	0	0	0	112.3	T469 E584 T590 F591 E592	T469-L588 HydrophobicContact CG2-CD2 3.86Å; E584-L588 PolarHBondContact O-N 3.15Å; L588-T590 PolarHBondContact O-N 3.28Å; L588-F591 PolarHBondContact O-N 2.78Å; L588-E592 WeakPolarHBondContact O-CB 3.49Å; L588-E592 PolarHBondContact O-N 3.32Å
589	K	93.7	Very high	91.6	Very high	154 Å²	154	53.8 Å²	53.8	67%	0.67	29%	0.292	S	S	*	.	H	α-helix	trans	-62.8	-40.6	175.3	-177.7	-179	177.4	-176.6	0	112.5	P585 A593	P585-K589 WeakPolarHBondContact O-CB 3.42Å; P585-K589 PolarHBondContact O-N 3.21Å; K589-A593 WeakPolarHBondContact O-CB 3.42Å; K589-A593 PolarHBondContact O-N 2.77Å
590	T	95.4	Very high	91.4	Very high	37 Å²	37	50.6 Å²	50.6	23%	0.227	28%	0.277	C	S	.	.	H	α-helix	trans	-66.8	-44.4	175.5	-59.1	0	0	0	0	110.8	A586 V587 L588 A593 M594 S633	A586-T590 WeakPolarHBondContact O-CB 3.35Å; A586-T590 PolarHBondContact O-N 2.89Å; A586-T590 VanDerWaalsContact O-N 3.08Å; A586-T590 PolarHBondContact O-OG1 3.4Å; V587-T590 PolarHBondContact O-N 3.08Å; L588-T590 PolarHBondContact O-N 3.28Å; T590-A593 PolarHBondContact O-N 3.15Å; T590-M594 HydrophobicContact CG2-CG 4.49Å; T590-M594 HydrophobicContact CG2-SD 3.77Å; T590-M594 WeakPolarHBondContact O-CB 3.44Å; T590-M594 VanDerWaalsContact O-CG 3.32Å; T590-M594 WeakPolarHBondContact O-CG 3.43Å; T590-M594 PolarHBondContact O-N 2.67Å; T590-M594 VanDerWaalsContact O-N 3.12Å; T590-S633 WeakPolarHBondContact OG1-CB 3.29Å
591	F	95.3	Very high	91.1	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.013	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-50.1	177.5	-179.6	-99.3	0	0	0	111.8	V463 A466 V472 L575 V587 L588 A593 M594 A595 L615 I626	V463-F591 HydrophobicContact CG1-CE1 3.98Å; V463-F591 HydrophobicContact CG1-CZ 3.64Å; A466-F591 HydrophobicContact CB-CD1 3.82Å; A466-F591 HydrophobicContact CB-CE1 3.49Å; A466-F591 VanDerWaalsContact CB-CE1 3.49Å; A466-F591 HydrophobicContact CB-CZ 4.44Å; V472-F591 HydrophobicContact CB-CZ 4.42Å; V472-F591 HydrophobicContact CG1-CE1 4.06Å; V472-F591 HydrophobicContact CG1-CZ 3.56Å; V472-F591 HydrophobicContact CG2-CE1 4.25Å; V472-F591 HydrophobicContact CG2-CE2 4.46Å; V472-F591 HydrophobicContact CG2-CZ 3.93Å; L575-F591 HydrophobicContact CD1-CD2 3.54Å; L575-F591 HydrophobicContact CD1-CE2 3.46Å; L575-F591 VanDerWaalsContact CD1-CE2 3.46Å; L575-F591 HydrophobicContact CD1-CG 4.45Å; L575-F591 HydrophobicContact CD1-CZ 4.3Å; L575-F591 HydrophobicContact CD2-CE2 4.48Å; V587-F591 WeakPolarHBondContact O-CB 3.25Å; V587-F591 PolarHBondContact O-N 3.05Å; L588-F591 PolarHBondContact O-N 2.78Å; F591-A593 VanDerWaalsContact C-N 3.31Å; F591-A593 PolarHBondContact O-N 2.93Å; F591-M594 PolarHBondContact O-N 3.18Å; F591-M594 VanDerWaalsContact O-N 3.15Å; F591-A595 HydrophobicContact CD2-CB 3.95Å; F591-A595 HydrophobicContact CE1-CB 4.19Å; F591-A595 HydrophobicContact CE2-CB 3.5Å; F591-A595 VanDerWaalsContact CE2-CB 3.5Å; F591-A595 HydrophobicContact CG-CB 4.47Å; F591-A595 HydrophobicContact CZ-CB 3.64Å; F591-A595 WeakPolarHBondContact O-CB 3.36Å; F591-A595 PolarHBondContact O-N 2.7Å; F591-L615 HydrophobicContact CE2-CD1 3.94Å; F591-L615 HydrophobicContact CZ-CD1 4.37Å; F591-I626 HydrophobicContact CD2-CG2 4.07Å; F591-I626 HydrophobicContact CE2-CG2 4.4Å
592	E	89.8	Confident	90.9	Very high	94 Å²	94	46.6 Å²	46.6	44%	0.439	25%	0.252	S	S	.	.	H	α-helix	trans	-57.5	-43.8	179.8	-174	-172.3	-173.3	0	0	111.7	A79 L588 M594 S596	A79-E592 VanDerWaalsContact CB-OE1 3.23Å; A79-E592 WeakPolarHBondContact CB-OE1 3.31Å; L588-E592 WeakPolarHBondContact O-CB 3.49Å; L588-E592 PolarHBondContact O-N 3.32Å; E592-M594 VanDerWaalsContact C-N 3.34Å; E592-M594 PolarHBondContact O-N 3.12Å; E592-S596 WeakPolarHBondContact O-CB 3.4Å; E592-S596 PolarHBondContact O-N 3.33Å
593	A	89.4	Confident	90.8	Very high	69 Å²	69	46.2 Å²	46.2	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-67.5	-32.3	179.3	0	0	0	0	0	113.6	K589 T590 F591 R598	K589-A593 WeakPolarHBondContact O-CB 3.42Å; K589-A593 PolarHBondContact O-N 2.77Å; T590-A593 PolarHBondContact O-N 3.15Å; F591-A593 VanDerWaalsContact C-N 3.31Å; F591-A593 PolarHBondContact O-N 2.93Å; A593-R598 PolarHBondContact O-NH2 3.41Å
594	M	88.6	Confident	90.5	Very high	48 Å²	48	40 Å²	40	24%	0.236	22%	0.22	C	C	.	.	H	α-helix	trans	-96.6	-26.9	-174	-64.6	-175.5	79.5	0	0	114.3	T590 F591 E592 R598 V624 I626 A629	T590-M594 HydrophobicContact CG2-CG 4.49Å; T590-M594 HydrophobicContact CG2-SD 3.77Å; T590-M594 WeakPolarHBondContact O-CB 3.44Å; T590-M594 VanDerWaalsContact O-CG 3.32Å; T590-M594 WeakPolarHBondContact O-CG 3.43Å; T590-M594 PolarHBondContact O-N 2.67Å; T590-M594 VanDerWaalsContact O-N 3.12Å; F591-M594 PolarHBondContact O-N 3.18Å; F591-M594 VanDerWaalsContact O-N 3.15Å; E592-M594 VanDerWaalsContact C-N 3.34Å; E592-M594 PolarHBondContact O-N 3.12Å; M594-R598 WeakPolarHBondContact O-CD 3.41Å; M594-R598 PolarHBondContact O-NE 3.13Å; M594-R598 VanDerWaalsContact O-NE 3.09Å; M594-V624 HydrophobicContact CE-CG1 3.72Å; M594-I626 HydrophobicContact CB-CD1 4.05Å; M594-I626 HydrophobicContact CB-CG2 4.34Å; M594-I626 HydrophobicContact CE-CD1 3.78Å; M594-A629 HydrophobicContact CE-CB 3.73Å; M594-A629 HydrophobicContact SD-CB 3.63Å
595	A	88.6	Confident	90.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-121.5	-39	-169.5	0	0	0	0	0	115.1	V463 F591 G597 R598 L600 I626	V463-A595 HydrophobicContact CB-CB 4.42Å; V463-A595 WeakPolarHBondContact CB-O 3.3Å; V463-A595 HydrophobicContact CG1-CB 4.08Å; V463-A595 HydrophobicContact CG2-CB 4.46Å; F591-A595 HydrophobicContact CD2-CB 3.95Å; F591-A595 HydrophobicContact CE1-CB 4.19Å; F591-A595 HydrophobicContact CE2-CB 3.5Å; F591-A595 VanDerWaalsContact CE2-CB 3.5Å; F591-A595 HydrophobicContact CG-CB 4.47Å; F591-A595 HydrophobicContact CZ-CB 3.64Å; F591-A595 WeakPolarHBondContact O-CB 3.36Å; F591-A595 PolarHBondContact O-N 2.7Å; A595-G597 PolarHBondContact O-N 2.89Å; A595-R598 WeakPolarHBondContact O-CB 3.47Å; A595-R598 PolarHBondContact O-N 3.31Å; A595-L600 HydrophobicContact CB-CD1 3.76Å; A595-I626 HydrophobicContact CB-CG2 4.38Å
596	S	85.6	Confident	89.8	Confident	30 Å²	30	39.4 Å²	39.4	21%	0.21	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	129.5	-173.7	-63.5	0	0	0	0	112.4	E592 R598	E592-S596 WeakPolarHBondContact O-CB 3.4Å; E592-S596 PolarHBondContact O-N 3.33Å; S596-R598 VanDerWaalsContact C-N 3.27Å; S596-R598 PolarHBondContact O-N 3.38Å
597	G	78.9	Confident	89.4	Confident	9 Å²	9	43.1 Å²	43.1	9%	0.093	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	6.2	-176.9	0	0	0	0	0	115.2	V86 V463 A595	V86-G597 VanDerWaalsContact CG1-O 3.28Å; V86-G597 WeakPolarHBondContact CG1-O 3.43Å; V463-G597 WeakPolarHBondContact O-CA 3.34Å; V463-G597 PolarHBondContact O-N 3.41Å; A595-G597 PolarHBondContact O-N 2.89Å
598	R	81.8	Confident	88.9	Confident	95 Å²	95	44 Å²	44	36%	0.358	22%	0.223	S	C	.	.			trans	-102.9	147.2	-179.8	-53.7	-162.4	-166.1	-167.1	2.9	112.5	L462 V463 A593 M594 A595 S596 L600 D617	L462-R598 WeakPolarHBondContact CA-O 3.41Å; V463-R598 PolarHBondContact N-O 2.92Å; A593-R598 PolarHBondContact O-NH2 3.41Å; M594-R598 WeakPolarHBondContact O-CD 3.41Å; M594-R598 PolarHBondContact O-NE 3.13Å; M594-R598 VanDerWaalsContact O-NE 3.09Å; A595-R598 WeakPolarHBondContact O-CB 3.47Å; A595-R598 PolarHBondContact O-N 3.31Å; S596-R598 VanDerWaalsContact C-N 3.27Å; S596-R598 PolarHBondContact O-N 3.38Å; R598-L600 HydrophobicContact CB-CD2 4.04Å; R598-L600 HydrophobicContact CB-CG 4.19Å; R598-D617 IonicContact CZ-OD2 2.77Å; R598-D617 IonicContact NH1-OD2 3.63Å; R598-D617 PolarHBondContact NH1-OD2 3Å
599	I	83.6	Confident	88.4	Confident	39 Å²	39	48.7 Å²	48.7	20%	0.2	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	122	163.7	-60	178.2	0	0	0	106.9	V461 L462 I477	V461-I599 CarbonylContact O-C 3.54Å; V461-I599 VanDerWaalsContact O-CA 3.26Å; V461-I599 WeakPolarHBondContact O-CA 3.39Å; L462-I599 HydrophobicContact CB-CG1 4.41Å; L462-I599 HydrophobicContact CD1-CG1 4.02Å; I477-I599 HydrophobicContact CG1-CG2 4.41Å
600	L	88.8	Confident	88.4	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	163.4	-178.1	-60.5	-178.8	0	0	0	109.8	S460 V461 V463 A595 R598 L615 Y616 D617 I626	S460-L600 WeakPolarHBondContact CA-O 3.32Å; V461-L600 HydrophobicContact CG2-CB 4.38Å; V461-L600 PolarHBondContact N-O 3.02Å; V461-L600 PolarHBondContact O-N 3.48Å; V463-L600 HydrophobicContact CG2-CD1 4.03Å; A595-L600 HydrophobicContact CB-CD1 3.76Å; R598-L600 HydrophobicContact CB-CD2 4.04Å; R598-L600 HydrophobicContact CB-CG 4.19Å; L600-L615 HydrophobicContact CD1-CB 4.11Å; L600-L615 HydrophobicContact CD1-CD1 4.27Å; L600-Y616 WeakPolarHBondContact CB-O 3.48Å; L600-D617 HydrophobicContact CD2-CB 3.69Å; L600-I626 HydrophobicContact CD1-CG1 4.2Å
601	L	88.4	Confident	88.3	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.8	169.8	-157.3	75.2	0	0	0	109	M105 Y458 L615 Y616 T618	M105-L601 HydrophobicContact CB-CD2 4.17Å; Y458-L601 HydrophobicContact CD1-CD2 3.96Å; Y458-L601 HydrophobicContact CD1-CG 4.39Å; Y458-L601 HydrophobicContact CG-CD2 4.21Å; Y458-L601 WeakPolarHBondContact O-CD1 3.29Å; L601-L615 WeakPolarHBondContact O-CA 3.32Å; L601-Y616 PolarHBondContact N-O 3.3Å; L601-Y616 PolarHBondContact O-N 2.92Å; L601-T618 HydrophobicContact CB-CG2 4.31Å; L601-T618 HydrophobicContact CD2-CG2 4.34Å
602	A	92.6	Very high	88.3	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	109.7	-179.9	0	0	0	0	0	111.9	Y458 P459 V461 V614 L615	Y458-A602 WeakPolarHBondContact CA-O 3.35Å; P459-A602 VanDerWaalsContact CD-O 3.25Å; P459-A602 WeakPolarHBondContact CD-O 3.31Å; P459-A602 PolarHBondContact O-N 3.43Å; V461-A602 HydrophobicContact CG1-CB 3.85Å; V461-A602 HydrophobicContact CG2-CB 3.81Å; A602-V614 WeakPolarHBondContact CA-O 3.27Å; A602-L615 HydrophobicContact CB-CD2 3.75Å
603	E	91.9	Very high	88.6	Confident	15 Å²	15	38.6 Å²	38.6	7%	0.07	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	119	168.7	-178.3	-171.4	167.9	0	0	109	Y458 L605 V613 V614 Y616	Y458-E603 HydrophobicContact CD1-CB 3.86Å; Y458-E603 HydrophobicContact CD1-CG 4.34Å; Y458-E603 HydrophobicContact CE1-CB 3.62Å; Y458-E603 HydrophobicContact CE1-CG 3.69Å; E603-L605 HydrophobicContact CG-CD2 4.01Å; E603-L605 WeakPolarHBondContact OE1-CD2 3.3Å; E603-V613 CarbonylContact O-C 3.56Å; E603-V613 WeakPolarHBondContact O-CA 3.47Å; E603-V614 HydrophobicContact CB-CB 4.15Å; E603-V614 PolarHBondContact N-O 3.23Å; E603-V614 PolarHBondContact O-N 3.37Å; E603-Y616 HydrophobicContact CB-CE2 3.81Å; E603-Y616 VanDerWaalsContact OE2-CE2 3.25Å; E603-Y616 WeakPolarHBondContact OE2-CE2 3.34Å; E603-Y616 PolarHBondContact OE2-OH 3.34Å
604	I	90.6	Very high	88.9	Confident	18 Å²	18	35.3 Å²	35.3	9%	0.092	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	99	-175.5	-53.6	-172.7	0	0	0	111	I453 E457 P459 Y476 R607 P611 V613	I453-I604 HydrophobicContact CG2-CD1 3.48Å; I453-I604 VanDerWaalsContact CG2-CD1 3.48Å; E457-I604 PolarHBondContact O-N 3.44Å; P459-I604 HydrophobicContact CG-CD1 3.68Å; P459-I604 HydrophobicContact CG-CG1 4.19Å; Y476-I604 HydrophobicContact CE1-CD1 4.5Å; I604-R607 HydrophobicContact CG2-CG 3.73Å; I604-P611 HydrophobicContact CG2-CB 4.19Å; I604-V613 HydrophobicContact CG1-CG1 4.2Å
605	L	87.1	Confident	89.3	Confident	44 Å²	44	33 Å²	33	23%	0.23	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-31	179.4	-55.9	-174	0	0	0	113.5	A576 E603 L612 V614 F700	A576-L605 HydrophobicContact CB-CD1 3.57Å; E603-L605 HydrophobicContact CG-CD2 4.01Å; E603-L605 WeakPolarHBondContact OE1-CD2 3.3Å; L605-L612 HydrophobicContact CB-CD2 4.41Å; L605-L612 PolarHBondContact N-O 3.23Å; L605-V614 HydrophobicContact CD1-CG2 3.84Å; L605-V614 HydrophobicContact CD2-CG2 4.45Å; L605-V614 HydrophobicContact CG-CG2 4.14Å; L605-F700 HydrophobicContact CD1-CB 3.88Å; L605-F700 HydrophobicContact CD1-CD1 3.56Å; L605-F700 HydrophobicContact CD1-CE1 4.28Å; L605-F700 HydrophobicContact CD1-CG 3.84Å; L605-F700 HydrophobicContact CD2-CB 4.02Å
606	E	88.6	Confident	89.4	Confident	85 Å²	85	33.6 Å²	33.6	40%	0.397	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	127.3	177.9	-168.4	172.1	131.9	0	0	111.7	G608 P611 L612 R698	E606-G608 PolarHBondContact O-N 3.4Å; E606-P611 WeakPolarHBondContact O-CA 3.23Å; E606-P611 VanDerWaalsContact O-CB 3.28Å; E606-P611 WeakPolarHBondContact O-CB 3.32Å; E606-L612 HydrophobicContact CB-CB 3.72Å; E606-L612 PolarHBondContact N-O 3.08Å; E606-L612 PolarHBondContact O-N 2.89Å; E606-L612 VanDerWaalsContact O-N 3.08Å; E606-R698 IonicContact OE2-CZ 2.68Å; E606-R698 IonicContact OE2-NE 3.1Å; E606-R698 PolarHBondContact OE2-NE 3.15Å; E606-R698 IonicContact OE2-NH2 3.67Å; E606-R698 PolarHBondContact OE2-NH2 3.39Å
607	R	88.3	Confident	89.5	Confident	120 Å²	120	32.5 Å²	32.5	45%	0.453	17%	0.168	S	C	.	.			trans	-97.1	66.5	-178.3	-65.5	172.9	179.8	-82.7	-1.2	110.7	I453 P454 K455 E456 I604	I453-R607 HydrophobicContact CD1-CB 4.44Å; P454-R607 PolarHBondContact O-NH1 3.3Å; P454-R607 PolarHBondContact O-NH2 2.96Å; K455-R607 PolarHBondContact O-NH2 3.06Å; E456-R607 PolarHBondContact O-NH2 2.76Å; I604-R607 HydrophobicContact CG2-CG 3.73Å
608	G	85.9	Confident	89.7	Confident	18 Å²	18	32.4 Å²	32.4	19%	0.186	17%	0.166	C	C	.	.	S	Bend	trans	-100.7	-179.2	172.8	0	0	0	0	0	113	I453 E606 V610 P611	I453-G608 WeakPolarHBondContact CD1-O 3.39Å; E606-G608 PolarHBondContact O-N 3.4Å; G608-V610 PolarHBondContact O-N 2.92Å; G608-V610 VanDerWaalsContact O-N 3.16Å; G608-P611 WeakPolarHBondContact O-CD 3.46Å
609	P	84.8	Confident	89.4	Confident	136 Å²	136	31.8 Å²	31.8	88%	0.883	18%	0.176	S	C	*	.	S	Bend	trans	-57.6	-27.1	175.8	-25.1	34.8	0	0	0	114.2
610	V	92.8	Very high	89.1	Confident	54 Å²	54	35.7 Å²	35.7	33%	0.327	19%	0.194	S	C	.	.	S	Bend	trans	-124.5	96.3	166.3	-177.7	0	0	0	0	106.1	K572 K574 G608	K572-V610 HydrophobicContact CB-CG1 4.24Å; K574-V610 HydrophobicContact CD-CG1 4.43Å; K574-V610 HydrophobicContact CG-CG1 3.91Å; G608-V610 PolarHBondContact O-N 2.92Å; G608-V610 VanDerWaalsContact O-N 3.16Å
611	P	94.2	Very high	88.3	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	23%	0.231	C	C	.	.			trans	-61.8	149.7	-174.6	20.9	-33.3	0	0	0	113.2	I453 K572 C573 K574 I604 E606 G608 V613	I453-P611 HydrophobicContact CD1-CB 4.16Å; I453-P611 HydrophobicContact CD1-CG 4.14Å; K572-P611 WeakPolarHBondContact O-CD 3.43Å; C573-P611 CarbonylContact C-O 3.52Å; C573-P611 WeakPolarHBondContact CA-O 3.34Å; C573-P611 HydrophobicContact CB-CG 4.16Å; C573-P611 WeakPolarHBondContact CB-O 3.46Å; K574-P611 PolarHBondContact N-O 2.93Å; I604-P611 HydrophobicContact CG2-CB 4.19Å; E606-P611 WeakPolarHBondContact O-CA 3.23Å; E606-P611 VanDerWaalsContact O-CB 3.28Å; E606-P611 WeakPolarHBondContact O-CB 3.32Å; G608-P611 WeakPolarHBondContact O-CD 3.46Å; P611-V613 HydrophobicContact CB-CG1 4.25Å
612	L	94.8	Very high	87.6	Confident	18 Å²	18	46.9 Å²	46.9	9%	0.094	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.4	172	-170.7	67.6	0	0	0	108.9	K574 A576 L605 E606	K574-L612 HydrophobicContact CB-CD1 3.65Å; K574-L612 WeakPolarHBondContact O-CA 3.31Å; A576-L612 HydrophobicContact CB-CD1 4.16Å; A576-L612 HydrophobicContact CB-CD2 4.33Å; A576-L612 HydrophobicContact CB-CG 3.99Å; L605-L612 HydrophobicContact CB-CD2 4.41Å; L605-L612 PolarHBondContact N-O 3.23Å; E606-L612 HydrophobicContact CB-CB 3.72Å; E606-L612 PolarHBondContact N-O 3.08Å; E606-L612 PolarHBondContact O-N 2.89Å; E606-L612 VanDerWaalsContact O-N 3.08Å
613	V	96.1	Very high	87.2	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	154.6	-171.4	-53.4	0	0	0	0	114	C573 K574 L575 A576 E603 I604 P611 L615 N627	C573-V613 HydrophobicContact CB-CG1 4.23Å; C573-V613 HydrophobicContact CB-CG2 3.99Å; C573-V613 VanDerWaalsContact SG-CG2 3.55Å; K574-V613 PolarHBondContact O-N 3.09Å; L575-V613 HydrophobicContact CD2-CG2 3.92Å; A576-V613 PolarHBondContact N-O 3.27Å; E603-V613 CarbonylContact O-C 3.56Å; E603-V613 WeakPolarHBondContact O-CA 3.47Å; I604-V613 HydrophobicContact CG1-CG1 4.2Å; P611-V613 HydrophobicContact CB-CG1 4.25Å; V613-L615 HydrophobicContact CG2-CD2 4.22Å; V613-L615 HydrophobicContact CG2-CG 4.23Å; V613-N627 PolarHBondContact O-ND2 3.24Å
614	V	96.3	Very high	87	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.9	162.5	-170	0	0	0	0	108.2	A576 A602 E603 L605 Y616 N625 N627 F700	A576-V614 HydrophobicContact CB-CG2 4.03Å; A602-V614 WeakPolarHBondContact CA-O 3.27Å; E603-V614 HydrophobicContact CB-CB 4.15Å; E603-V614 PolarHBondContact N-O 3.23Å; E603-V614 PolarHBondContact O-N 3.37Å; L605-V614 HydrophobicContact CD1-CG2 3.84Å; L605-V614 HydrophobicContact CD2-CG2 4.45Å; L605-V614 HydrophobicContact CG-CG2 4.14Å; V614-Y616 HydrophobicContact CB-CE2 3.83Å; V614-Y616 HydrophobicContact CG1-CD2 4.35Å; V614-Y616 HydrophobicContact CG1-CE1 4.37Å; V614-Y616 HydrophobicContact CG1-CE2 3.58Å; V614-N625 WeakPolarHBondContact CG1-ND2 3.27Å; V614-N627 HydrophobicContact CG1-CB 4.35Å; V614-F700 HydrophobicContact CG1-CD2 4.39Å; V614-F700 HydrophobicContact CG2-CB 4.04Å; V614-F700 HydrophobicContact CG2-CD2 3.5Å; V614-F700 HydrophobicContact CG2-CE2 4.09Å; V614-F700 HydrophobicContact CG2-CG 3.82Å
615	L	95.4	Very high	87.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.6	-179.8	-64.9	174.2	0	0	0	110.9	V461 V463 L575 F591 L600 L601 A602 V613 I626 N627	V461-L615 HydrophobicContact CG2-CD2 3.75Å; V463-L615 HydrophobicContact CG2-CD1 3.96Å; L575-L615 HydrophobicContact CD2-CD1 3.61Å; L575-L615 HydrophobicContact CD2-CG 4.02Å; F591-L615 HydrophobicContact CE2-CD1 3.94Å; F591-L615 HydrophobicContact CZ-CD1 4.37Å; L600-L615 HydrophobicContact CD1-CB 4.11Å; L600-L615 HydrophobicContact CD1-CD1 4.27Å; L601-L615 WeakPolarHBondContact O-CA 3.32Å; A602-L615 HydrophobicContact CB-CD2 3.75Å; V613-L615 HydrophobicContact CG2-CD2 4.22Å; V613-L615 HydrophobicContact CG2-CG 4.23Å; L615-I626 HydrophobicContact CB-CB 4.12Å; L615-I626 HydrophobicContact CB-CG1 4.19Å; L615-I626 WeakPolarHBondContact O-CB 3.26Å; L615-I626 WeakPolarHBondContact O-CG1 3.45Å; L615-I626 PolarHBondContact O-N 3Å; L615-N627 PolarHBondContact N-OD1 2.93Å; L615-N627 VanDerWaalsContact N-OD1 3.08Å
616	Y	92.2	Very high	87.5	Confident	12 Å²	12	48 Å²	48	5%	0.047	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.3	177.7	-59.1	-95.5	0	0	0	111.2	L600 L601 E603 V614 V624 N625	L600-Y616 WeakPolarHBondContact CB-O 3.48Å; L601-Y616 PolarHBondContact N-O 3.3Å; L601-Y616 PolarHBondContact O-N 2.92Å; E603-Y616 HydrophobicContact CB-CE2 3.81Å; E603-Y616 VanDerWaalsContact OE2-CE2 3.25Å; E603-Y616 WeakPolarHBondContact OE2-CE2 3.34Å; E603-Y616 PolarHBondContact OE2-OH 3.34Å; V614-Y616 HydrophobicContact CB-CE2 3.83Å; V614-Y616 HydrophobicContact CG1-CD2 4.35Å; V614-Y616 HydrophobicContact CG1-CE1 4.37Å; V614-Y616 HydrophobicContact CG1-CE2 3.58Å; Y616-V624 WeakPolarHBondContact CA-O 3.32Å; Y616-N625 HydrophobicContact CD1-CB 3.92Å; Y616-N625 HydrophobicContact CE1-CB 3.72Å
617	D	87.3	Confident	87.9	Confident	7 Å²	7	44.1 Å²	44.1	4%	0.037	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.8	165.9	-171.9	-18.1	0	0	0	108.6	R598 L600 S619 V624 I626	R598-D617 IonicContact CZ-OD2 2.77Å; R598-D617 IonicContact NH1-OD2 3.63Å; R598-D617 PolarHBondContact NH1-OD2 3Å; L600-D617 HydrophobicContact CD2-CB 3.69Å; D617-S619 WeakPolarHBondContact OD1-CB 3.29Å; D617-S619 PolarHBondContact OD1-N 3.43Å; D617-S619 PolarHBondContact OD1-OG 2.83Å; D617-V624 HydrophobicContact CB-CB 4.41Å; D617-V624 PolarHBondContact N-O 2.84Å; D617-V624 PolarHBondContact O-N 2.79Å; D617-I626 HydrophobicContact CB-CD1 4Å
618	T	83.4	Confident	88.3	Confident	8 Å²	8	38.9 Å²	38.9	5%	0.049	23%	0.226	C	C	.	.			trans	-96.5	11.1	179.4	62.4	0	0	0	0	112.8	N102 R106 L601 Q620 D623	N102-T618 PolarHBondContact O-OG1 3.5Å; R106-T618 PolarHBondContact NH2-O 2.85Å; R106-T618 VanDerWaalsContact NH2-O 3.14Å; L601-T618 HydrophobicContact CB-CG2 4.31Å; L601-T618 HydrophobicContact CD2-CG2 4.34Å; T618-Q620 PolarHBondContact O-N 2.98Å; T618-D623 HydrophobicContact CG2-CB 4.37Å
619	S	75.6	Confident	88.7	Confident	81 Å²	81	39.1 Å²	39.1	57%	0.566	23%	0.227	S	C	*	.	S	Bend	trans	-78.3	-14.2	-172.4	68.2	0	0	0	0	115.8	D617	D617-S619 WeakPolarHBondContact OD1-CB 3.29Å; D617-S619 PolarHBondContact OD1-N 3.43Å; D617-S619 PolarHBondContact OD1-OG 2.83Å
620	Q	75.6	Confident	89.3	Confident	121 Å²	121	32.7 Å²	32.7	57%	0.565	19%	0.185	S	C	*	.	S	Bend	trans	-99.5	-157.6	-179.3	-65.2	-176.6	59.3	0	0	111	R106 T618	R106-Q620 PolarHBondContact NH1-O 2.99Å; R106-Q620 PolarHBondContact NH2-O 2.76Å; T618-Q620 PolarHBondContact O-N 2.98Å
621	D	71.7	Confident	89.4	Confident	150 Å²	150	31 Å²	31	80%	0.802	17%	0.174	S	C	*	.	S	Bend	trans	-86.3	-30.7	174.1	-76.1	-35.1	0	0	0	113.7	R106	R106-D621 PolarHBondContact NE-O 3.23Å; R106-D621 PolarHBondContact NH1-O 3.23Å
622	D	74.9	Confident	89.4	Confident	93 Å²	93	35.2 Å²	35.2	50%	0.497	19%	0.192	S	C	.	.	S	Bend	trans	-104.9	143.9	169.7	-83.3	-67.4	0	0	0	109.5	K108	K108-D622 WeakPolarHBondContact CE-OD1 3.48Å; K108-D622 IonicContact NZ-OD1 3.28Å; K108-D622 PolarHBondContact NZ-OD1 3.32Å
623	D	84.1	Confident	89.5	Confident	38 Å²	38	36 Å²	36	20%	0.203	20%	0.198	C	C	.	.			trans	-81.5	127.4	174.6	-59.3	-22.3	0	0	0	110.5	M105 R106 T618	M105-D623 VanDerWaalsContact CA-OD2 3.32Å; M105-D623 WeakPolarHBondContact CA-OD2 3.39Å; M105-D623 WeakPolarHBondContact CG-OD2 3.19Å; R106-D623 IonicContact CZ-OD1 3.51Å; R106-D623 PolarHBondContact N-OD2 3.38Å; R106-D623 IonicContact NE-OD1 2.7Å; R106-D623 PolarHBondContact NE-OD1 3.32Å; R106-D623 IonicContact NH2-OD1 3.48Å; R106-D623 PolarHBondContact NH2-OD1 3.32Å; T618-D623 HydrophobicContact CG2-CB 4.37Å
624	V	87.4	Confident	89.5	Confident	42 Å²	42	37.4 Å²	37.4	26%	0.255	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	112.1	-172.4	-175.9	0	0	0	0	111	M594 Y616 D617 I626	M594-V624 HydrophobicContact CE-CG1 3.72Å; Y616-V624 WeakPolarHBondContact CA-O 3.32Å; D617-V624 HydrophobicContact CB-CB 4.41Å; D617-V624 PolarHBondContact N-O 2.84Å; D617-V624 PolarHBondContact O-N 2.79Å; V624-I626 HydrophobicContact CG1-CD1 4.33Å; V624-I626 PolarHBondContact O-N 3.18Å
625	N	94.3	Very high	89.5	Confident	22 Å²	22	39.4 Å²	39.4	12%	0.118	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	110.5	171	-176.8	-47.6	0	0	0	110.6	V614 Y616 N627 A628 A629 C701	V614-N625 WeakPolarHBondContact CG1-ND2 3.27Å; Y616-N625 HydrophobicContact CD1-CB 3.92Å; Y616-N625 HydrophobicContact CE1-CB 3.72Å; N625-N627 PolarHBondContact OD1-N 2.97Å; N625-N627 VanDerWaalsContact OD1-N 3.14Å; N625-A628 HydrophobicContact CB-CB 4.14Å; N625-A628 WeakPolarHBondContact OD1-CB 3.3Å; N625-A628 PolarHBondContact OD1-N 3.01Å; N625-A629 PolarHBondContact O-N 2.9Å; N625-A629 VanDerWaalsContact O-N 3.15Å; N625-C701 PolarHBondContact ND2-O 2.81Å
626	I	95.2	Very high	89.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-69.3	-40.4	-176	-55.4	-50	0	0	0	111.2	F591 M594 A595 L600 L615 D617 V624 A628 A629 C630	F591-I626 HydrophobicContact CD2-CG2 4.07Å; F591-I626 HydrophobicContact CE2-CG2 4.4Å; M594-I626 HydrophobicContact CB-CD1 4.05Å; M594-I626 HydrophobicContact CB-CG2 4.34Å; M594-I626 HydrophobicContact CE-CD1 3.78Å; A595-I626 HydrophobicContact CB-CG2 4.38Å; L600-I626 HydrophobicContact CD1-CG1 4.2Å; L615-I626 HydrophobicContact CB-CB 4.12Å; L615-I626 HydrophobicContact CB-CG1 4.19Å; L615-I626 WeakPolarHBondContact O-CB 3.26Å; L615-I626 WeakPolarHBondContact O-CG1 3.45Å; L615-I626 PolarHBondContact O-N 3Å; D617-I626 HydrophobicContact CB-CD1 4Å; V624-I626 HydrophobicContact CG1-CD1 4.33Å; V624-I626 PolarHBondContact O-N 3.18Å; I626-A628 VanDerWaalsContact C-N 3.32Å; I626-A628 PolarHBondContact O-N 3.36Å; I626-A629 PolarHBondContact O-N 2.83Å; I626-C630 WeakPolarHBondContact O-CB 3.43Å; I626-C630 PolarHBondContact O-N 2.84Å
627	N	96.9	Very high	89.5	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.011	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-44.6	179.9	-61.3	34.8	0	0	0	111	A576 L578 V613 V614 L615 N625 C630 M631	A576-N627 PolarHBondContact N-ND2 2.82Å; A576-N627 PolarHBondContact O-ND2 2.97Å; L578-N627 HydrophobicContact CD1-CB 4.37Å; V613-N627 PolarHBondContact O-ND2 3.24Å; V614-N627 HydrophobicContact CG1-CB 4.35Å; L615-N627 PolarHBondContact N-OD1 2.93Å; L615-N627 VanDerWaalsContact N-OD1 3.08Å; N625-N627 PolarHBondContact OD1-N 2.97Å; N625-N627 VanDerWaalsContact OD1-N 3.14Å; N627-C630 WeakPolarHBondContact O-CB 3.43Å; N627-C630 PolarHBondContact O-N 2.86Å; N627-M631 PolarHBondContact O-N 3.44Å
628	A	94.9	Very high	89.8	Confident	10 Å²	10	54.7 Å²	54.7	8%	0.083	29%	0.292	C	S	.	.	H	α-helix	trans	-67.8	-36.3	177.3	0	0	0	0	0	112.4	N625 I626 M631 K632	N625-A628 HydrophobicContact CB-CB 4.14Å; N625-A628 WeakPolarHBondContact OD1-CB 3.3Å; N625-A628 PolarHBondContact OD1-N 3.01Å; I626-A628 VanDerWaalsContact C-N 3.32Å; I626-A628 PolarHBondContact O-N 3.36Å; A628-M631 PolarHBondContact O-N 3.22Å; A628-K632 VanDerWaalsContact O-CG 3.3Å; A628-K632 WeakPolarHBondContact O-CG 3.47Å; A628-K632 PolarHBondContact O-N 3.24Å
629	A	95	Very high	90.4	Very high	24 Å²	24	54.4 Å²	54.4	20%	0.198	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-42.8	173.6	0	0	0	0	0	112	M594 N625 I626 K632 S633	M594-A629 HydrophobicContact CE-CB 3.73Å; M594-A629 HydrophobicContact SD-CB 3.63Å; N625-A629 PolarHBondContact O-N 2.9Å; N625-A629 VanDerWaalsContact O-N 3.15Å; I626-A629 PolarHBondContact O-N 2.83Å; A629-K632 PolarHBondContact O-N 3.42Å; A629-S633 PolarHBondContact O-N 2.87Å
630	C	96.6	Very high	91.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-44.2	171.1	-79.1	0	0	0	0	112.2	L578 V587 I626 N627 K632 S633	L578-C630 HydrophobicContact CD1-CB 3.59Å; L578-C630 HydrophobicContact CD2-CB 3.86Å; L578-C630 HydrophobicContact CG-CB 4.37Å; V587-C630 HydrophobicContact CG1-CB 4.23Å; I626-C630 WeakPolarHBondContact O-CB 3.43Å; I626-C630 PolarHBondContact O-N 2.84Å; N627-C630 WeakPolarHBondContact O-CB 3.43Å; N627-C630 PolarHBondContact O-N 2.86Å; C630-K632 VanDerWaalsContact C-N 3.32Å; C630-K632 PolarHBondContact O-N 3.27Å; C630-S633 WeakPolarHBondContact O-CB 3.21Å; C630-S633 PolarHBondContact O-N 3.39Å; C630-S633 VanDerWaalsContact O-N 3.1Å; C630-S633 PolarHBondContact O-OG 2.85Å
631	M	95.7	Very high	91.8	Very high	19 Å²	19	47.6 Å²	47.6	9%	0.094	26%	0.259	C	S	.	.	H	α-helix	trans	-59.5	-41.4	173.8	-79.6	-65.7	-74.8	0	0	112.2	G577 L578 F581 N627 A628 S633 L634 V757	G577-M631 VanDerWaalsContact O-SD 3.32Å; L578-M631 HydrophobicContact CD2-CG 3.69Å; L578-M631 HydrophobicContact CD2-SD 3.66Å; L578-M631 HydrophobicContact CG-CG 4.32Å; L578-M631 HydrophobicContact CG-SD 4.49Å; F581-M631 HydrophobicContact CD2-CE 4.4Å; F581-M631 HydrophobicContact CD2-SD 3.8Å; F581-M631 HydrophobicContact CE2-CE 4.04Å; F581-M631 HydrophobicContact CE2-SD 4.05Å; N627-M631 PolarHBondContact O-N 3.44Å; A628-M631 PolarHBondContact O-N 3.22Å; M631-S633 PolarHBondContact O-N 3.11Å; M631-L634 WeakPolarHBondContact O-CB 3.34Å; M631-L634 PolarHBondContact O-N 3.46Å; M631-L634 HydrophobicContact SD-CD1 4.07Å; M631-V757 HydrophobicContact CE-CB 4.45Å; M631-V757 HydrophobicContact CE-CG1 3.79Å; M631-V757 HydrophobicContact CE-CG2 3.7Å
632	K	94.7	Very high	92.4	Very high	89 Å²	89	44.2 Å²	44.2	39%	0.387	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-22.8	176.7	-73	164.2	-175.4	171.6	0	112.8	A628 A629 C630 L634 Q635 E717	A628-K632 VanDerWaalsContact O-CG 3.3Å; A628-K632 WeakPolarHBondContact O-CG 3.47Å; A628-K632 PolarHBondContact O-N 3.24Å; A629-K632 PolarHBondContact O-N 3.42Å; C630-K632 VanDerWaalsContact C-N 3.32Å; C630-K632 PolarHBondContact O-N 3.27Å; K632-L634 PolarHBondContact O-N 3.06Å; K632-Q635 WeakPolarHBondContact O-CB 3.19Å; K632-Q635 WeakPolarHBondContact O-CG 3.13Å; K632-Q635 PolarHBondContact O-N 2.83Å; K632-E717 IonicContact NZ-OE1 3.62Å; K632-E717 PolarHBondContact NZ-OE1 2.86Å; K632-E717 IonicContact NZ-OE2 2.69Å
633	S	95.9	Very high	93.1	Very high	34 Å²	34	41.4 Å²	41.4	24%	0.238	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-16	176	80.9	0	0	0	0	114.9	A586 V587 T590 A629 C630 M631 Q635	A586-S633 PolarHBondContact O-OG 3.37Å; V587-S633 PolarHBondContact N-OG 2.88Å; T590-S633 WeakPolarHBondContact OG1-CB 3.29Å; A629-S633 PolarHBondContact O-N 2.87Å; C630-S633 WeakPolarHBondContact O-CB 3.21Å; C630-S633 PolarHBondContact O-N 3.39Å; C630-S633 VanDerWaalsContact O-N 3.1Å; C630-S633 PolarHBondContact O-OG 2.85Å; M631-S633 PolarHBondContact O-N 3.11Å; S633-Q635 VanDerWaalsContact C-N 3.28Å
634	L	96.3	Very high	93.5	Very high	34 Å²	34	45.5 Å²	45.5	18%	0.178	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-4.7	176.6	-64.4	167.9	0	0	0	113.5	F581 E584 V587 M631 K632 V757	F581-L634 HydrophobicContact CB-CD1 3.97Å; F581-L634 HydrophobicContact CD1-CD1 3.8Å; F581-L634 HydrophobicContact CD1-CD2 4.44Å; F581-L634 HydrophobicContact CD2-CD1 3.58Å; F581-L634 HydrophobicContact CE1-CD1 4.15Å; F581-L634 HydrophobicContact CE2-CD1 3.94Å; F581-L634 HydrophobicContact CG-CD1 3.49Å; F581-L634 VanDerWaalsContact CG-CD1 3.49Å; F581-L634 HydrophobicContact CZ-CD1 4.2Å; E584-L634 HydrophobicContact CB-CD2 3.98Å; E584-L634 HydrophobicContact CG-CD2 3.96Å; V587-L634 HydrophobicContact CG2-CD1 3.99Å; V587-L634 HydrophobicContact CG2-CD2 3.71Å; V587-L634 HydrophobicContact CG2-CG 3.74Å; M631-L634 WeakPolarHBondContact O-CB 3.34Å; M631-L634 PolarHBondContact O-N 3.46Å; M631-L634 HydrophobicContact SD-CD1 4.07Å; K632-L634 PolarHBondContact O-N 3.06Å; L634-V757 HydrophobicContact CB-CG1 3.9Å; L634-V757 HydrophobicContact CD1-CG1 3.9Å
635	Q	96.1	Very high	93.6	Very high	42 Å²	42	46.9 Å²	46.9	20%	0.196	26%	0.256	C	S	.	.			trans	-77.3	129.8	-174.4	-66.6	177.7	5.8	0	0	112.5	K632 S633 K637 P760	K632-Q635 WeakPolarHBondContact O-CB 3.19Å; K632-Q635 WeakPolarHBondContact O-CG 3.13Å; K632-Q635 PolarHBondContact O-N 2.83Å; S633-Q635 VanDerWaalsContact C-N 3.28Å; Q635-K637 PolarHBondContact O-N 2.9Å; Q635-P760 HydrophobicContact CB-CG 4.18Å
636	D	95.9	Very high	93.4	Very high	62 Å²	62	51.4 Å²	51.4	33%	0.332	28%	0.28	S	S	.	.			trans	-73.6	107.5	170.8	179.8	-4.7	0	0	0	109.6	T638 L639 S758 P760	D636-T638 PolarHBondContact O-N 2.94Å; D636-T638 VanDerWaalsContact O-N 3.13Å; D636-T638 WeakPolarHBondContact OD1-CA 3.33Å; D636-T638 VanDerWaalsContact OD1-CB 3.28Å; D636-T638 WeakPolarHBondContact OD1-CB 3.31Å; D636-T638 WeakPolarHBondContact OD1-CG2 3.31Å; D636-T638 PolarHBondContact OD1-N 2.97Å; D636-T638 PolarHBondContact OD1-OG1 3.49Å; D636-T638 PolarHBondContact OD2-OG1 2.8Å; D636-T638 VanDerWaalsContact OD2-OG1 3.05Å; D636-L639 HydrophobicContact CB-CD1 3.98Å; D636-L639 HydrophobicContact CB-CG 4.06Å; D636-L639 WeakPolarHBondContact O-CB 3.19Å; D636-L639 PolarHBondContact O-N 2.8Å; D636-S758 PolarHBondContact N-O 3.38Å; D636-P760 WeakPolarHBondContact O-CD 3.26Å; D636-P760 WeakPolarHBondContact O-CG 3.13Å
637	K	92.3	Very high	93.2	Very high	187 Å²	187	53.1 Å²	53.1	81%	0.813	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-59.7	-21.9	178.5	-61.7	-172.5	179.4	-171.5	0	113.2	Q635 L639 A640	Q635-K637 PolarHBondContact O-N 2.9Å; K637-L639 PolarHBondContact O-N 3.28Å; K637-A640 WeakPolarHBondContact O-CB 3.21Å; K637-A640 PolarHBondContact O-N 3.4Å
638	T	94.3	Very high	92.9	Very high	90 Å²	90	55 Å²	55	55%	0.552	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-74.6	-7.9	175.4	78.2	0	0	0	0	113.5	D636 R670	D636-T638 PolarHBondContact O-N 2.94Å; D636-T638 VanDerWaalsContact O-N 3.13Å; D636-T638 WeakPolarHBondContact OD1-CA 3.33Å; D636-T638 VanDerWaalsContact OD1-CB 3.28Å; D636-T638 WeakPolarHBondContact OD1-CB 3.31Å; D636-T638 WeakPolarHBondContact OD1-CG2 3.31Å; D636-T638 PolarHBondContact OD1-N 2.97Å; D636-T638 PolarHBondContact OD1-OG1 3.49Å; D636-T638 PolarHBondContact OD2-OG1 2.8Å; D636-T638 VanDerWaalsContact OD2-OG1 3.05Å; T638-R670 PolarHBondContact OG1-NH1 2.86Å; T638-R670 VanDerWaalsContact OG1-NH1 3.14Å
639	L	95.9	Very high	92.8	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.016	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-102.9	3.8	174.4	-56.5	180	0	0	0	112.7	D636 K637 R670 G671 K674 I759 Q762	D636-L639 HydrophobicContact CB-CD1 3.98Å; D636-L639 HydrophobicContact CB-CG 4.06Å; D636-L639 WeakPolarHBondContact O-CB 3.19Å; D636-L639 PolarHBondContact O-N 2.8Å; K637-L639 PolarHBondContact O-N 3.28Å; L639-R670 HydrophobicContact CD2-CB 4.34Å; L639-R670 HydrophobicContact CD2-CG 3.81Å; L639-G671 WeakPolarHBondContact O-CA 3.21Å; L639-K674 HydrophobicContact CD1-CD 3.86Å; L639-I759 HydrophobicContact CD1-CG1 3.9Å; L639-Q762 PolarHBondContact O-NE2 2.93Å
640	A	91.9	Very high	92.5	Very high	39 Å²	39	59 Å²	59	32%	0.322	32%	0.32	S	S	.	.	S	Bend	trans	-71.6	162.2	169.6	0	0	0	0	0	111.4	K637 P760	K637-A640 WeakPolarHBondContact O-CB 3.21Å; K637-A640 PolarHBondContact O-N 3.4Å; A640-P760 HydrophobicContact CB-CB 4.42Å; A640-P760 HydrophobicContact CB-CG 4.09Å
641	S	88.8	Confident	92.2	Very high	20 Å²	20	62.7 Å²	62.7	14%	0.14	34%	0.34	C	S	.	.			trans	-61.4	129	169	-53.7	0	0	0	0	109.8	L643 V764	S641-L643 PolarHBondContact O-N 3.25Å; S641-V764 WeakPolarHBondContact OG-CG2 3.29Å
642	P	84	Confident	92	Very high	79 Å²	79	61.8 Å²	61.8	51%	0.513	34%	0.336	S	S	.	.			trans	-81	55	-170.6	34.7	-38.3	0	0	0	112.1	Y649	P642-Y649 WeakPolarHBondContact O-CE1 3.28Å; P642-Y649 PolarHBondContact O-OH 2.86Å
643	L	89.9	Confident	91.9	Very high	33 Å²	33	60.5 Å²	60.5	17%	0.173	34%	0.335	C	S	.	.			trans	-74.6	142.2	-176.3	-58.2	176.5	0	0	0	111.1	S641 Y649 L667 V764 M798 V800 M803 V810	S641-L643 PolarHBondContact O-N 3.25Å; L643-Y649 VanDerWaalsContact CA-OH 3.29Å; L643-Y649 WeakPolarHBondContact CA-OH 3.39Å; L643-Y649 HydrophobicContact CD2-CD2 4.32Å; L643-Y649 HydrophobicContact CD2-CE2 4.12Å; L643-L667 HydrophobicContact CD2-CD1 4.3Å; L643-L667 HydrophobicContact CD2-CD2 3.74Å; L643-V764 HydrophobicContact CD1-CB 4.4Å; L643-V764 HydrophobicContact CD1-CG1 3.55Å; L643-V764 HydrophobicContact CD1-CG2 3.92Å; L643-M798 HydrophobicContact CD2-SD 4.42Å; L643-V800 HydrophobicContact CD2-CG2 4.31Å; L643-M803 VanDerWaalsContact C-CE 3.42Å; L643-M803 HydrophobicContact CB-CE 3.39Å; L643-M803 WeakPolarHBondContact O-CE 3.4Å; L643-V810 HydrophobicContact CD1-CG2 3.94Å
644	Q	90.6	Very high	91.8	Very high	124 Å²	124	59.1 Å²	59.1	58%	0.579	33%	0.326	S	S	*	.			trans	-144	142.1	176.9	-68	178.7	-10.6	0	0	108.8	S647 Y649 V800	Q644-S647 WeakPolarHBondContact O-CB 3.35Å; Q644-S647 PolarHBondContact O-N 3.07Å; Q644-Y649 PolarHBondContact N-OH 2.83Å; Q644-V800 WeakPolarHBondContact O-CB 3.28Å
645	V	91.3	Very high	91.5	Very high	72 Å²	72	58.4 Å²	58.4	44%	0.436	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	140.4	178.2	-178.8	0	0	0	0	110.2	S647 V800 M803	V645-S647 PolarHBondContact O-N 3.24Å; V645-V800 HydrophobicContact CG2-CG1 4.46Å; V645-M803 HydrophobicContact CG2-CE 4.49Å; V645-M803 HydrophobicContact CG2-CG 3.99Å; V645-M803 HydrophobicContact CG2-SD 4.14Å
646	N	89.1	Confident	91.1	Very high	117 Å²	117	57.4 Å²	57.4	63%	0.626	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-6.3	-172.2	-60.2	-54.3	0	0	0	116.6	K799 V800	N646-K799 WeakPolarHBondContact O-CE 3.36Å; N646-V800 VanDerWaalsContact CA-O 3.3Å; N646-V800 WeakPolarHBondContact CA-O 3.43Å; N646-V800 PolarHBondContact N-O 3.26Å
647	S	91.4	Very high	90.8	Very high	36 Å²	36	54.8 Å²	54.8	25%	0.252	31%	0.307	S	S	.	.			trans	-78.7	149.1	175.5	-65.9	0	0	0	0	112.4	Q644 V645 Y649 K799 V800	Q644-S647 WeakPolarHBondContact O-CB 3.35Å; Q644-S647 PolarHBondContact O-N 3.07Å; V645-S647 PolarHBondContact O-N 3.24Å; S647-Y649 WeakPolarHBondContact CB-OH 3.47Å; S647-K799 WeakPolarHBondContact O-CA 3.47Å; S647-V800 PolarHBondContact O-N 2.88Å
648	A	90.7	Very high	90.5	Very high	41 Å²	41	47 Å²	47	34%	0.339	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	145	176.8	0	0	0	0	0	111.1	M798 K799 F820	A648-M798 CarbonylContact C-O 3.38Å; A648-M798 VanDerWaalsContact CA-O 3.31Å; A648-M798 WeakPolarHBondContact CA-O 3.23Å; A648-K799 HydrophobicContact CB-CB 4.41Å; A648-K799 HydrophobicContact CB-CG 4.44Å; A648-F820 HydrophobicContact CB-CD2 3.59Å; A648-F820 HydrophobicContact CB-CE2 3.58Å; A648-F820 HydrophobicContact CB-CG 4.32Å; A648-F820 HydrophobicContact CB-CZ 4.3Å
649	Y	91.5	Very high	89.9	Confident	37 Å²	37	47.2 Å²	47.2	15%	0.145	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140.5	-175	-58.7	-93.4	0	0	0	109.7	P642 L643 Q644 S647 L667 S797 M798 V800	P642-Y649 WeakPolarHBondContact O-CE1 3.28Å; P642-Y649 PolarHBondContact O-OH 2.86Å; L643-Y649 VanDerWaalsContact CA-OH 3.29Å; L643-Y649 WeakPolarHBondContact CA-OH 3.39Å; L643-Y649 HydrophobicContact CD2-CD2 4.32Å; L643-Y649 HydrophobicContact CD2-CE2 4.12Å; Q644-Y649 PolarHBondContact N-OH 2.83Å; S647-Y649 WeakPolarHBondContact CB-OH 3.47Å; Y649-L667 HydrophobicContact CD1-CD2 3.89Å; Y649-L667 HydrophobicContact CD2-CD2 4.41Å; Y649-L667 HydrophobicContact CG-CD2 3.71Å; Y649-S797 CarbonylContact O-C 3.57Å; Y649-S797 VanDerWaalsContact O-CA 3.23Å; Y649-S797 WeakPolarHBondContact O-CA 3.36Å; Y649-S797 WeakPolarHBondContact O-CB 3.48Å; Y649-M798 HydrophobicContact CD2-CG 4.19Å; Y649-M798 PolarHBondContact N-O 2.95Å; Y649-M798 PolarHBondContact O-N 2.7Å; Y649-V800 HydrophobicContact CD2-CG2 4.26Å; Y649-V800 HydrophobicContact CE2-CG2 3.89Å
650	M	90.4	Very high	89.1	Confident	81 Å²	81	49.6 Å²	49.6	40%	0.399	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	166.1	-178.4	-58.3	-177	75.7	0	0	110.9	V652 K818 F820	M650-V652 PolarHBondContact O-N 3.45Å; M650-K818 HydrophobicContact CE-CB 3.72Å; M650-K818 HydrophobicContact CE-CD 3.9Å; M650-K818 HydrophobicContact CE-CG 3.73Å; M650-F820 HydrophobicContact CE-CE1 4.3Å; M650-F820 HydrophobicContact CG-CD1 4.48Å; M650-F820 HydrophobicContact CG-CE1 3.93Å; M650-F820 HydrophobicContact SD-CE1 3.92Å
651	N	90	Very high	88.6	Confident	77 Å²	77	47.9 Å²	47.9	41%	0.412	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.3	38.5	-178.9	-47.3	-20	0	0	0	111.5	P668 C796	N651-P668 HydrophobicContact CB-CG 4.07Å; N651-P668 WeakPolarHBondContact O-CD 3.37Å; N651-C796 PolarHBondContact N-O 2.89Å
652	V	91.8	Very high	88.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	126.3	175.7	179.4	0	0	0	0	108.2	M650 C665 L667 C796 M798	M650-V652 PolarHBondContact O-N 3.45Å; V652-C665 HydrophobicContact CG1-CB 3.88Å; V652-L667 HydrophobicContact CG2-CD2 4.3Å; V652-L667 HydrophobicContact CG2-CG 4.27Å; V652-C796 HydrophobicContact CB-CB 4.25Å; V652-C796 WeakPolarHBondContact CB-O 3.32Å; V652-C796 PolarHBondContact N-O 2.91Å; V652-C796 VanDerWaalsContact O-CB 3.26Å; V652-C796 WeakPolarHBondContact O-CB 3.36Å; V652-C796 PolarHBondContact O-N 3.45Å; V652-C796 VanDerWaalsContact O-N 3.11Å; V652-M798 HydrophobicContact CB-CE 4.41Å; V652-M798 HydrophobicContact CG1-CE 3.46Å; V652-M798 VanDerWaalsContact CG1-CE 3.46Å; V652-M798 HydrophobicContact CG2-CB 4.3Å; V652-M798 HydrophobicContact CG2-CE 4.03Å; V652-M798 HydrophobicContact CG2-CG 3.98Å
653	T	92	Very high	89	Confident	62 Å²	62	43.8 Å²	43.8	38%	0.38	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.9	170	-57.9	0	0	0	0	108.7	S655 C665 Q666	T653-S655 PolarHBondContact O-N 2.87Å; T653-C665 CarbonylContact O-C 3.59Å; T653-C665 WeakPolarHBondContact O-CA 3.24Å; T653-Q666 PolarHBondContact N-O 3.41Å; T653-Q666 PolarHBondContact O-N 2.64Å
654	V	92.7	Very high	89.1	Confident	6 Å²	6	43.4 Å²	43.4	4%	0.036	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.7	167	-179.3	0	0	0	0	108.5	V657 I663 V790 L791 L814	V654-V657 HydrophobicContact CG1-CG2 3.93Å; V654-I663 HydrophobicContact CG1-CG2 3.47Å; V654-I663 VanDerWaalsContact CG1-CG2 3.47Å; V654-I663 HydrophobicContact CG2-CG2 4.3Å; V654-V790 HydrophobicContact CB-CB 3.91Å; V654-V790 HydrophobicContact CB-CG2 3.88Å; V654-V790 HydrophobicContact CG1-CB 4.09Å; V654-V790 HydrophobicContact CG1-CG2 3.51Å; V654-V790 HydrophobicContact CG2-CB 3.95Å; V654-V790 HydrophobicContact CG2-CG2 4.3Å; V654-L791 HydrophobicContact CG1-CD2 4.29Å; V654-L814 HydrophobicContact CG2-CD1 4.24Å; V654-L814 HydrophobicContact CG2-CD2 4.03Å
655	S	90.2	Very high	89.3	Confident	19 Å²	19	37.5 Å²	37.5	13%	0.133	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-22	-170.4	55.2	0	0	0	0	113.7	T653 Y664 V734	T653-S655 PolarHBondContact O-N 2.87Å; S655-Y664 PolarHBondContact N-O 3.01Å; S655-Y664 PolarHBondContact OG-O 2.84Å; S655-V734 VanDerWaalsContact CB-O 3.23Å; S655-V734 WeakPolarHBondContact CB-O 3.33Å; S655-V734 PolarHBondContact OG-O 3.32Å
656	S	89.4	Confident	89.4	Confident	21 Å²	21	35.8 Å²	35.8	15%	0.147	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	150.4	177.5	-172.9	0	0	0	0	111.6	Y664 G735	S656-Y664 PolarHBondContact O-N 2.81Å; S656-G735 WeakPolarHBondContact CB-O 3.29Å; S656-G735 PolarHBondContact OG-O 3.04Å; S656-G735 VanDerWaalsContact OG-O 3.12Å
657	V	89	Confident	89.5	Confident	6 Å²	6	30.5 Å²	30.5	4%	0.036	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	114.1	171.6	-178.8	0	0	0	0	108.7	V654 T662 V783 L786 R787 V790 L791	V654-V657 HydrophobicContact CG1-CG2 3.93Å; V657-T662 WeakPolarHBondContact CA-O 3.46Å; V657-V783 HydrophobicContact CG1-CG1 4.4Å; V657-L786 HydrophobicContact CG1-CD2 3.79Å; V657-L786 HydrophobicContact CG1-CG 4.17Å; V657-R787 HydrophobicContact CB-CG 3.77Å; V657-R787 HydrophobicContact CG1-CG 4.05Å; V657-R787 HydrophobicContact CG2-CG 4.33Å; V657-R787 PolarHBondContact O-NE 3.33Å; V657-R787 PolarHBondContact O-NH2 3.48Å; V657-V790 HydrophobicContact CG2-CG2 3.68Å; V657-L791 HydrophobicContact CG2-CD2 4.22Å; V657-L791 HydrophobicContact CG2-CG 4.46Å
658	C	85	Confident	89.6	Confident	25 Å²	25	32.6 Å²	32.6	17%	0.169	19%	0.194	C	C	.	.			trans	-81.1	164.7	-178.5	-65.4	0	0	0	0	112.2	D660 G661 T662	C658-D660 VanDerWaalsContact C-N 3.26Å; C658-D660 WeakPolarHBondContact CB-OD1 3.46Å; C658-D660 PolarHBondContact O-N 3.04Å; C658-G661 PolarHBondContact O-N 3.04Å; C658-T662 PolarHBondContact N-O 2.91Å
659	S	81.5	Confident	89.7	Confident	93 Å²	93	31.5 Å²	31.5	65%	0.65	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.5	178.8	43.3	0	0	0	0	114.1	G661 V783	S659-G661 VanDerWaalsContact C-N 3.28Å; S659-V783 WeakPolarHBondContact O-CG2 3.39Å
660	D	80.6	Confident	89.9	Confident	53 Å²	53	37.8 Å²	37.8	28%	0.283	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	0.7	175.9	71	-25.4	0	0	0	113.5	C658 T662 V775 W778	C658-D660 VanDerWaalsContact C-N 3.26Å; C658-D660 WeakPolarHBondContact CB-OD1 3.46Å; C658-D660 PolarHBondContact O-N 3.04Å; D660-T662 VanDerWaalsContact C-N 3.35Å; D660-T662 VanDerWaalsContact CG-OG1 3.31Å; D660-T662 WeakPolarHBondContact OD1-CB 3.4Å; D660-T662 PolarHBondContact OD1-N 3.13Å; D660-T662 PolarHBondContact OD1-OG1 2.88Å; D660-T662 PolarHBondContact OD2-OG1 2.67Å; D660-V775 HydrophobicContact CB-CG1 4.26Å; D660-W778 VanDerWaalsContact O-CD1 3.29Å
661	G	81.6	Confident	90.3	Very high	4 Å²	4	34 Å²	34	4%	0.041	19%	0.188	C	C	.	.	S	Bend	trans	83.4	2.5	-173.2	0	0	0	0	0	115.1	C658 S659 I663	C658-G661 PolarHBondContact O-N 3.04Å; S659-G661 VanDerWaalsContact C-N 3.28Å; G661-I663 PolarHBondContact O-N 3.08Å
662	T	88	Confident	90.5	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.08	18%	0.176	C	C	.	.			trans	-63.1	130.4	170.4	-68.6	0	0	0	0	109.4	V657 C658 D660 Y664 K765	V657-T662 WeakPolarHBondContact CA-O 3.46Å; C658-T662 PolarHBondContact N-O 2.91Å; D660-T662 VanDerWaalsContact C-N 3.35Å; D660-T662 VanDerWaalsContact CG-OG1 3.31Å; D660-T662 WeakPolarHBondContact OD1-CB 3.4Å; D660-T662 PolarHBondContact OD1-N 3.13Å; D660-T662 PolarHBondContact OD1-OG1 2.88Å; D660-T662 PolarHBondContact OD2-OG1 2.67Å; T662-Y664 HydrophobicContact CG2-CD2 4.03Å; T662-Y664 HydrophobicContact CG2-CE2 3.5Å; T662-K765 HydrophobicContact CG2-CD 4.22Å; T662-K765 VanDerWaalsContact CG2-CE 3.5Å; T662-K765 HydrophobicContact CG2-CG 3.68Å
663	I	91.5	Very high	90.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.8	175.6	-54.4	178.4	0	0	0	108.1	V654 G661 C766 L768 L786 L814	V654-I663 HydrophobicContact CG1-CG2 3.47Å; V654-I663 VanDerWaalsContact CG1-CG2 3.47Å; V654-I663 HydrophobicContact CG2-CG2 4.3Å; G661-I663 PolarHBondContact O-N 3.08Å; I663-C766 HydrophobicContact CB-CB 4.18Å; I663-C766 PolarHBondContact N-O 3.1Å; I663-C766 WeakPolarHBondContact O-CA 3.23Å; I663-C766 PolarHBondContact O-N 2.77Å; I663-L768 HydrophobicContact CD1-CD1 4.33Å; I663-L768 HydrophobicContact CD1-CD2 3.47Å; I663-L768 VanDerWaalsContact CD1-CD2 3.47Å; I663-L768 HydrophobicContact CD1-CG 3.71Å; I663-L786 HydrophobicContact CD1-CD1 4.41Å; I663-L786 HydrophobicContact CD1-CD2 3.83Å; I663-L786 HydrophobicContact CG1-CD2 4.06Å; I663-L814 HydrophobicContact CD1-CD2 4.04Å
664	Y	93.5	Very high	91.1	Very high	24 Å²	24	34.2 Å²	34.2	9%	0.094	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.5	166.6	-69.4	-94.3	0	0	0	110.6	S655 S656 T662 G735 A763 V764 K765	S655-Y664 PolarHBondContact N-O 3.01Å; S655-Y664 PolarHBondContact OG-O 2.84Å; S656-Y664 PolarHBondContact O-N 2.81Å; T662-Y664 HydrophobicContact CG2-CD2 4.03Å; T662-Y664 HydrophobicContact CG2-CE2 3.5Å; Y664-G735 VanDerWaalsContact CD2-O 3.3Å; Y664-G735 WeakPolarHBondContact CD2-O 3.39Å; Y664-G735 VanDerWaalsContact CG-CA 3.48Å; Y664-A763 HydrophobicContact CD1-CB 4.11Å; Y664-V764 WeakPolarHBondContact CA-O 3.46Å; Y664-K765 HydrophobicContact CD1-CB 4.15Å; Y664-K765 HydrophobicContact CD1-CG 4.48Å; Y664-K765 HydrophobicContact CE1-CB 3.76Å; Y664-K765 HydrophobicContact CE1-CD 4.47Å; Y664-K765 HydrophobicContact CE1-CG 3.88Å
665	C	93.9	Very high	91.3	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.8	-175.6	-63.6	0	0	0	0	110.8	V652 T653 V764 M798	V652-C665 HydrophobicContact CG1-CB 3.88Å; T653-C665 CarbonylContact O-C 3.59Å; T653-C665 WeakPolarHBondContact O-CA 3.24Å; C665-V764 PolarHBondContact N-O 3.07Å; C665-V764 WeakPolarHBondContact O-CB 3.16Å; C665-V764 PolarHBondContact O-N 3.36Å; C665-M798 HydrophobicContact CB-CE 3.43Å; C665-M798 VanDerWaalsContact CB-CE 3.43Å
666	Q	93.4	Very high	91.6	Very high	37 Å²	37	37.4 Å²	37.4	17%	0.173	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	140.2	166.2	-60.7	-177.5	-72.5	0	0	109.2	T653 D733	T653-Q666 PolarHBondContact N-O 3.41Å; T653-Q666 PolarHBondContact O-N 2.64Å; Q666-D733 VanDerWaalsContact CD-O 3.32Å; Q666-D733 WeakPolarHBondContact CG-O 3.07Å; Q666-D733 PolarHBondContact NE2-O 2.93Å
667	L	91.8	Very high	92.1	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	22%	0.224	C	C	.	.			trans	-124.3	146.5	177.5	-61.5	90.4	0	0	0	109.8	L643 Y649 V652 S669 L672 V764 M798	L643-L667 HydrophobicContact CD2-CD1 4.3Å; L643-L667 HydrophobicContact CD2-CD2 3.74Å; Y649-L667 HydrophobicContact CD1-CD2 3.89Å; Y649-L667 HydrophobicContact CD2-CD2 4.41Å; Y649-L667 HydrophobicContact CG-CD2 3.71Å; V652-L667 HydrophobicContact CG2-CD2 4.3Å; V652-L667 HydrophobicContact CG2-CG 4.27Å; L667-S669 PolarHBondContact O-N 3.08Å; L667-S669 VanDerWaalsContact O-N 3.09Å; L667-L672 WeakPolarHBondContact O-CD2 3.47Å; L667-V764 HydrophobicContact CD1-CB 4.25Å; L667-V764 HydrophobicContact CD1-CG2 3.55Å; L667-M798 HydrophobicContact CD1-CE 3.85Å; L667-M798 HydrophobicContact CD2-CE 4.1Å; L667-M798 HydrophobicContact CD2-SD 4.17Å; L667-M798 HydrophobicContact CG-CE 4.11Å
668	P	92.4	Very high	92.5	Very high	81 Å²	81	41.2 Å²	41.2	53%	0.526	22%	0.224	S	C	.	.			trans	-56.5	116.4	169.7	-23	33.6	0	0	0	110.3	N651	N651-P668 HydrophobicContact CB-CG 4.07Å; N651-P668 WeakPolarHBondContact O-CD 3.37Å
669	S	94.3	Very high	93.1	Very high	18 Å²	18	40.9 Å²	40.9	13%	0.126	22%	0.22	C	C	.	.			trans	-144.2	160.4	-176.8	87.1	0	0	0	0	110.6	L667 G671 L672 A673 Q762	L667-S669 PolarHBondContact O-N 3.08Å; L667-S669 VanDerWaalsContact O-N 3.09Å; S669-G671 PolarHBondContact O-N 2.93Å; S669-G671 PolarHBondContact OG-N 3.06Å; S669-L672 PolarHBondContact O-N 2.85Å; S669-L672 WeakPolarHBondContact OG-CB 3.27Å; S669-L672 PolarHBondContact OG-N 2.99Å; S669-A673 PolarHBondContact O-N 2.86Å; S669-A673 VanDerWaalsContact O-N 3.11Å; S669-Q762 PolarHBondContact OG-OE1 3.26Å
670	R	96	Very high	93.8	Very high	169 Å²	169	42.7 Å²	42.7	64%	0.638	22%	0.218	S	C	*	.	H	α-helix	trans	-61	-36.1	171.5	-175.1	-178.2	174.3	-138.5	0.2	111.7	T638 L639 K674	T638-R670 PolarHBondContact OG1-NH1 2.86Å; T638-R670 VanDerWaalsContact OG1-NH1 3.14Å; L639-R670 HydrophobicContact CD2-CB 4.34Å; L639-R670 HydrophobicContact CD2-CG 3.81Å; R670-K674 WeakPolarHBondContact O-CB 3.38Å; R670-K674 PolarHBondContact O-N 2.93Å
671	G	96.9	Very high	94.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-46.1	176.4	0	0	0	0	0	112.8	L639 S669 A673 K674 L675	L639-G671 WeakPolarHBondContact O-CA 3.21Å; S669-G671 PolarHBondContact O-N 2.93Å; S669-G671 PolarHBondContact OG-N 3.06Å; G671-A673 PolarHBondContact O-N 3.39Å; G671-K674 PolarHBondContact O-N 2.86Å; G671-L675 VanDerWaalsContact O-CB 3.22Å; G671-L675 WeakPolarHBondContact O-CB 3.1Å; G671-L675 PolarHBondContact O-N 2.83Å
672	L	95.8	Very high	95.2	Very high	28 Å²	28	44.6 Å²	44.6	15%	0.147	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-38.9	179.2	-177.5	60.6	0	0	0	111.5	L667 S669 L675 N676 Q762	L667-L672 WeakPolarHBondContact O-CD2 3.47Å; S669-L672 PolarHBondContact O-N 2.85Å; S669-L672 WeakPolarHBondContact OG-CB 3.27Å; S669-L672 PolarHBondContact OG-N 2.99Å; L672-L675 HydrophobicContact CD1-CD2 4.37Å; L672-N676 VanDerWaalsContact O-CG 3.29Å; L672-N676 PolarHBondContact O-N 2.84Å; L672-N676 VanDerWaalsContact O-N 3.07Å; L672-N676 PolarHBondContact O-ND2 2.9Å; L672-N676 VanDerWaalsContact O-ND2 3.12Å; L672-Q762 HydrophobicContact CB-CG 4.43Å; L672-Q762 HydrophobicContact CD1-CB 4.19Å
673	A	96.9	Very high	95.4	Very high	62 Å²	62	45.4 Å²	45.4	51%	0.512	23%	0.226	S	C	.	.	H	α-helix	trans	-62.5	-51.2	172.9	0	0	0	0	0	111.9	S669 G671 L675 N676 E677	S669-A673 PolarHBondContact O-N 2.86Å; S669-A673 VanDerWaalsContact O-N 3.11Å; G671-A673 PolarHBondContact O-N 3.39Å; A673-L675 VanDerWaalsContact C-N 3.31Å; A673-L675 PolarHBondContact O-N 2.83Å; A673-N676 PolarHBondContact O-N 3.26Å; A673-E677 PolarHBondContact O-N 3.04Å; A673-E677 VanDerWaalsContact O-N 3.16Å
674	K	98	Very high	95.3	Very high	55 Å²	55	50 Å²	50	24%	0.239	25%	0.25	C	S	.	.	H	α-helix	trans	-60.6	-39.5	177.6	-165.8	-168.2	178.6	-158.8	0	111.8	L639 R670 G671 E677 I678 D755 S758 I759	L639-K674 HydrophobicContact CD1-CD 3.86Å; R670-K674 WeakPolarHBondContact O-CB 3.38Å; R670-K674 PolarHBondContact O-N 2.93Å; G671-K674 PolarHBondContact O-N 2.86Å; K674-E677 PolarHBondContact O-N 3Å; K674-I678 HydrophobicContact CD-CD1 4.33Å; K674-I678 HydrophobicContact CG-CD1 3.96Å; K674-I678 WeakPolarHBondContact O-CD1 3.18Å; K674-I678 WeakPolarHBondContact O-CG1 3.3Å; K674-I678 PolarHBondContact O-N 2.89Å; K674-I678 VanDerWaalsContact O-N 3.07Å; K674-D755 IonicContact NZ-OD1 2.71Å; K674-D755 PolarHBondContact NZ-OD1 2.74Å; K674-S758 PolarHBondContact NZ-OG 2.86Å; K674-I759 HydrophobicContact CB-CD1 4.18Å; K674-I759 HydrophobicContact CD-CD1 3.98Å; K674-I759 HydrophobicContact CD-CG1 4.18Å; K674-I759 HydrophobicContact CG-CD1 4.07Å
675	L	98.2	Very high	95	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-49.8	177.6	175.4	66.5	0	0	0	111.5	G671 L672 A673 E677 I678 L679 R715 D733 I759 Q762	G671-L675 VanDerWaalsContact O-CB 3.22Å; G671-L675 WeakPolarHBondContact O-CB 3.1Å; G671-L675 PolarHBondContact O-N 2.83Å; L672-L675 HydrophobicContact CD1-CD2 4.37Å; A673-L675 VanDerWaalsContact C-N 3.31Å; A673-L675 PolarHBondContact O-N 2.83Å; L675-E677 VanDerWaalsContact C-N 3.32Å; L675-E677 PolarHBondContact O-N 3.03Å; L675-I678 PolarHBondContact O-N 2.75Å; L675-L679 HydrophobicContact CD1-CD1 3.82Å; L675-L679 HydrophobicContact CD1-CG 4.04Å; L675-L679 HydrophobicContact CD2-CD1 4.45Å; L675-L679 HydrophobicContact CG-CD1 3.84Å; L675-L679 HydrophobicContact CG-CG 4.38Å; L675-L679 WeakPolarHBondContact O-CB 3.48Å; L675-L679 WeakPolarHBondContact O-CG 3.25Å; L675-L679 PolarHBondContact O-N 2.96Å; L675-R715 HydrophobicContact CD1-CG 4.08Å; L675-D733 HydrophobicContact CD2-CB 3.81Å; L675-D733 VanDerWaalsContact CD2-OD2 3.3Å; L675-D733 WeakPolarHBondContact CD2-OD2 3.41Å; L675-I759 HydrophobicContact CB-CD1 4.17Å; L675-I759 HydrophobicContact CB-CG2 4.4Å; L675-Q762 HydrophobicContact CD2-CB 4.25Å; L675-Q762 HydrophobicContact CD2-CG 3.82Å
676	N	97	Very high	94.5	Very high	90 Å²	90	52 Å²	52	48%	0.481	26%	0.259	S	S	.	.	H	α-helix	trans	-61.2	-41.9	179.8	-72.9	-32.7	0	0	0	111.5	L672 A673 I678 L679 E680	L672-N676 VanDerWaalsContact O-CG 3.29Å; L672-N676 PolarHBondContact O-N 2.84Å; L672-N676 VanDerWaalsContact O-N 3.07Å; L672-N676 PolarHBondContact O-ND2 2.9Å; L672-N676 VanDerWaalsContact O-ND2 3.12Å; A673-N676 PolarHBondContact O-N 3.26Å; N676-I678 PolarHBondContact O-N 3.12Å; N676-L679 PolarHBondContact O-N 3.27Å; N676-E680 WeakPolarHBondContact O-CB 3.19Å; N676-E680 PolarHBondContact O-N 2.92Å
677	E	98.1	Very high	93.8	Very high	100 Å²	100	56.5 Å²	56.5	47%	0.467	28%	0.279	S	S	.	.	H	α-helix	trans	-59.7	-43.4	175.5	-168.9	-160.6	147.4	0	0	112.3	A673 K674 L675 K681	A673-E677 PolarHBondContact O-N 3.04Å; A673-E677 VanDerWaalsContact O-N 3.16Å; K674-E677 PolarHBondContact O-N 3Å; L675-E677 VanDerWaalsContact C-N 3.32Å; L675-E677 PolarHBondContact O-N 3.03Å; E677-K681 WeakPolarHBondContact O-CG 3.4Å; E677-K681 PolarHBondContact O-N 3.08Å; E677-K681 VanDerWaalsContact O-N 3.16Å; E677-K681 WeakPolarHBondContact OE1-CE 3.23Å; E677-K681 IonicContact OE1-NZ 3.21Å; E677-K681 PolarHBondContact OE1-NZ 2.61Å
678	I	98.1	Very high	92.7	Very high	7 Å²	7	61 Å²	61	4%	0.036	31%	0.307	C	S	.	.	H	α-helix	trans	-71.6	-41.6	178.8	-66.8	159.2	0	0	0	111.3	K674 L675 N676 E680 K681 I682 F752 D755 L756 I759	K674-I678 HydrophobicContact CD-CD1 4.33Å; K674-I678 HydrophobicContact CG-CD1 3.96Å; K674-I678 WeakPolarHBondContact O-CD1 3.18Å; K674-I678 WeakPolarHBondContact O-CG1 3.3Å; K674-I678 PolarHBondContact O-N 2.89Å; K674-I678 VanDerWaalsContact O-N 3.07Å; L675-I678 PolarHBondContact O-N 2.75Å; N676-I678 PolarHBondContact O-N 3.12Å; I678-E680 VanDerWaalsContact C-N 3.28Å; I678-E680 PolarHBondContact O-N 2.87Å; I678-K681 WeakPolarHBondContact O-CB 3.49Å; I678-K681 PolarHBondContact O-N 3.38Å; I678-K681 VanDerWaalsContact O-N 3.17Å; I678-I682 HydrophobicContact CG2-CD1 3.86Å; I678-I682 HydrophobicContact CG2-CG1 4.44Å; I678-I682 WeakPolarHBondContact O-CG1 3.48Å; I678-I682 PolarHBondContact O-N 2.81Å; I678-F752 HydrophobicContact CG2-CB 4.31Å; I678-F752 HydrophobicContact CG2-CD1 4.43Å; I678-D755 HydrophobicContact CD1-CB 3.92Å; I678-L756 HydrophobicContact CG2-CB 4.38Å; I678-L756 HydrophobicContact CG2-CD1 4.23Å; I678-I759 HydrophobicContact CD1-CD1 3.68Å
679	L	97.7	Very high	91.3	Very high	18 Å²	18	61.1 Å²	61.1	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-33	177.3	-71.7	174.7	0	0	0	111.9	L675 N676 I682 E683 L706 R715 L756	L675-L679 HydrophobicContact CD1-CD1 3.82Å; L675-L679 HydrophobicContact CD1-CG 4.04Å; L675-L679 HydrophobicContact CD2-CD1 4.45Å; L675-L679 HydrophobicContact CG-CD1 3.84Å; L675-L679 HydrophobicContact CG-CG 4.38Å; L675-L679 WeakPolarHBondContact O-CB 3.48Å; L675-L679 WeakPolarHBondContact O-CG 3.25Å; L675-L679 PolarHBondContact O-N 2.96Å; N676-L679 PolarHBondContact O-N 3.27Å; L679-I682 HydrophobicContact CD2-CD1 4.36Å; L679-I682 PolarHBondContact O-N 2.98Å; L679-E683 WeakPolarHBondContact O-CB 3.39Å; L679-E683 PolarHBondContact O-N 3.4Å; L679-L706 HydrophobicContact CD2-CD2 4.18Å; L679-R715 HydrophobicContact CD2-CG 4.44Å; L679-L756 HydrophobicContact CD2-CD1 4.34Å
680	E	96.6	Very high	89.7	Confident	130 Å²	130	63.9 Å²	63.9	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-67.6	-40	171.5	-175.6	170.7	-158.6	0	0	112.4	N676 I678 I682 E683 N684	N676-E680 WeakPolarHBondContact O-CB 3.19Å; N676-E680 PolarHBondContact O-N 2.92Å; I678-E680 VanDerWaalsContact C-N 3.28Å; I678-E680 PolarHBondContact O-N 2.87Å; E680-I682 VanDerWaalsContact C-N 3.35Å; E680-E683 WeakPolarHBondContact O-CB 3.48Å; E680-E683 PolarHBondContact O-N 3.37Å; E680-N684 PolarHBondContact O-N 2.84Å; E680-N684 PolarHBondContact O-ND2 3.35Å
681	K	96.6	Very high	87.9	Confident	98 Å²	98	57.9 Å²	57.9	43%	0.426	30%	0.298	S	S	.	.	H	α-helix	trans	-63.5	-39.6	172.1	-68.9	170.3	-170.6	171.9	0	112.1	E677 I678 N684 Y685 F752	E677-K681 WeakPolarHBondContact O-CG 3.4Å; E677-K681 PolarHBondContact O-N 3.08Å; E677-K681 VanDerWaalsContact O-N 3.16Å; E677-K681 WeakPolarHBondContact OE1-CE 3.23Å; E677-K681 IonicContact OE1-NZ 3.21Å; E677-K681 PolarHBondContact OE1-NZ 2.61Å; I678-K681 WeakPolarHBondContact O-CB 3.49Å; I678-K681 PolarHBondContact O-N 3.38Å; I678-K681 VanDerWaalsContact O-N 3.17Å; K681-N684 PolarHBondContact O-N 3.24Å; K681-Y685 WeakPolarHBondContact O-CB 3.5Å; K681-Y685 PolarHBondContact O-N 2.92Å; K681-F752 HydrophobicContact CB-CE1 3.84Å; K681-F752 HydrophobicContact CB-CZ 4.25Å
682	I	94.3	Very high	85.9	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-41.8	174.3	-73.9	167.3	0	0	0	111.3	I678 L679 E680 Y685 F686 L706 W713 F752 L756	I678-I682 HydrophobicContact CG2-CD1 3.86Å; I678-I682 HydrophobicContact CG2-CG1 4.44Å; I678-I682 WeakPolarHBondContact O-CG1 3.48Å; I678-I682 PolarHBondContact O-N 2.81Å; L679-I682 HydrophobicContact CD2-CD1 4.36Å; L679-I682 PolarHBondContact O-N 2.98Å; E680-I682 VanDerWaalsContact C-N 3.35Å; I682-Y685 WeakPolarHBondContact O-CB 3.41Å; I682-Y685 PolarHBondContact O-N 3.37Å; I682-F686 HydrophobicContact CG2-CD2 3.57Å; I682-F686 HydrophobicContact CG2-CE2 3.49Å; I682-F686 VanDerWaalsContact CG2-CE2 3.49Å; I682-F686 WeakPolarHBondContact O-CD2 3.2Å; I682-F686 PolarHBondContact O-N 3.09Å; I682-L706 HydrophobicContact CD1-CD1 4.38Å; I682-L706 HydrophobicContact CG2-CD1 3.83Å; I682-W713 HydrophobicContact CG2-CB 4.47Å; I682-W713 HydrophobicContact CG2-CG 4.41Å; I682-F752 HydrophobicContact CD1-CB 3.92Å; I682-F752 HydrophobicContact CD1-CD2 4.2Å; I682-F752 HydrophobicContact CD1-CG 4.08Å; I682-F752 HydrophobicContact CG1-CB 4.02Å; I682-F752 HydrophobicContact CG1-CD1 4.22Å; I682-F752 HydrophobicContact CG1-CD2 3.39Å; I682-F752 HydrophobicContact CG1-CE2 3.83Å; I682-F752 HydrophobicContact CG1-CG 3.61Å; I682-F752 HydrophobicContact CG1-CZ 4.4Å; I682-L756 HydrophobicContact CD1-CD1 3.42Å; I682-L756 VanDerWaalsContact CD1-CD1 3.42Å
683	E	91.6	Very high	84.4	Confident	30 Å²	30	66.4 Å²	66.4	14%	0.14	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-50.8	174.5	-171.8	69.7	-119	0	0	110.4	L679 E680 Y685 F686 H687 R708 W713	L679-E683 WeakPolarHBondContact O-CB 3.39Å; L679-E683 PolarHBondContact O-N 3.4Å; E680-E683 WeakPolarHBondContact O-CB 3.48Å; E680-E683 PolarHBondContact O-N 3.37Å; E683-Y685 PolarHBondContact O-N 2.72Å; E683-F686 PolarHBondContact O-N 3.29Å; E683-H687 PolarHBondContact O-N 3.06Å; E683-H687 VanDerWaalsContact O-N 3.09Å; E683-H687 PolarHBondContact O-ND1 2.84Å; E683-H687 IonicContact OE1-CE1 3.77Å; E683-H687 PolarHBondContact OE1-CE1 2.82Å; E683-H687 VanDerWaalsContact OE1-CE1 3.25Å; E683-H687 IonicContact OE1-ND1 2.63Å; E683-R708 IonicContact OE1-CZ 3.89Å; E683-R708 IonicContact OE1-NH1 3.32Å; E683-R708 PolarHBondContact OE1-NH1 3.14Å; E683-R708 IonicContact OE1-NH2 3.9Å; E683-R708 PolarHBondContact OE1-NH2 2.73Å; E683-R708 IonicContact OE2-CZ 2.76Å; E683-R708 IonicContact OE2-NH1 3.2Å; E683-R708 PolarHBondContact OE2-NH1 3.05Å; E683-R708 IonicContact OE2-NH2 2.7Å; E683-W713 VanDerWaalsContact OE2-CD1 3.26Å; E683-W713 PolarHBondContact OE2-N 3.46Å
684	N	91.1	Very high	83.3	Confident	95 Å²	95	64.5 Å²	64.5	51%	0.508	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-39.1	177.3	-69.1	-26	0	0	0	112.7	E680 K681 H687 T688	E680-N684 PolarHBondContact O-N 2.84Å; E680-N684 PolarHBondContact O-ND2 3.35Å; K681-N684 PolarHBondContact O-N 3.24Å; N684-H687 WeakPolarHBondContact O-CB 3.34Å; N684-H687 PolarHBondContact O-N 2.93Å; N684-T688 PolarHBondContact O-N 3.33Å
685	Y	86.7	Confident	82.3	Confident	57 Å²	57	65.2 Å²	65.2	22%	0.224	33%	0.331	C	S	.	.	H	α-helix	trans	-57.6	-50.9	174.1	-179.2	-101	0	0	0	111.2	K681 I682 E683 H687 T688 Q689 F694 P749 F752	K681-Y685 WeakPolarHBondContact O-CB 3.5Å; K681-Y685 PolarHBondContact O-N 2.92Å; I682-Y685 WeakPolarHBondContact O-CB 3.41Å; I682-Y685 PolarHBondContact O-N 3.37Å; E683-Y685 PolarHBondContact O-N 2.72Å; Y685-H687 VanDerWaalsContact C-N 3.26Å; Y685-H687 PolarHBondContact O-N 2.81Å; Y685-T688 PolarHBondContact O-N 2.86Å; Y685-T688 PolarHBondContact O-OG1 2.86Å; Y685-Q689 HydrophobicContact CD1-CG 4.22Å; Y685-Q689 HydrophobicContact CD2-CG 4.13Å; Y685-Q689 HydrophobicContact CE1-CB 4.39Å; Y685-Q689 HydrophobicContact CE1-CG 3.96Å; Y685-Q689 HydrophobicContact CE2-CG 3.86Å; Y685-Q689 HydrophobicContact CG-CG 4.31Å; Y685-Q689 WeakPolarHBondContact O-CG 3.41Å; Y685-Q689 PolarHBondContact O-N 3.32Å; Y685-Q689 VanDerWaalsContact O-N 3.15Å; Y685-F694 HydrophobicContact CE1-CE1 4.12Å; Y685-F694 HydrophobicContact CE1-CE2 4.13Å; Y685-F694 AromaticContact CE1-CZ 3.65Å; Y685-F694 HydrophobicContact CE1-CZ 3.65Å; Y685-F694 AromaticContact CZ-CZ 3.97Å; Y685-F694 WeakPolarHBondContact OH-CZ 3.3Å; Y685-P749 HydrophobicContact CD1-CB 4.2Å; Y685-P749 HydrophobicContact CD1-CG 3.88Å; Y685-P749 HydrophobicContact CE1-CB 3.67Å; Y685-P749 HydrophobicContact CE1-CG 3.72Å; Y685-F752 HydrophobicContact CD1-CE2 4.11Å; Y685-F752 HydrophobicContact CD2-CE2 4.14Å; Y685-F752 HydrophobicContact CD2-CZ 4.44Å; Y685-F752 AromaticContact CG-CE2 3.78Å; Y685-F752 HydrophobicContact CG-CE2 3.78Å; Y685-F752 HydrophobicContact CG-CZ 4.31Å
686	F	83.1	Confident	81.5	Confident	11 Å²	11	65.5 Å²	65.5	5%	0.048	33%	0.333	C	S	.	.	H	α-helix	trans	-69.9	-14.4	178.8	-73	-43.5	0	0	0	114.8	I682 E683 T688 T691 F694 L706 W713 R746 P749	I682-F686 HydrophobicContact CG2-CD2 3.57Å; I682-F686 HydrophobicContact CG2-CE2 3.49Å; I682-F686 VanDerWaalsContact CG2-CE2 3.49Å; I682-F686 WeakPolarHBondContact O-CD2 3.2Å; I682-F686 PolarHBondContact O-N 3.09Å; E683-F686 PolarHBondContact O-N 3.29Å; F686-T688 VanDerWaalsContact C-N 3.32Å; F686-T691 HydrophobicContact CB-CG2 3.81Å; F686-T691 HydrophobicContact CD1-CG2 3.84Å; F686-T691 HydrophobicContact CG-CG2 4.05Å; F686-F694 HydrophobicContact CD1-CD2 4.41Å; F686-F694 HydrophobicContact CE1-CB 4.02Å; F686-F694 HydrophobicContact CE1-CD1 4.22Å; F686-F694 AromaticContact CE1-CD2 3.7Å; F686-F694 HydrophobicContact CE1-CD2 3.7Å; F686-F694 HydrophobicContact CE1-CE2 4.25Å; F686-F694 AromaticContact CE1-CG 3.7Å; F686-F694 HydrophobicContact CE1-CG 3.7Å; F686-F694 HydrophobicContact CZ-CB 4.31Å; F686-F694 HydrophobicContact CZ-CG 4.29Å; F686-L706 HydrophobicContact CE2-CD1 3.85Å; F686-L706 HydrophobicContact CZ-CD1 4.31Å; F686-W713 AromaticContact CD2-CD1 3.82Å; F686-W713 HydrophobicContact CD2-CD2 4.18Å; F686-W713 AromaticContact CD2-CE2 3.59Å; F686-W713 HydrophobicContact CD2-CG 4.3Å; F686-W713 HydrophobicContact CD2-CZ2 4.05Å; F686-W713 AromaticContact CD2-NE1 3.32Å; F686-W713 VanDerWaalsContact CD2-NE1 3.32Å; F686-W713 HydrophobicContact CE2-CD2 4.31Å; F686-W713 HydrophobicContact CE2-CZ2 4.39Å; F686-R746 HydrophobicContact CZ-CB 4.21Å; F686-P749 HydrophobicContact CE1-CG 3.83Å; F686-P749 HydrophobicContact CE2-CG 4.28Å; F686-P749 HydrophobicContact CZ-CG 3.55Å
687	H	79	Confident	80.5	Confident	131 Å²	131	65.2 Å²	65.2	61%	0.606	34%	0.338	S	S	*	.	H	α-helix	trans	-73.5	-23.6	166.1	-78.9	86	0	0	0	113.1	E683 N684 Y685	E683-H687 PolarHBondContact O-N 3.06Å; E683-H687 VanDerWaalsContact O-N 3.09Å; E683-H687 PolarHBondContact O-ND1 2.84Å; E683-H687 IonicContact OE1-CE1 3.77Å; E683-H687 PolarHBondContact OE1-CE1 2.82Å; E683-H687 VanDerWaalsContact OE1-CE1 3.25Å; E683-H687 IonicContact OE1-ND1 2.63Å; N684-H687 WeakPolarHBondContact O-CB 3.34Å; N684-H687 PolarHBondContact O-N 2.93Å; Y685-H687 VanDerWaalsContact C-N 3.26Å; Y685-H687 PolarHBondContact O-N 2.81Å
688	T	69.4	Low	79.5	Confident	100 Å²	100	65.6 Å²	65.6	61%	0.613	34%	0.335	S	S	*	.	H	α-helix	trans	-103.9	-7	-177.6	62.1	0	0	0	0	114.3	N684 Y685 F686	N684-T688 PolarHBondContact O-N 3.33Å; Y685-T688 PolarHBondContact O-N 2.86Å; Y685-T688 PolarHBondContact O-OG1 2.86Å; F686-T688 VanDerWaalsContact C-N 3.32Å
689	Q	61.5	Low	78.8	Confident	83 Å²	83	66.7 Å²	66.7	39%	0.388	34%	0.343	S	S	.	.	S	Bend	trans	-124.3	155.4	-172.1	-63.1	-62.8	-16.4	0	0	112.4	Y685 T691	Y685-Q689 HydrophobicContact CD1-CG 4.22Å; Y685-Q689 HydrophobicContact CD2-CG 4.13Å; Y685-Q689 HydrophobicContact CE1-CB 4.39Å; Y685-Q689 HydrophobicContact CE1-CG 3.96Å; Y685-Q689 HydrophobicContact CE2-CG 3.86Å; Y685-Q689 HydrophobicContact CG-CG 4.31Å; Y685-Q689 WeakPolarHBondContact O-CG 3.41Å; Y685-Q689 PolarHBondContact O-N 3.32Å; Y685-Q689 VanDerWaalsContact O-N 3.15Å; Q689-T691 PolarHBondContact O-N 2.71Å
690	V	60.3	Low	78.3	Confident	75 Å²	75	66.3 Å²	66.3	46%	0.455	34%	0.34	S	S	.	.			trans	-76.1	96.2	176.3	178.4	0	0	0	0	109.2	S692 E693	V690-S692 VanDerWaalsContact CG1-OG 3.25Å; V690-S692 WeakPolarHBondContact CG1-OG 3.33Å; V690-S692 PolarHBondContact O-N 3.15Å; V690-E693 HydrophobicContact CB-CG 4.41Å; V690-E693 HydrophobicContact CG1-CG 4.4Å; V690-E693 PolarHBondContact O-N 3.16Å; V690-E693 VanDerWaalsContact O-N 3.11Å
691	T	60.1	Low	77.9	Confident	43 Å²	43	61.4 Å²	61.4	26%	0.264	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-59.7	-18.4	-172.9	73.4	0	0	0	0	114.7	F686 Q689 E693 F694 R746	F686-T691 HydrophobicContact CB-CG2 3.81Å; F686-T691 HydrophobicContact CD1-CG2 3.84Å; F686-T691 HydrophobicContact CG-CG2 4.05Å; Q689-T691 PolarHBondContact O-N 2.71Å; T691-E693 VanDerWaalsContact C-N 3.27Å; T691-E693 PolarHBondContact O-N 3.43Å; T691-F694 PolarHBondContact O-N 3.28Å; T691-R746 WeakPolarHBondContact O-CD 3.5Å; T691-R746 PolarHBondContact O-NE 2.76Å
692	S	53.2	Low	77.6	Confident	67 Å²	67	57.4 Å²	57.4	47%	0.469	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-69.9	-20.2	178	49.9	0	0	0	0	114	V690 F694 L695	V690-S692 VanDerWaalsContact CG1-OG 3.25Å; V690-S692 WeakPolarHBondContact CG1-OG 3.33Å; V690-S692 PolarHBondContact O-N 3.15Å; S692-F694 PolarHBondContact O-N 3.48Å; S692-L695 WeakPolarHBondContact O-CD1 3.4Å; S692-L695 VanDerWaalsContact O-CG 3.3Å; S692-L695 WeakPolarHBondContact O-CG 3.48Å; S692-L695 PolarHBondContact O-N 3.47Å
693	E	64.6	Low	77.6	Confident	140 Å²	140	58.7 Å²	58.7	65%	0.654	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-65.6	-23.4	172.3	-65.5	175.5	-169	0	0	112.1	V690 T691	V690-E693 HydrophobicContact CB-CG 4.41Å; V690-E693 HydrophobicContact CG1-CG 4.4Å; V690-E693 PolarHBondContact O-N 3.16Å; V690-E693 VanDerWaalsContact O-N 3.11Å; T691-E693 VanDerWaalsContact C-N 3.27Å; T691-E693 PolarHBondContact O-N 3.43Å
694	F	75.2	Confident	77.7	Confident	23 Å²	23	58.8 Å²	58.8	10%	0.101	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-97.3	18.2	-179.7	-58.4	-92.4	0	0	0	112.2	Y685 F686 T691 S692 R746 E747 P749	Y685-F694 HydrophobicContact CE1-CE1 4.12Å; Y685-F694 HydrophobicContact CE1-CE2 4.13Å; Y685-F694 AromaticContact CE1-CZ 3.65Å; Y685-F694 HydrophobicContact CE1-CZ 3.65Å; Y685-F694 AromaticContact CZ-CZ 3.97Å; Y685-F694 WeakPolarHBondContact OH-CZ 3.3Å; F686-F694 HydrophobicContact CD1-CD2 4.41Å; F686-F694 HydrophobicContact CE1-CB 4.02Å; F686-F694 HydrophobicContact CE1-CD1 4.22Å; F686-F694 AromaticContact CE1-CD2 3.7Å; F686-F694 HydrophobicContact CE1-CD2 3.7Å; F686-F694 HydrophobicContact CE1-CE2 4.25Å; F686-F694 AromaticContact CE1-CG 3.7Å; F686-F694 HydrophobicContact CE1-CG 3.7Å; F686-F694 HydrophobicContact CZ-CB 4.31Å; F686-F694 HydrophobicContact CZ-CG 4.29Å; T691-F694 PolarHBondContact O-N 3.28Å; S692-F694 PolarHBondContact O-N 3.48Å; F694-R746 HydrophobicContact CB-CB 4.36Å; F694-R746 CarbonylContact O-C 3.57Å; F694-R746 WeakPolarHBondContact O-CA 3.4Å; F694-R746 VanDerWaalsContact O-CD 3.25Å; F694-R746 WeakPolarHBondContact O-CD 3.3Å; F694-E747 PolarHBondContact O-N 2.96Å; F694-P749 HydrophobicContact CD1-CB 4.12Å; F694-P749 HydrophobicContact CD1-CG 4.01Å; F694-P749 HydrophobicContact CE1-CB 3.7Å; F694-P749 HydrophobicContact CE1-CG 3.99Å; F694-P749 HydrophobicContact CZ-CB 4.5Å
695	L	76.8	Confident	77.9	Confident	69 Å²	69	54.3 Å²	54.3	36%	0.361	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-62	139.7	174.9	-78.6	166	0	0	0	111.2	S692 S697 F743	S692-L695 WeakPolarHBondContact O-CD1 3.4Å; S692-L695 VanDerWaalsContact O-CG 3.3Å; S692-L695 WeakPolarHBondContact O-CG 3.48Å; S692-L695 PolarHBondContact O-N 3.47Å; L695-S697 PolarHBondContact O-N 3.05Å; L695-F743 HydrophobicContact CD2-CB 4.17Å
696	V	81.1	Confident	78.4	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.055	28%	0.278	C	S	.	.			trans	-66.3	107.4	173.8	170.8	0	0	0	0	109.1	P699 K703 C705 V742 L745 E747	V696-P699 HydrophobicContact CG1-CB 4.01Å; V696-K703 HydrophobicContact CG1-CD 4.28Å; V696-C705 HydrophobicContact CG2-CB 3.97Å; V696-V742 HydrophobicContact CB-CG2 4.35Å; V696-V742 HydrophobicContact CG1-CG2 4.34Å; V696-L745 HydrophobicContact CB-CB 4.16Å; V696-L745 HydrophobicContact CG2-CB 3.63Å; V696-E747 HydrophobicContact CG2-CG 4.27Å
697	S	74.7	Confident	79	Confident	83 Å²	83	51.2 Å²	51.2	58%	0.58	28%	0.277	S	S	*	.	S	Bend	trans	-86	-29.9	-175.4	59.7	0	0	0	0	113.6	L695	L695-S697 PolarHBondContact O-N 3.05Å
698	R	78.2	Confident	79.4	Confident	109 Å²	109	50.1 Å²	50.1	41%	0.411	27%	0.268	S	S	.	.	S	Bend	trans	-134.9	86.8	-179.8	-63.1	178.9	-165.6	71.7	-11.8	108.7	E606 K703	E606-R698 IonicContact OE2-CZ 2.68Å; E606-R698 IonicContact OE2-NE 3.1Å; E606-R698 PolarHBondContact OE2-NE 3.15Å; E606-R698 IonicContact OE2-NH2 3.67Å; E606-R698 PolarHBondContact OE2-NH2 3.39Å; R698-K703 VanDerWaalsContact O-CD 3.27Å; R698-K703 WeakPolarHBondContact O-CD 3.31Å; R698-K703 WeakPolarHBondContact O-CE 3.45Å
699	P	83.7	Confident	80.4	Confident	29 Å²	29	48.1 Å²	48.1	19%	0.188	25%	0.249	C	C	.	.			trans	-71.4	144	172.3	31.7	-34.2	0	0	0	109.9	V696 I718 L721 L727 V742	V696-P699 HydrophobicContact CG1-CB 4.01Å; P699-I718 HydrophobicContact CB-CD1 3.73Å; P699-L721 HydrophobicContact CB-CD2 3.84Å; P699-L721 HydrophobicContact CG-CD2 3.92Å; P699-L727 HydrophobicContact CB-CD1 3.94Å; P699-L727 HydrophobicContact CB-CD2 4.03Å; P699-L727 HydrophobicContact CG-CD2 4.36Å; P699-V742 HydrophobicContact CG-CG2 4.21Å
700	F	86.3	Confident	81.7	Confident	10 Å²	10	52.7 Å²	52.7	4%	0.044	27%	0.268	C	S	.	.			trans	-155.4	158.7	172.2	64.2	-91.3	0	0	0	109.2	A576 L605 V614 K703	A576-F700 HydrophobicContact CB-CD1 4.19Å; A576-F700 HydrophobicContact CB-CE1 3.7Å; A576-F700 HydrophobicContact CB-CE2 4.31Å; A576-F700 HydrophobicContact CB-CZ 3.78Å; L605-F700 HydrophobicContact CD1-CB 3.88Å; L605-F700 HydrophobicContact CD1-CD1 3.56Å; L605-F700 HydrophobicContact CD1-CE1 4.28Å; L605-F700 HydrophobicContact CD1-CG 3.84Å; L605-F700 HydrophobicContact CD2-CB 4.02Å; V614-F700 HydrophobicContact CG1-CD2 4.39Å; V614-F700 HydrophobicContact CG2-CB 4.04Å; V614-F700 HydrophobicContact CG2-CD2 3.5Å; V614-F700 HydrophobicContact CG2-CE2 4.09Å; V614-F700 HydrophobicContact CG2-CG 3.82Å; F700-K703 HydrophobicContact CD1-CB 3.9Å; F700-K703 HydrophobicContact CD1-CD 3.78Å; F700-K703 HydrophobicContact CD1-CG 4.17Å; F700-K703 HydrophobicContact CD2-CB 4.08Å; F700-K703 HydrophobicContact CE1-CB 3.75Å; F700-K703 HydrophobicContact CE1-CD 3.66Å; F700-K703 HydrophobicContact CE1-CG 3.75Å; F700-K703 HydrophobicContact CE2-CB 3.93Å; F700-K703 HydrophobicContact CG-CB 4.06Å; F700-K703 HydrophobicContact CZ-CB 3.76Å; F700-K703 HydrophobicContact CZ-CD 4.42Å; F700-K703 HydrophobicContact CZ-CG 4.01Å; F700-K703 WeakPolarHBondContact O-CB 3.49Å; F700-K703 PolarHBondContact O-N 2.8Å; F700-K703 VanDerWaalsContact O-N 3.15Å
701	C	88.1	Confident	82.8	Confident	28 Å²	28	51.8 Å²	51.8	19%	0.189	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	137.7	-179.5	-77.2	0	0	0	0	111.5	N625 K703 L721	N625-C701 PolarHBondContact ND2-O 2.81Å; C701-K703 VanDerWaalsContact C-N 3.27Å; C701-K703 PolarHBondContact O-N 3.29Å; C701-L721 VanDerWaalsContact SG-CD1 3.5Å
702	G	91	Very high	84.2	Confident	14 Å²	14	57 Å²	57	14%	0.144	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-2.5	-174.5	0	0	0	0	0	115.1	Q704 I718	G702-Q704 PolarHBondContact O-N 2.96Å; G702-I718 PolarHBondContact N-O 2.7Å
703	K	93.2	Very high	86.2	Confident	26 Å²	26	54.7 Å²	54.7	11%	0.113	27%	0.274	C	S	.	.			trans	-67.4	126.7	175.9	-175.5	178.9	169.8	70	0	110.9	V696 R698 F700 C701 I718 E747	V696-K703 HydrophobicContact CG1-CD 4.28Å; R698-K703 VanDerWaalsContact O-CD 3.27Å; R698-K703 WeakPolarHBondContact O-CD 3.31Å; R698-K703 WeakPolarHBondContact O-CE 3.45Å; F700-K703 HydrophobicContact CD1-CB 3.9Å; F700-K703 HydrophobicContact CD1-CD 3.78Å; F700-K703 HydrophobicContact CD1-CG 4.17Å; F700-K703 HydrophobicContact CD2-CB 4.08Å; F700-K703 HydrophobicContact CE1-CB 3.75Å; F700-K703 HydrophobicContact CE1-CD 3.66Å; F700-K703 HydrophobicContact CE1-CG 3.75Å; F700-K703 HydrophobicContact CE2-CB 3.93Å; F700-K703 HydrophobicContact CG-CB 4.06Å; F700-K703 HydrophobicContact CZ-CB 3.76Å; F700-K703 HydrophobicContact CZ-CD 4.42Å; F700-K703 HydrophobicContact CZ-CG 4.01Å; F700-K703 WeakPolarHBondContact O-CB 3.49Å; F700-K703 PolarHBondContact O-N 2.8Å; F700-K703 VanDerWaalsContact O-N 3.15Å; C701-K703 VanDerWaalsContact C-N 3.27Å; C701-K703 PolarHBondContact O-N 3.29Å; K703-I718 HydrophobicContact CB-CD1 4.21Å; K703-I718 HydrophobicContact CD-CD1 4.4Å; K703-I718 PolarHBondContact O-N 2.84Å; K703-E747 WeakPolarHBondContact CE-OE1 3.47Å; K703-E747 VanDerWaalsContact CE-OE2 3.24Å; K703-E747 WeakPolarHBondContact CE-OE2 3.48Å; K703-E747 IonicContact NZ-OE1 2.71Å; K703-E747 PolarHBondContact NZ-OE1 3.13Å; K703-E747 IonicContact NZ-OE2 3.4Å; K703-E747 PolarHBondContact NZ-OE2 2.8Å
704	Q	95.1	Very high	87.8	Confident	33 Å²	33	48.5 Å²	48.5	15%	0.154	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.7	175.2	-65.3	-178.3	-15.2	0	0	110.8	G702 V716 I748	G702-Q704 PolarHBondContact O-N 2.96Å; Q704-V716 WeakPolarHBondContact CA-O 3.45Å; Q704-I748 HydrophobicContact CB-CD1 4.24Å
705	C	95.3	Very high	88.8	Confident	1 Å²	1	48 Å²	48	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	-171.3	-179.6	50	0	0	0	0	110.7	V696 V716 R746	V696-C705 HydrophobicContact CG2-CB 3.97Å; C705-V716 HydrophobicContact CB-CG2 4.45Å; C705-V716 PolarHBondContact N-O 3.34Å; C705-V716 WeakPolarHBondContact O-CG2 3.45Å; C705-V716 PolarHBondContact O-N 2.81Å; C705-V716 VanDerWaalsContact SG-CG2 3.57Å; C705-R746 VanDerWaalsContact CB-O 3.27Å; C705-R746 WeakPolarHBondContact CB-O 3.31Å
706	L	96.9	Very high	89.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.6	-177.9	-60.3	171.8	0	0	0	110.6	L679 I682 F686 W713 S714 R715 L745 R746 I748 L756	L679-L706 HydrophobicContact CD2-CD2 4.18Å; I682-L706 HydrophobicContact CD1-CD1 4.38Å; I682-L706 HydrophobicContact CG2-CD1 3.83Å; F686-L706 HydrophobicContact CE2-CD1 3.85Å; F686-L706 HydrophobicContact CZ-CD1 4.31Å; L706-W713 HydrophobicContact CB-CE3 4Å; L706-S714 WeakPolarHBondContact CA-O 3.42Å; L706-R715 HydrophobicContact CD2-CG 4.41Å; L706-L745 CarbonylContact O-C 3.56Å; L706-L745 WeakPolarHBondContact O-CA 3.31Å; L706-R746 HydrophobicContact CB-CB 4.32Å; L706-R746 PolarHBondContact N-O 2.68Å; L706-R746 PolarHBondContact O-N 3.36Å; L706-I748 HydrophobicContact CD1-CG1 4.29Å; L706-I748 HydrophobicContact CD2-CG1 4.21Å; L706-I748 HydrophobicContact CG-CG1 3.86Å; L706-L756 HydrophobicContact CD2-CD1 4.22Å
707	A	95.1	Very high	90.5	Very high	3 Å²	3	45.8 Å²	45.8	3%	0.025	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	163.4	171.4	0	0	0	0	0	110.7	S714 V716 I729 F731 L745	A707-S714 PolarHBondContact N-O 2.71Å; A707-S714 PolarHBondContact O-N 3.33Å; A707-V716 HydrophobicContact CB-CG1 3.82Å; A707-V716 HydrophobicContact CB-CG2 4.02Å; A707-I729 HydrophobicContact CB-CD1 4.21Å; A707-F731 HydrophobicContact CB-CE1 3.81Å; A707-F731 HydrophobicContact CB-CZ 4.03Å; A707-L745 HydrophobicContact CB-CD2 3.81Å
708	R	88.8	Confident	91.4	Very high	107 Å²	107	41.8 Å²	41.8	40%	0.404	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.3	175.2	-75	-70.9	-170.5	175	-8.8	110.6	E683 G711 K712 W713	E683-R708 IonicContact OE1-CZ 3.89Å; E683-R708 IonicContact OE1-NH1 3.32Å; E683-R708 PolarHBondContact OE1-NH1 3.14Å; E683-R708 IonicContact OE1-NH2 3.9Å; E683-R708 PolarHBondContact OE1-NH2 2.73Å; E683-R708 IonicContact OE2-CZ 2.76Å; E683-R708 IonicContact OE2-NH1 3.2Å; E683-R708 PolarHBondContact OE2-NH1 3.05Å; E683-R708 IonicContact OE2-NH2 2.7Å; R708-G711 PolarHBondContact NH1-O 3.17Å; R708-K712 CarbonylContact C-O 3.54Å; R708-K712 WeakPolarHBondContact CA-O 3.29Å; R708-W713 HydrophobicContact CG-CD2 4.46Å; R708-W713 HydrophobicContact CG-CE3 4.16Å; R708-W713 HydrophobicContact CG-CH2 4.13Å; R708-W713 HydrophobicContact CG-CZ2 4.43Å; R708-W713 HydrophobicContact CG-CZ3 3.99Å; R708-W713 VanDerWaalsContact CZ-NE1 3.31Å
709	Y	90.2	Very high	91.7	Very high	58 Å²	58	39.6 Å²	39.6	23%	0.227	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.3	169.5	-178.6	-117.2	0	0	0	110.1	G711 K712 F731 V734 V736	Y709-G711 PolarHBondContact O-N 2.95Å; Y709-K712 PolarHBondContact N-O 2.81Å; Y709-K712 PolarHBondContact O-N 2.8Å; Y709-F731 HydrophobicContact CD2-CE2 4.41Å; Y709-F731 HydrophobicContact CD2-CZ 4.42Å; Y709-F731 HydrophobicContact CG-CD1 4.45Å; Y709-F731 HydrophobicContact CG-CE1 4.4Å; Y709-V734 HydrophobicContact CD1-CG2 4.29Å; Y709-V734 HydrophobicContact CE1-CB 4.46Å; Y709-V734 HydrophobicContact CE1-CG1 4.2Å; Y709-V734 HydrophobicContact CE1-CG2 4Å; Y709-V736 HydrophobicContact CE2-CG1 4.48Å; Y709-V736 HydrophobicContact CE2-CG2 4.44Å
710	K	87.6	Confident	91.4	Very high	180 Å²	180	40.1 Å²	40.1	78%	0.783	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.3	37.4	-178.1	-64.4	-179.5	176.5	174.6	0	113.4
711	G	83.8	Confident	90.6	Very high	56 Å²	56	42 Å²	42	58%	0.577	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	-2.9	179	0	0	0	0	0	116.5	R708 Y709	R708-G711 PolarHBondContact NH1-O 3.17Å; Y709-G711 PolarHBondContact O-N 2.95Å
712	K	90.1	Very high	89.4	Confident	153 Å²	153	41.3 Å²	41.3	67%	0.665	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	155.6	177.1	-64.4	-170.7	176.4	-169.2	0	111.7	R708 Y709	R708-K712 CarbonylContact C-O 3.54Å; R708-K712 WeakPolarHBondContact CA-O 3.29Å; Y709-K712 PolarHBondContact N-O 2.81Å; Y709-K712 PolarHBondContact O-N 2.8Å
713	W	94.6	Very high	87.6	Confident	17 Å²	17	42.3 Å²	42.3	6%	0.064	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	140.3	167.7	-66.5	108.9	0	0	0	111.7	I682 E683 F686 L706 R708 R746	I682-W713 HydrophobicContact CG2-CB 4.47Å; I682-W713 HydrophobicContact CG2-CG 4.41Å; E683-W713 VanDerWaalsContact OE2-CD1 3.26Å; E683-W713 PolarHBondContact OE2-N 3.46Å; F686-W713 AromaticContact CD2-CD1 3.82Å; F686-W713 HydrophobicContact CD2-CD2 4.18Å; F686-W713 AromaticContact CD2-CE2 3.59Å; F686-W713 HydrophobicContact CD2-CG 4.3Å; F686-W713 HydrophobicContact CD2-CZ2 4.05Å; F686-W713 AromaticContact CD2-NE1 3.32Å; F686-W713 VanDerWaalsContact CD2-NE1 3.32Å; F686-W713 HydrophobicContact CE2-CD2 4.31Å; F686-W713 HydrophobicContact CE2-CZ2 4.39Å; L706-W713 HydrophobicContact CB-CE3 4Å; R708-W713 HydrophobicContact CG-CD2 4.46Å; R708-W713 HydrophobicContact CG-CE3 4.16Å; R708-W713 HydrophobicContact CG-CH2 4.13Å; R708-W713 HydrophobicContact CG-CZ2 4.43Å; R708-W713 HydrophobicContact CG-CZ3 3.99Å; R708-W713 VanDerWaalsContact CZ-NE1 3.31Å; W713-R746 HydrophobicContact CH2-CB 4.45Å; W713-R746 HydrophobicContact CH2-CG 3.54Å; W713-R746 HydrophobicContact CZ2-CG 4.36Å; W713-R746 HydrophobicContact CZ3-CB 4.32Å; W713-R746 HydrophobicContact CZ3-CG 3.82Å
714	S	97.3	Very high	85.4	Confident	11 Å²	11	44.6 Å²	44.6	8%	0.077	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	153.6	177.3	-170.6	0	0	0	0	109.9	L706 A707	L706-S714 WeakPolarHBondContact CA-O 3.42Å; A707-S714 PolarHBondContact N-O 2.71Å; A707-S714 PolarHBondContact O-N 3.33Å
715	R	98	Very high	83.4	Confident	11 Å²	11	48.7 Å²	48.7	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	137.6	179	-52.4	-169.3	-63.1	169.6	-1.3	110.4	L675 L679 L706 F731 V732 D733 L756 I759 P760	L675-R715 HydrophobicContact CD1-CG 4.08Å; L679-R715 HydrophobicContact CD2-CG 4.44Å; L706-R715 HydrophobicContact CD2-CG 4.41Å; R715-F731 WeakPolarHBondContact O-CA 3.48Å; R715-V732 HydrophobicContact CB-CG2 3.81Å; R715-V732 PolarHBondContact O-N 3.42Å; R715-D733 WeakPolarHBondContact CB-OD2 3.39Å; R715-D733 WeakPolarHBondContact CG-OD2 3.46Å; R715-D733 IonicContact CZ-OD1 3.65Å; R715-D733 IonicContact CZ-OD2 3.3Å; R715-D733 IonicContact NE-OD1 2.72Å; R715-D733 PolarHBondContact NE-OD1 3.06Å; R715-D733 IonicContact NE-OD2 2.77Å; R715-D733 PolarHBondContact NE-OD2 2.78Å; R715-D733 IonicContact NH2-OD1 3.88Å; R715-D733 PolarHBondContact NH2-OD1 3.03Å; R715-D733 IonicContact NH2-OD2 3.2Å; R715-L756 HydrophobicContact CG-CD1 4.26Å; R715-L756 HydrophobicContact CG-CD2 3.92Å; R715-L756 HydrophobicContact CG-CG 4.24Å; R715-L756 PolarHBondContact NH1-O 3.21Å; R715-I759 PolarHBondContact NH1-O 2.82Å; R715-I759 PolarHBondContact NH2-O 2.74Å; R715-P760 PolarHBondContact NH2-O 2.73Å
716	V	97.6	Very high	82.2	Confident	2 Å²	2	50 Å²	50	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.3	176.2	-66.3	0	0	0	0	110.9	Q704 C705 A707 I729 L730 F731 L745	Q704-V716 WeakPolarHBondContact CA-O 3.45Å; C705-V716 HydrophobicContact CB-CG2 4.45Å; C705-V716 PolarHBondContact N-O 3.34Å; C705-V716 WeakPolarHBondContact O-CG2 3.45Å; C705-V716 PolarHBondContact O-N 2.81Å; C705-V716 VanDerWaalsContact SG-CG2 3.57Å; A707-V716 HydrophobicContact CB-CG1 3.82Å; A707-V716 HydrophobicContact CB-CG2 4.02Å; V716-I729 HydrophobicContact CB-CB 4.26Å; V716-I729 HydrophobicContact CB-CD1 4.29Å; V716-I729 HydrophobicContact CG1-CD1 3.74Å; V716-L730 CarbonylContact C-O 3.51Å; V716-L730 VanDerWaalsContact CA-O 3.25Å; V716-L730 WeakPolarHBondContact CA-O 3.46Å; V716-F731 HydrophobicContact CG1-CB 4.39Å; V716-F731 HydrophobicContact CG1-CD1 3.24Å; V716-F731 HydrophobicContact CG1-CD2 4.35Å; V716-F731 HydrophobicContact CG1-CE1 3.41Å; V716-F731 VanDerWaalsContact CG1-CE1 3.41Å; V716-F731 HydrophobicContact CG1-CE2 4.49Å; V716-F731 HydrophobicContact CG1-CG 3.75Å; V716-F731 HydrophobicContact CG1-CZ 4.06Å; V716-L745 HydrophobicContact CG2-CD2 4.05Å
717	E	95.8	Very high	81.2	Confident	30 Å²	30	50.1 Å²	50.1	14%	0.14	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.1	167.1	-173.9	167.2	130.8	0	0	107	K632 T719 I729 L730 V732	K632-E717 IonicContact NZ-OE1 3.62Å; K632-E717 PolarHBondContact NZ-OE1 2.86Å; K632-E717 IonicContact NZ-OE2 2.69Å; E717-T719 PolarHBondContact O-N 2.73Å; E717-I729 WeakPolarHBondContact O-CA 3.28Å; E717-L730 PolarHBondContact N-O 3.3Å; E717-L730 PolarHBondContact O-N 2.91Å; E717-V732 HydrophobicContact CB-CG1 3.61Å
718	I	92	Very high	80.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	118.9	172.3	-63.2	176.6	0	0	0	107.5	P699 G702 K703 L721 L727 I729 L745	P699-I718 HydrophobicContact CB-CD1 3.73Å; G702-I718 PolarHBondContact N-O 2.7Å; K703-I718 HydrophobicContact CB-CD1 4.21Å; K703-I718 HydrophobicContact CD-CD1 4.4Å; K703-I718 PolarHBondContact O-N 2.84Å; I718-L721 HydrophobicContact CG2-CG 4.44Å; I718-L727 HydrophobicContact CD1-CD1 4.06Å; I718-L727 HydrophobicContact CG2-CD2 4.49Å; I718-I729 HydrophobicContact CG1-CG2 4.25Å; I718-L745 HydrophobicContact CD1-CD1 3.91Å; I718-L745 HydrophobicContact CG1-CD1 4.1Å
719	T	86	Confident	80.8	Confident	62 Å²	62	46.3 Å²	46.3	38%	0.38	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-23.4	-177.5	52.2	0	0	0	0	113.6	E717 D728 L730	E717-T719 PolarHBondContact O-N 2.73Å; T719-D728 PolarHBondContact N-O 3.26Å; T719-D728 PolarHBondContact OG1-O 3.38Å; T719-D728 VanDerWaalsContact OG1-O 3.05Å; T719-L730 HydrophobicContact CG2-CB 3.76Å
720	N	77.5	Confident	80.9	Confident	41 Å²	41	45 Å²	45	22%	0.219	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	156.2	176	-158.7	5.1	0	0	0	111.3	L727 D728	N720-L727 WeakPolarHBondContact O-CA 3.37Å; N720-D728 HydrophobicContact CB-CB 3.82Å; N720-D728 PolarHBondContact N-O 3.06Å; N720-D728 PolarHBondContact O-N 3.35Å
721	L	69.7	Low	81.3	Confident	49 Å²	49	37 Å²	37	26%	0.257	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123.4	172.6	-56.6	104	0	0	0	110.7	P699 C701 I718 L727	P699-L721 HydrophobicContact CB-CD2 3.84Å; P699-L721 HydrophobicContact CG-CD2 3.92Å; C701-L721 VanDerWaalsContact SG-CD1 3.5Å; I718-L721 HydrophobicContact CG2-CG 4.44Å; L721-L727 HydrophobicContact CB-CD2 4.05Å; L721-L727 HydrophobicContact CD2-CD2 3.63Å; L721-L727 HydrophobicContact CG-CD2 3.77Å
722	H	61.8	Low	81.9	Confident	14 Å²	14	35 Å²	35	7%	0.065	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	80.4	174.3	-64.4	-78.4	0	0	0	109	L113 V726 D728	L113-H722 PolarHBondContact N-ND1 3.41Å; H722-V726 CarbonylContact C-O 3.58Å; H722-V726 WeakPolarHBondContact CA-O 3.46Å; H722-V726 HydrophobicContact CB-CB 4.06Å; H722-V726 HydrophobicContact CB-CG1 4.3Å; H722-V726 WeakPolarHBondContact CB-O 3.48Å; H722-V726 PolarHBondContact N-O 3.13Å; H722-D728 IonicContact CD2-OD1 3.87Å; H722-D728 IonicContact CD2-OD2 2.67Å; H722-D728 IonicContact CE1-OD2 2.7Å; H722-D728 IonicContact NE2-OD1 3.05Å; H722-D728 PolarHBondContact NE2-OD1 3Å; H722-D728 IonicContact NE2-OD2 2.71Å; H722-D728 PolarHBondContact NE2-OD2 3.15Å
723	G	52.9	Low	82.2	Confident	35 Å²	35	28 Å²	28	36%	0.361	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	-150.6	-169.8	0	0	0	0	0	112.3
724	S	46.9	Very low	82.1	Confident	73 Å²	73	27.8 Å²	27.8	51%	0.51	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	15.9	-175.8	84.9	0	0	0	0	114.7	N116	N116-S724 VanDerWaalsContact CG-N 3.3Å; N116-S724 WeakPolarHBondContact ND2-CB 3.26Å; N116-S724 PolarHBondContact ND2-N 3.33Å; N116-S724 PolarHBondContact ND2-OG 3.01Å; N116-S724 PolarHBondContact OD1-N 3.27Å; N116-S724 PolarHBondContact OD1-OG 3.37Å
725	R	53.4	Low	81.8	Confident	120 Å²	120	27.3 Å²	27.3	45%	0.453	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-48.4	-175.5	-60.5	-169.7	-163.9	-146.3	3.3	114.1	E741 V742	R725-E741 CarbonylContact O-C 3.58Å; R725-E741 VanDerWaalsContact O-CA 3.29Å; R725-E741 WeakPolarHBondContact O-CA 3.34Å; R725-V742 PolarHBondContact O-N 3.19Å
726	V	71	Confident	81.3	Confident	29 Å²	29	28.2 Å²	28.2	18%	0.176	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.1	-176.8	-179.4	0	0	0	0	109	L115 H722 V740	L115-V726 HydrophobicContact CD1-CG2 4.08Å; H722-V726 CarbonylContact C-O 3.58Å; H722-V726 WeakPolarHBondContact CA-O 3.46Å; H722-V726 HydrophobicContact CB-CB 4.06Å; H722-V726 HydrophobicContact CB-CG1 4.3Å; H722-V726 WeakPolarHBondContact CB-O 3.48Å; H722-V726 PolarHBondContact N-O 3.13Å; V726-V740 WeakPolarHBondContact CA-O 3.4Å
727	L	75.5	Confident	80.8	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132	-175	-56.9	171.4	0	0	0	108.3	P699 I718 N720 L721 S739 V740 V742 L745	P699-L727 HydrophobicContact CB-CD1 3.94Å; P699-L727 HydrophobicContact CB-CD2 4.03Å; P699-L727 HydrophobicContact CG-CD2 4.36Å; I718-L727 HydrophobicContact CD1-CD1 4.06Å; I718-L727 HydrophobicContact CG2-CD2 4.49Å; N720-L727 WeakPolarHBondContact O-CA 3.37Å; L721-L727 HydrophobicContact CB-CD2 4.05Å; L721-L727 HydrophobicContact CD2-CD2 3.63Å; L721-L727 HydrophobicContact CG-CD2 3.77Å; L727-S739 CarbonylContact O-C 3.44Å; L727-S739 WeakPolarHBondContact O-CA 3.19Å; L727-V740 PolarHBondContact N-O 3.4Å; L727-V740 PolarHBondContact O-N 2.87Å; L727-V742 HydrophobicContact CD1-CB 3.87Å; L727-V742 HydrophobicContact CD1-CG2 3.96Å; L727-L745 HydrophobicContact CD1-CD1 3.43Å; L727-L745 VanDerWaalsContact CD1-CD1 3.43Å
728	D	82.6	Confident	80.2	Confident	30 Å²	30	34.6 Å²	34.6	16%	0.16	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	131.4	164.7	-64.4	-29.2	0	0	0	108.3	T719 N720 H722 S739	T719-D728 PolarHBondContact N-O 3.26Å; T719-D728 PolarHBondContact OG1-O 3.38Å; T719-D728 VanDerWaalsContact OG1-O 3.05Å; N720-D728 HydrophobicContact CB-CB 3.82Å; N720-D728 PolarHBondContact N-O 3.06Å; N720-D728 PolarHBondContact O-N 3.35Å; H722-D728 IonicContact CD2-OD1 3.87Å; H722-D728 IonicContact CD2-OD2 2.67Å; H722-D728 IonicContact CE1-OD2 2.7Å; H722-D728 IonicContact NE2-OD1 3.05Å; H722-D728 PolarHBondContact NE2-OD1 3Å; H722-D728 IonicContact NE2-OD2 2.71Å; H722-D728 PolarHBondContact NE2-OD2 3.15Å; D728-S739 WeakPolarHBondContact OD1-CB 3.48Å; D728-S739 PolarHBondContact OD1-OG 2.94Å
729	I	92.1	Very high	79.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	148.4	178.9	55.5	156.9	0	0	0	110.9	A707 V716 E717 I718 F731 Q737 A738 V740 L745	A707-I729 HydrophobicContact CB-CD1 4.21Å; V716-I729 HydrophobicContact CB-CB 4.26Å; V716-I729 HydrophobicContact CB-CD1 4.29Å; V716-I729 HydrophobicContact CG1-CD1 3.74Å; E717-I729 WeakPolarHBondContact O-CA 3.28Å; I718-I729 HydrophobicContact CG1-CG2 4.25Å; I729-F731 HydrophobicContact CD1-CD2 4.26Å; I729-F731 HydrophobicContact CD1-CE1 4.39Å; I729-F731 HydrophobicContact CD1-CE2 3.63Å; I729-F731 HydrophobicContact CD1-CZ 3.71Å; I729-Q737 WeakPolarHBondContact O-CA 3.48Å; I729-A738 HydrophobicContact CD1-CB 4.38Å; I729-A738 HydrophobicContact CG1-CB 4.13Å; I729-A738 WeakPolarHBondContact CG1-O 3.06Å; I729-A738 PolarHBondContact N-O 2.78Å; I729-A738 PolarHBondContact O-N 2.84Å; I729-V740 HydrophobicContact CD1-CB 4.4Å; I729-V740 HydrophobicContact CD1-CG1 3.68Å; I729-V740 HydrophobicContact CD1-CG2 3.79Å; I729-V740 HydrophobicContact CG1-CG1 4.07Å; I729-V740 HydrophobicContact CG1-CG2 3.84Å; I729-V740 HydrophobicContact CG2-CG2 3.89Å; I729-L745 HydrophobicContact CG2-CD1 4.41Å; I729-L745 HydrophobicContact CG2-CD2 4.29Å
730	L	93.1	Very high	79.5	Confident	32 Å²	32	36.4 Å²	36.4	17%	0.168	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.7	165.3	178.2	65.4	0	0	0	109	V716 E717 T719 V732 Q737	V716-L730 CarbonylContact C-O 3.51Å; V716-L730 VanDerWaalsContact CA-O 3.25Å; V716-L730 WeakPolarHBondContact CA-O 3.46Å; E717-L730 PolarHBondContact N-O 3.3Å; E717-L730 PolarHBondContact O-N 2.91Å; T719-L730 HydrophobicContact CG2-CB 3.76Å; L730-V732 VanDerWaalsContact C-N 3.33Å; L730-V732 HydrophobicContact CD2-CG1 4.41Å; L730-V732 HydrophobicContact CG-CG1 4.35Å; L730-V732 WeakPolarHBondContact O-CG1 3.38Å; L730-V732 PolarHBondContact O-N 3.36Å; L730-Q737 HydrophobicContact CD1-CG 3.9Å
731	F	96.4	Very high	79.6	Confident	10 Å²	10	37.9 Å²	37.9	4%	0.044	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	89.3	166	-70.3	-85.2	0	0	0	109.2	A707 Y709 R715 V716 I729 D733 V734 G735 V736 A738	A707-F731 HydrophobicContact CB-CE1 3.81Å; A707-F731 HydrophobicContact CB-CZ 4.03Å; Y709-F731 HydrophobicContact CD2-CE2 4.41Å; Y709-F731 HydrophobicContact CD2-CZ 4.42Å; Y709-F731 HydrophobicContact CG-CD1 4.45Å; Y709-F731 HydrophobicContact CG-CE1 4.4Å; R715-F731 WeakPolarHBondContact O-CA 3.48Å; V716-F731 HydrophobicContact CG1-CB 4.39Å; V716-F731 HydrophobicContact CG1-CD1 3.24Å; V716-F731 HydrophobicContact CG1-CD2 4.35Å; V716-F731 HydrophobicContact CG1-CE1 3.41Å; V716-F731 VanDerWaalsContact CG1-CE1 3.41Å; V716-F731 HydrophobicContact CG1-CE2 4.49Å; V716-F731 HydrophobicContact CG1-CG 3.75Å; V716-F731 HydrophobicContact CG1-CZ 4.06Å; I729-F731 HydrophobicContact CD1-CD2 4.26Å; I729-F731 HydrophobicContact CD1-CE1 4.39Å; I729-F731 HydrophobicContact CD1-CE2 3.63Å; I729-F731 HydrophobicContact CD1-CZ 3.71Å; F731-D733 PolarHBondContact O-N 3.26Å; F731-V734 HydrophobicContact CB-CG2 3.43Å; F731-V734 VanDerWaalsContact CB-CG2 3.43Å; F731-V734 HydrophobicContact CG-CG2 4.3Å; F731-V734 PolarHBondContact O-N 3.47Å; F731-G735 PolarHBondContact O-N 2.86Å; F731-V736 HydrophobicContact CB-CB 4.42Å; F731-V736 HydrophobicContact CD2-CB 4.23Å; F731-V736 HydrophobicContact CD2-CG1 4.32Å; F731-V736 WeakPolarHBondContact CD2-O 3.46Å; F731-V736 PolarHBondContact N-O 2.89Å; F731-A738 HydrophobicContact CE2-CB 4Å
732	V	95.9	Very high	79.7	Confident	16 Å²	16	37 Å²	37	10%	0.097	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.1	-166.4	-61.4	0	0	0	0	114.7	R715 E717 L730 P761 A763	R715-V732 HydrophobicContact CB-CG2 3.81Å; R715-V732 PolarHBondContact O-N 3.42Å; E717-V732 HydrophobicContact CB-CG1 3.61Å; L730-V732 VanDerWaalsContact C-N 3.33Å; L730-V732 HydrophobicContact CD2-CG1 4.41Å; L730-V732 HydrophobicContact CG-CG1 4.35Å; L730-V732 WeakPolarHBondContact O-CG1 3.38Å; L730-V732 PolarHBondContact O-N 3.36Å; V732-P761 HydrophobicContact CB-CB 4.18Å; V732-P761 HydrophobicContact CB-CG 4.44Å; V732-P761 WeakPolarHBondContact O-CB 3.28Å; V732-A763 WeakPolarHBondContact O-CB 3.17Å; V732-A763 PolarHBondContact O-N 3.33Å
733	D	96.4	Very high	80.4	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-13	179.1	-62.3	-48.8	0	0	0	114.6	Q666 L675 R715 F731 Q762 A763	Q666-D733 VanDerWaalsContact CD-O 3.32Å; Q666-D733 WeakPolarHBondContact CG-O 3.07Å; Q666-D733 PolarHBondContact NE2-O 2.93Å; L675-D733 HydrophobicContact CD2-CB 3.81Å; L675-D733 VanDerWaalsContact CD2-OD2 3.3Å; L675-D733 WeakPolarHBondContact CD2-OD2 3.41Å; R715-D733 WeakPolarHBondContact CB-OD2 3.39Å; R715-D733 WeakPolarHBondContact CG-OD2 3.46Å; R715-D733 IonicContact CZ-OD1 3.65Å; R715-D733 IonicContact CZ-OD2 3.3Å; R715-D733 IonicContact NE-OD1 2.72Å; R715-D733 PolarHBondContact NE-OD1 3.06Å; R715-D733 IonicContact NE-OD2 2.77Å; R715-D733 PolarHBondContact NE-OD2 2.78Å; R715-D733 IonicContact NH2-OD1 3.88Å; R715-D733 PolarHBondContact NH2-OD1 3.03Å; R715-D733 IonicContact NH2-OD2 3.2Å; F731-D733 PolarHBondContact O-N 3.26Å; D733-Q762 HydrophobicContact CB-CB 4.29Å; D733-Q762 PolarHBondContact OD1-N 3.16Å; D733-A763 PolarHBondContact O-N 3.26Å
734	V	92.7	Very high	81.8	Confident	14 Å²	14	44.1 Å²	44.1	9%	0.085	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-6.6	176.9	-65	0	0	0	0	113.9	S655 Y709 F731 V736	S655-V734 VanDerWaalsContact CB-O 3.23Å; S655-V734 WeakPolarHBondContact CB-O 3.33Å; S655-V734 PolarHBondContact OG-O 3.32Å; Y709-V734 HydrophobicContact CD1-CG2 4.29Å; Y709-V734 HydrophobicContact CE1-CB 4.46Å; Y709-V734 HydrophobicContact CE1-CG1 4.2Å; Y709-V734 HydrophobicContact CE1-CG2 4Å; F731-V734 HydrophobicContact CB-CG2 3.43Å; F731-V734 VanDerWaalsContact CB-CG2 3.43Å; F731-V734 HydrophobicContact CG-CG2 4.3Å; F731-V734 PolarHBondContact O-N 3.47Å; V734-V736 VanDerWaalsContact C-N 3.28Å; V734-V736 HydrophobicContact CB-CG2 4.4Å; V734-V736 HydrophobicContact CG2-CB 4.1Å; V734-V736 HydrophobicContact CG2-CG2 3.91Å; V734-V736 PolarHBondContact O-N 3.41Å
735	G	89.9	Confident	83.7	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.01	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	25.9	177	0	0	0	0	0	114.5	S656 Y664 F731	S656-G735 WeakPolarHBondContact CB-O 3.29Å; S656-G735 PolarHBondContact OG-O 3.04Å; S656-G735 VanDerWaalsContact OG-O 3.12Å; Y664-G735 VanDerWaalsContact CD2-O 3.3Å; Y664-G735 WeakPolarHBondContact CD2-O 3.39Å; Y664-G735 VanDerWaalsContact CG-CA 3.48Å; F731-G735 PolarHBondContact O-N 2.86Å
736	V	88.4	Confident	85.5	Confident	29 Å²	29	36.4 Å²	36.4	18%	0.176	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.8	176.8	176.4	0	0	0	0	108.6	Y709 F731 V734	Y709-V736 HydrophobicContact CE2-CG1 4.48Å; Y709-V736 HydrophobicContact CE2-CG2 4.44Å; F731-V736 HydrophobicContact CB-CB 4.42Å; F731-V736 HydrophobicContact CD2-CB 4.23Å; F731-V736 HydrophobicContact CD2-CG1 4.32Å; F731-V736 WeakPolarHBondContact CD2-O 3.46Å; F731-V736 PolarHBondContact N-O 2.89Å; V734-V736 VanDerWaalsContact C-N 3.28Å; V734-V736 HydrophobicContact CB-CG2 4.4Å; V734-V736 HydrophobicContact CG2-CB 4.1Å; V734-V736 HydrophobicContact CG2-CG2 3.91Å; V734-V736 PolarHBondContact O-N 3.41Å
737	Q	86.7	Confident	86.5	Confident	133 Å²	133	37.2 Å²	37.2	62%	0.621	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	144.4	168.8	-69.3	174.4	-16.9	0	0	109.7	I729 L730	I729-Q737 WeakPolarHBondContact O-CA 3.48Å; L730-Q737 HydrophobicContact CD1-CG 3.9Å
738	A	83.8	Confident	87.4	Confident	33 Å²	33	37.7 Å²	37.7	27%	0.273	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	152.5	173.5	0	0	0	0	0	110.4	I729 F731 V740	I729-A738 HydrophobicContact CD1-CB 4.38Å; I729-A738 HydrophobicContact CG1-CB 4.13Å; I729-A738 WeakPolarHBondContact CG1-O 3.06Å; I729-A738 PolarHBondContact N-O 2.78Å; I729-A738 PolarHBondContact O-N 2.84Å; F731-A738 HydrophobicContact CE2-CB 4Å; A738-V740 HydrophobicContact CB-CG1 4.35Å
739	S	83.8	Confident	87.9	Confident	82 Å²	82	36.3 Å²	36.3	57%	0.573	19%	0.19	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	127.8	165.5	-47.8	0	0	0	0	108.3	L727 D728	L727-S739 CarbonylContact O-C 3.44Å; L727-S739 WeakPolarHBondContact O-CA 3.19Å; D728-S739 WeakPolarHBondContact OD1-CB 3.48Å; D728-S739 PolarHBondContact OD1-OG 2.94Å
740	V	79.6	Confident	87.8	Confident	19 Å²	19	41.5 Å²	41.5	12%	0.115	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	161.3	-174.6	-62.7	0	0	0	0	111.2	V726 L727 I729 A738 E744 L745	V726-V740 WeakPolarHBondContact CA-O 3.4Å; L727-V740 PolarHBondContact N-O 3.4Å; L727-V740 PolarHBondContact O-N 2.87Å; I729-V740 HydrophobicContact CD1-CB 4.4Å; I729-V740 HydrophobicContact CD1-CG1 3.68Å; I729-V740 HydrophobicContact CD1-CG2 3.79Å; I729-V740 HydrophobicContact CG1-CG1 4.07Å; I729-V740 HydrophobicContact CG1-CG2 3.84Å; I729-V740 HydrophobicContact CG2-CG2 3.89Å; A738-V740 HydrophobicContact CB-CG1 4.35Å; V740-E744 WeakPolarHBondContact CA-OE2 3.19Å; V740-E744 WeakPolarHBondContact CB-OE2 3.27Å; V740-L745 HydrophobicContact CG2-CD2 3.88Å; V740-L745 HydrophobicContact CG2-CG 4.24Å
741	E	78.8	Confident	87.9	Confident	71 Å²	71	46 Å²	46	33%	0.332	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	145.6	170.9	-65.1	-167.8	88.3	0	0	111.4	R725 F743 E744	R725-E741 CarbonylContact O-C 3.58Å; R725-E741 VanDerWaalsContact O-CA 3.29Å; R725-E741 WeakPolarHBondContact O-CA 3.34Å; E741-F743 HydrophobicContact CB-CD1 3.78Å; E741-F743 HydrophobicContact CB-CE1 3.47Å; E741-F743 VanDerWaalsContact CB-CE1 3.47Å; E741-F743 HydrophobicContact CB-CZ 3.92Å; E741-F743 HydrophobicContact CG-CE1 4.01Å; E741-F743 HydrophobicContact CG-CZ 4.4Å; E741-F743 PolarHBondContact O-N 3.39Å; E741-F743 WeakPolarHBondContact OE2-CE1 3.28Å; E741-F743 VanDerWaalsContact OE2-CZ 3.28Å; E741-F743 WeakPolarHBondContact OE2-CZ 3.22Å; E741-E744 HydrophobicContact CB-CG 4.36Å; E741-E744 PolarHBondContact N-OE2 3.41Å; E741-E744 VanDerWaalsContact O-CB 3.3Å; E741-E744 WeakPolarHBondContact O-CB 3.48Å; E741-E744 PolarHBondContact O-N 3.23Å
742	V	72.6	Confident	87.9	Confident	31 Å²	31	46.7 Å²	46.7	19%	0.188	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-55.9	-28.1	-177	66.3	0	0	0	0	113.6	V696 P699 R725 L727 E744 L745	V696-V742 HydrophobicContact CB-CG2 4.35Å; V696-V742 HydrophobicContact CG1-CG2 4.34Å; P699-V742 HydrophobicContact CG-CG2 4.21Å; R725-V742 PolarHBondContact O-N 3.19Å; L727-V742 HydrophobicContact CD1-CB 3.87Å; L727-V742 HydrophobicContact CD1-CG2 3.96Å; V742-E744 VanDerWaalsContact C-N 3.27Å; V742-E744 PolarHBondContact O-N 3.05Å; V742-L745 PolarHBondContact O-N 2.81Å
743	F	75.6	Confident	87.9	Confident	107 Å²	107	47.5 Å²	47.5	47%	0.469	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-75.8	-10.9	176.5	70.9	-104.1	0	0	0	114.3	L695 E741 L745 R746	L695-F743 HydrophobicContact CD2-CB 4.17Å; E741-F743 HydrophobicContact CB-CD1 3.78Å; E741-F743 HydrophobicContact CB-CE1 3.47Å; E741-F743 VanDerWaalsContact CB-CE1 3.47Å; E741-F743 HydrophobicContact CB-CZ 3.92Å; E741-F743 HydrophobicContact CG-CE1 4.01Å; E741-F743 HydrophobicContact CG-CZ 4.4Å; E741-F743 PolarHBondContact O-N 3.39Å; E741-F743 WeakPolarHBondContact OE2-CE1 3.28Å; E741-F743 VanDerWaalsContact OE2-CZ 3.28Å; E741-F743 WeakPolarHBondContact OE2-CZ 3.22Å; F743-L745 VanDerWaalsContact C-N 3.33Å; F743-R746 PolarHBondContact O-NH1 2.89Å
744	E	83.3	Confident	87.9	Confident	92 Å²	92	54.8 Å²	54.8	43%	0.43	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-81.2	-19.9	173	-57.5	-171.6	91	0	0	111.7	V740 E741 V742	V740-E744 WeakPolarHBondContact CA-OE2 3.19Å; V740-E744 WeakPolarHBondContact CB-OE2 3.27Å; E741-E744 HydrophobicContact CB-CG 4.36Å; E741-E744 PolarHBondContact N-OE2 3.41Å; E741-E744 VanDerWaalsContact O-CB 3.3Å; E741-E744 WeakPolarHBondContact O-CB 3.48Å; E741-E744 PolarHBondContact O-N 3.23Å; V742-E744 VanDerWaalsContact C-N 3.27Å; V742-E744 PolarHBondContact O-N 3.05Å
745	L	86.6	Confident	88.1	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.			trans	-83.4	151	178.8	-57.4	-175	0	0	0	112.3	V696 L706 A707 V716 I718 L727 I729 V740 V742 F743	V696-L745 HydrophobicContact CB-CB 4.16Å; V696-L745 HydrophobicContact CG2-CB 3.63Å; L706-L745 CarbonylContact O-C 3.56Å; L706-L745 WeakPolarHBondContact O-CA 3.31Å; A707-L745 HydrophobicContact CB-CD2 3.81Å; V716-L745 HydrophobicContact CG2-CD2 4.05Å; I718-L745 HydrophobicContact CD1-CD1 3.91Å; I718-L745 HydrophobicContact CG1-CD1 4.1Å; L727-L745 HydrophobicContact CD1-CD1 3.43Å; L727-L745 VanDerWaalsContact CD1-CD1 3.43Å; I729-L745 HydrophobicContact CG2-CD1 4.41Å; I729-L745 HydrophobicContact CG2-CD2 4.29Å; V740-L745 HydrophobicContact CG2-CD2 3.88Å; V740-L745 HydrophobicContact CG2-CG 4.24Å; V742-L745 PolarHBondContact O-N 2.81Å; F743-L745 VanDerWaalsContact C-N 3.33Å
746	R	90.9	Very high	88.4	Confident	31 Å²	31	58 Å²	58	12%	0.117	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-129	137.3	169.4	-63.5	-62.1	-179.1	-80.6	2.1	111.9	F686 T691 F694 C705 L706 W713 F743	F686-R746 HydrophobicContact CZ-CB 4.21Å; T691-R746 WeakPolarHBondContact O-CD 3.5Å; T691-R746 PolarHBondContact O-NE 2.76Å; F694-R746 HydrophobicContact CB-CB 4.36Å; F694-R746 CarbonylContact O-C 3.57Å; F694-R746 WeakPolarHBondContact O-CA 3.4Å; F694-R746 VanDerWaalsContact O-CD 3.25Å; F694-R746 WeakPolarHBondContact O-CD 3.3Å; C705-R746 VanDerWaalsContact CB-O 3.27Å; C705-R746 WeakPolarHBondContact CB-O 3.31Å; L706-R746 HydrophobicContact CB-CB 4.32Å; L706-R746 PolarHBondContact N-O 2.68Å; L706-R746 PolarHBondContact O-N 3.36Å; W713-R746 HydrophobicContact CH2-CB 4.45Å; W713-R746 HydrophobicContact CH2-CG 3.54Å; W713-R746 HydrophobicContact CZ2-CG 4.36Å; W713-R746 HydrophobicContact CZ3-CB 4.32Å; W713-R746 HydrophobicContact CZ3-CG 3.82Å; F743-R746 PolarHBondContact O-NH1 2.89Å
747	E	90.9	Very high	88.7	Confident	46 Å²	46	56.7 Å²	56.7	22%	0.215	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-55.9	143.1	162.4	-60.8	-69.2	-178.8	0	0	109.4	F694 V696 K703 P749	F694-E747 PolarHBondContact O-N 2.96Å; V696-E747 HydrophobicContact CG2-CG 4.27Å; K703-E747 WeakPolarHBondContact CE-OE1 3.47Å; K703-E747 VanDerWaalsContact CE-OE2 3.24Å; K703-E747 WeakPolarHBondContact CE-OE2 3.48Å; K703-E747 IonicContact NZ-OE1 2.71Å; K703-E747 PolarHBondContact NZ-OE1 3.13Å; K703-E747 IonicContact NZ-OE2 3.4Å; K703-E747 PolarHBondContact NZ-OE2 2.8Å; E747-P749 WeakPolarHBondContact O-CD 3.15Å
748	I	95	Very high	89.2	Confident	11 Å²	11	51.4 Å²	51.4	6%	0.056	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-69.8	124.2	174.3	-61.9	147.2	0	0	0	107.4	Q704 L706 L753 L756	Q704-I748 HydrophobicContact CB-CD1 4.24Å; L706-I748 HydrophobicContact CD1-CG1 4.29Å; L706-I748 HydrophobicContact CD2-CG1 4.21Å; L706-I748 HydrophobicContact CG-CG1 3.86Å; I748-L753 HydrophobicContact CB-CD1 3.94Å; I748-L753 HydrophobicContact CD1-CD1 4.01Å; I748-L753 HydrophobicContact CG2-CB 4.22Å; I748-L753 HydrophobicContact CG2-CD1 4.05Å; I748-L756 HydrophobicContact CD1-CD2 3.68Å; I748-L756 HydrophobicContact CG1-CD2 4.07Å; I748-L756 HydrophobicContact CG2-CB 4.47Å; I748-L756 HydrophobicContact CG2-CD1 4.19Å; I748-L756 HydrophobicContact CG2-CD2 4.3Å
749	P	92.5	Very high	89.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-59.1	136.9	-178.3	-22.6	31.8	0	0	0	110.9	Y685 F686 F694 E747 L751 F752 L753	Y685-P749 HydrophobicContact CD1-CB 4.2Å; Y685-P749 HydrophobicContact CD1-CG 3.88Å; Y685-P749 HydrophobicContact CE1-CB 3.67Å; Y685-P749 HydrophobicContact CE1-CG 3.72Å; F686-P749 HydrophobicContact CE1-CG 3.83Å; F686-P749 HydrophobicContact CE2-CG 4.28Å; F686-P749 HydrophobicContact CZ-CG 3.55Å; F694-P749 HydrophobicContact CD1-CB 4.12Å; F694-P749 HydrophobicContact CD1-CG 4.01Å; F694-P749 HydrophobicContact CE1-CB 3.7Å; F694-P749 HydrophobicContact CE1-CG 3.99Å; F694-P749 HydrophobicContact CZ-CB 4.5Å; E747-P749 WeakPolarHBondContact O-CD 3.15Å; P749-L751 PolarHBondContact O-N 3.1Å; P749-F752 HydrophobicContact CB-CD2 3.91Å; P749-F752 HydrophobicContact CB-CE2 4.37Å; P749-F752 HydrophobicContact CG-CD2 4.11Å; P749-F752 PolarHBondContact O-N 3.03Å; P749-L753 PolarHBondContact O-N 3.42Å
750	P	91.5	Very high	90.5	Very high	109 Å²	109	46.5 Å²	46.5	71%	0.708	23%	0.231	S	C	*	.	H	α-helix	trans	-53.1	-33.6	-171.6	-30.8	35.8	0	0	0	114.8	F752 L753	P750-F752 PolarHBondContact O-N 3.28Å; P750-L753 PolarHBondContact O-N 3.16Å
751	L	94.8	Very high	91.3	Very high	128 Å²	128	48 Å²	48	67%	0.67	24%	0.241	S	C	*	.	H	α-helix	trans	-56.5	-33.6	176	-178.8	62.8	0	0	0	113.7	P749	P749-L751 PolarHBondContact O-N 3.1Å
752	F	96.8	Very high	92.1	Very high	23 Å²	23	44.7 Å²	44.7	10%	0.101	23%	0.226	C	C	.	.	H	α-helix	trans	-103.9	-11.2	-176.8	-52.7	-68.6	0	0	0	113.2	I678 K681 I682 Y685 P749 P750 R754 D755 L756	I678-F752 HydrophobicContact CG2-CB 4.31Å; I678-F752 HydrophobicContact CG2-CD1 4.43Å; K681-F752 HydrophobicContact CB-CE1 3.84Å; K681-F752 HydrophobicContact CB-CZ 4.25Å; I682-F752 HydrophobicContact CD1-CB 3.92Å; I682-F752 HydrophobicContact CD1-CD2 4.2Å; I682-F752 HydrophobicContact CD1-CG 4.08Å; I682-F752 HydrophobicContact CG1-CB 4.02Å; I682-F752 HydrophobicContact CG1-CD1 4.22Å; I682-F752 HydrophobicContact CG1-CD2 3.39Å; I682-F752 HydrophobicContact CG1-CE2 3.83Å; I682-F752 HydrophobicContact CG1-CG 3.61Å; I682-F752 HydrophobicContact CG1-CZ 4.4Å; Y685-F752 HydrophobicContact CD1-CE2 4.11Å; Y685-F752 HydrophobicContact CD2-CE2 4.14Å; Y685-F752 HydrophobicContact CD2-CZ 4.44Å; Y685-F752 AromaticContact CG-CE2 3.78Å; Y685-F752 HydrophobicContact CG-CE2 3.78Å; Y685-F752 HydrophobicContact CG-CZ 4.31Å; P749-F752 HydrophobicContact CB-CD2 3.91Å; P749-F752 HydrophobicContact CB-CE2 4.37Å; P749-F752 HydrophobicContact CG-CD2 4.11Å; P749-F752 PolarHBondContact O-N 3.03Å; P750-F752 PolarHBondContact O-N 3.28Å; F752-R754 PolarHBondContact O-N 3.35Å; F752-D755 PolarHBondContact O-N 2.63Å; F752-L756 WeakPolarHBondContact O-CB 3.45Å; F752-L756 PolarHBondContact O-N 2.89Å
753	L	95.6	Very high	93.2	Very high	33 Å²	33	43.9 Å²	43.9	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-56	-51.6	-170.1	-178.6	67.6	0	0	0	112.6	P580 F581 I748 P749 P750 D755 L756 V757	P580-L753 HydrophobicContact CB-CD2 4.06Å; P580-L753 HydrophobicContact CG-CD2 3.77Å; F581-L753 HydrophobicContact CE2-CD2 4Å; F581-L753 HydrophobicContact CE2-CG 4.15Å; F581-L753 HydrophobicContact CZ-CD2 4.05Å; F581-L753 HydrophobicContact CZ-CG 3.95Å; I748-L753 HydrophobicContact CB-CD1 3.94Å; I748-L753 HydrophobicContact CD1-CD1 4.01Å; I748-L753 HydrophobicContact CG2-CB 4.22Å; I748-L753 HydrophobicContact CG2-CD1 4.05Å; P749-L753 PolarHBondContact O-N 3.42Å; P750-L753 PolarHBondContact O-N 3.16Å; L753-D755 PolarHBondContact O-N 3Å; L753-L756 PolarHBondContact O-N 2.79Å; L753-V757 HydrophobicContact CD1-CG2 3.81Å; L753-V757 HydrophobicContact CG-CG2 4.29Å; L753-V757 VanDerWaalsContact O-CB 3.31Å; L753-V757 WeakPolarHBondContact O-CB 3.39Å; L753-V757 WeakPolarHBondContact O-CG2 3.37Å; L753-V757 PolarHBondContact O-N 3.05Å
754	R	95.4	Very high	94.1	Very high	157 Å²	157	39.5 Å²	39.5	59%	0.592	20%	0.204	S	C	*	.	H	α-helix	trans	-64.5	-41.6	-176.4	-163.8	163.6	-160	-88.9	5.2	112.3	F581 E584 F752 S758	F581-R754 HydrophobicContact CE1-CB 4.27Å; F581-R754 HydrophobicContact CE1-CG 4.02Å; E584-R754 IonicContact OE1-CZ 3.21Å; E584-R754 IonicContact OE1-NE 2.88Å; E584-R754 PolarHBondContact OE1-NE 3.12Å; E584-R754 IonicContact OE1-NH2 3.97Å; E584-R754 PolarHBondContact OE1-NH2 2.98Å; E584-R754 IonicContact OE2-NH2 3.47Å; E584-R754 PolarHBondContact OE2-NH2 3.29Å; F752-R754 PolarHBondContact O-N 3.35Å; R754-S758 WeakPolarHBondContact O-CB 3.4Å; R754-S758 PolarHBondContact O-N 3.18Å; R754-S758 VanDerWaalsContact O-N 3.16Å
755	D	96.6	Very high	94.6	Very high	81 Å²	81	38.7 Å²	38.7	43%	0.433	20%	0.199	S	C	.	.	H	α-helix	trans	-67.4	-40.7	176.7	-97.6	-42.9	0	0	0	112.6	K674 I678 F752 L753 S758	K674-D755 IonicContact NZ-OD1 2.71Å; K674-D755 PolarHBondContact NZ-OD1 2.74Å; I678-D755 HydrophobicContact CD1-CB 3.92Å; F752-D755 PolarHBondContact O-N 2.63Å; L753-D755 PolarHBondContact O-N 3Å; D755-S758 PolarHBondContact O-N 2.86Å; D755-S758 PolarHBondContact O-OG 3Å
756	L	96.8	Very high	94.8	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-76.7	-35.9	-176.1	-173.2	149.8	0	0	0	112.3	I678 L679 I682 L706 R715 I748 F752 L753 S758 I759	I678-L756 HydrophobicContact CG2-CB 4.38Å; I678-L756 HydrophobicContact CG2-CD1 4.23Å; L679-L756 HydrophobicContact CD2-CD1 4.34Å; I682-L756 HydrophobicContact CD1-CD1 3.42Å; I682-L756 VanDerWaalsContact CD1-CD1 3.42Å; L706-L756 HydrophobicContact CD2-CD1 4.22Å; R715-L756 HydrophobicContact CG-CD1 4.26Å; R715-L756 HydrophobicContact CG-CD2 3.92Å; R715-L756 HydrophobicContact CG-CG 4.24Å; R715-L756 PolarHBondContact NH1-O 3.21Å; I748-L756 HydrophobicContact CD1-CD2 3.68Å; I748-L756 HydrophobicContact CG1-CD2 4.07Å; I748-L756 HydrophobicContact CG2-CB 4.47Å; I748-L756 HydrophobicContact CG2-CD1 4.19Å; I748-L756 HydrophobicContact CG2-CD2 4.3Å; F752-L756 WeakPolarHBondContact O-CB 3.45Å; F752-L756 PolarHBondContact O-N 2.89Å; L753-L756 PolarHBondContact O-N 2.79Å; L756-S758 VanDerWaalsContact C-N 3.33Å; L756-I759 PolarHBondContact O-N 3.18Å
757	V	95.8	Very high	94.8	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-69	-31.2	172.2	171.5	0	0	0	0	111.4	F581 M631 L634 L753 I759	F581-V757 HydrophobicContact CE2-CG2 4.43Å; F581-V757 HydrophobicContact CZ-CB 4.49Å; F581-V757 HydrophobicContact CZ-CG2 4.45Å; M631-V757 HydrophobicContact CE-CB 4.45Å; M631-V757 HydrophobicContact CE-CG1 3.79Å; M631-V757 HydrophobicContact CE-CG2 3.7Å; L634-V757 HydrophobicContact CB-CG1 3.9Å; L634-V757 HydrophobicContact CD1-CG1 3.9Å; L753-V757 HydrophobicContact CD1-CG2 3.81Å; L753-V757 HydrophobicContact CG-CG2 4.29Å; L753-V757 VanDerWaalsContact O-CB 3.31Å; L753-V757 WeakPolarHBondContact O-CB 3.39Å; L753-V757 WeakPolarHBondContact O-CG2 3.37Å; L753-V757 PolarHBondContact O-N 3.05Å; V757-I759 PolarHBondContact O-N 3.43Å; V757-I759 VanDerWaalsContact O-N 3.15Å
758	S	96.9	Very high	94.8	Very high	21 Å²	21	37.6 Å²	37.6	15%	0.147	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-16.8	177.3	77.9	0	0	0	0	114.5	D636 K674 R754 D755 L756	D636-S758 PolarHBondContact N-O 3.38Å; K674-S758 PolarHBondContact NZ-OG 2.86Å; R754-S758 WeakPolarHBondContact O-CB 3.4Å; R754-S758 PolarHBondContact O-N 3.18Å; R754-S758 VanDerWaalsContact O-N 3.16Å; D755-S758 PolarHBondContact O-N 2.86Å; D755-S758 PolarHBondContact O-OG 3Å; L756-S758 VanDerWaalsContact C-N 3.33Å
759	I	98.1	Very high	94.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-92.3	122	-177.6	-61.1	166.9	0	0	0	109.1	L639 K674 L675 I678 R715 L756 V757 Q762	L639-I759 HydrophobicContact CD1-CG1 3.9Å; K674-I759 HydrophobicContact CB-CD1 4.18Å; K674-I759 HydrophobicContact CD-CD1 3.98Å; K674-I759 HydrophobicContact CD-CG1 4.18Å; K674-I759 HydrophobicContact CG-CD1 4.07Å; L675-I759 HydrophobicContact CB-CD1 4.17Å; L675-I759 HydrophobicContact CB-CG2 4.4Å; I678-I759 HydrophobicContact CD1-CD1 3.68Å; R715-I759 PolarHBondContact NH1-O 2.82Å; R715-I759 PolarHBondContact NH2-O 2.74Å; L756-I759 PolarHBondContact O-N 3.18Å; V757-I759 PolarHBondContact O-N 3.43Å; V757-I759 VanDerWaalsContact O-N 3.15Å; I759-Q762 HydrophobicContact CG2-CG 4.17Å
760	P	96.5	Very high	94	Very high	12 Å²	12	43.7 Å²	43.7	8%	0.078	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-57.8	158.6	171.2	-22.5	32.3	0	0	0	112.4	Q635 D636 A640 R715 Q762	Q635-P760 HydrophobicContact CB-CG 4.18Å; D636-P760 WeakPolarHBondContact O-CD 3.26Å; D636-P760 WeakPolarHBondContact O-CG 3.13Å; A640-P760 HydrophobicContact CB-CB 4.42Å; A640-P760 HydrophobicContact CB-CG 4.09Å; R715-P760 PolarHBondContact NH2-O 2.73Å; P760-Q762 PolarHBondContact O-N 2.7Å; P760-Q762 PolarHBondContact O-NE2 3.48Å
761	P	96.1	Very high	93.3	Very high	52 Å²	52	39.8 Å²	39.8	34%	0.338	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-49.3	129.4	168	-28.8	37.4	0	0	0	111.8	V732	V732-P761 HydrophobicContact CB-CB 4.18Å; V732-P761 HydrophobicContact CB-CG 4.44Å; V732-P761 WeakPolarHBondContact O-CB 3.28Å
762	Q	96.3	Very high	91.7	Very high	1 Å²	1	39 Å²	39	1%	0.005	22%	0.219	C	C	.	.	S	Bend	trans	-94.3	-2.3	-176	-61.6	-61.8	-60	0	0	114.2	L639 S669 L672 L675 D733 I759 P760	L639-Q762 PolarHBondContact O-NE2 2.93Å; S669-Q762 PolarHBondContact OG-OE1 3.26Å; L672-Q762 HydrophobicContact CB-CG 4.43Å; L672-Q762 HydrophobicContact CD1-CB 4.19Å; L675-Q762 HydrophobicContact CD2-CB 4.25Å; L675-Q762 HydrophobicContact CD2-CG 3.82Å; D733-Q762 HydrophobicContact CB-CB 4.29Å; D733-Q762 PolarHBondContact OD1-N 3.16Å; I759-Q762 HydrophobicContact CG2-CG 4.17Å; P760-Q762 PolarHBondContact O-N 2.7Å; P760-Q762 PolarHBondContact O-NE2 3.48Å
763	A	95.5	Very high	90.1	Very high	14 Å²	14	39.7 Å²	39.7	12%	0.116	23%	0.225	C	C	.	.	S	Bend	trans	-90	118.1	165.1	0	0	0	0	0	110.6	Y664 V732 D733	Y664-A763 HydrophobicContact CD1-CB 4.11Å; V732-A763 WeakPolarHBondContact O-CB 3.17Å; V732-A763 PolarHBondContact O-N 3.33Å; D733-A763 PolarHBondContact O-N 3.26Å
764	V	94.1	Very high	88.1	Confident	15 Å²	15	41.9 Å²	41.9	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	121.1	171.6	-177.3	0	0	0	0	108.5	S641 L643 Y664 C665 L667 V810	S641-V764 WeakPolarHBondContact OG-CG2 3.29Å; L643-V764 HydrophobicContact CD1-CB 4.4Å; L643-V764 HydrophobicContact CD1-CG1 3.55Å; L643-V764 HydrophobicContact CD1-CG2 3.92Å; Y664-V764 WeakPolarHBondContact CA-O 3.46Å; C665-V764 PolarHBondContact N-O 3.07Å; C665-V764 WeakPolarHBondContact O-CB 3.16Å; C665-V764 PolarHBondContact O-N 3.36Å; L667-V764 HydrophobicContact CD1-CB 4.25Å; L667-V764 HydrophobicContact CD1-CG2 3.55Å; V764-V810 HydrophobicContact CG1-CB 4.26Å; V764-V810 HydrophobicContact CG1-CG2 3.76Å
765	K	93.4	Very high	85.9	Confident	74 Å²	74	40.4 Å²	40.4	32%	0.322	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	122.6	169.8	-170.4	-176.7	-178.4	-178.7	0	109.2	T662 Y664 C809 V810	T662-K765 HydrophobicContact CG2-CD 4.22Å; T662-K765 VanDerWaalsContact CG2-CE 3.5Å; T662-K765 HydrophobicContact CG2-CG 3.68Å; Y664-K765 HydrophobicContact CD1-CB 4.15Å; Y664-K765 HydrophobicContact CD1-CG 4.48Å; Y664-K765 HydrophobicContact CE1-CB 3.76Å; Y664-K765 HydrophobicContact CE1-CD 4.47Å; Y664-K765 HydrophobicContact CE1-CG 3.88Å; K765-C809 WeakPolarHBondContact O-CA 3.3Å; K765-V810 PolarHBondContact O-N 2.93Å
766	C	92.3	Very high	83.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	154.4	-174.8	-68.9	0	0	0	0	111.4	I663 V810 V812	I663-C766 HydrophobicContact CB-CB 4.18Å; I663-C766 PolarHBondContact N-O 3.1Å; I663-C766 WeakPolarHBondContact O-CA 3.23Å; I663-C766 PolarHBondContact O-N 2.77Å; C766-V810 CarbonylContact C-O 3.6Å; C766-V810 WeakPolarHBondContact CA-O 3.39Å; C766-V812 HydrophobicContact CB-CG2 4.02Å
767	C	90.6	Very high	82.1	Confident	41 Å²	41	42.8 Å²	42.8	28%	0.277	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	155.5	162.6	59.7	0	0	0	0	109.8	A769 V810 C811 V812	C767-A769 PolarHBondContact O-N 2.84Å; C767-V810 PolarHBondContact N-O 2.92Å; C767-C811 WeakPolarHBondContact O-CA 3.5Å; C767-C811 VanDerWaalsContact SG-SG 3.61Å; C767-V812 PolarHBondContact O-N 2.86Å
768	L	89.8	Confident	81.3	Confident	14 Å²	14	44.4 Å²	44.4	7%	0.073	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.6	177.5	-65.5	-170.7	0	0	0	110.3	I663 L771 W778 L786 V812 L814 N828 M831	I663-L768 HydrophobicContact CD1-CD1 4.33Å; I663-L768 HydrophobicContact CD1-CD2 3.47Å; I663-L768 VanDerWaalsContact CD1-CD2 3.47Å; I663-L768 HydrophobicContact CD1-CG 3.71Å; L768-L771 HydrophobicContact CB-CD1 3.7Å; L768-L771 HydrophobicContact CB-CG 4.13Å; L768-L771 HydrophobicContact CD1-CD1 4.05Å; L768-L771 HydrophobicContact CG-CD1 4.45Å; L768-W778 HydrophobicContact CD1-CH2 4.12Å; L768-L786 HydrophobicContact CD1-CD1 4.27Å; L768-L786 HydrophobicContact CD1-CD2 4.35Å; L768-V812 HydrophobicContact CD2-CG2 4.48Å; L768-L814 HydrophobicContact CD2-CB 3.82Å; L768-L814 HydrophobicContact CD2-CD2 4.37Å; L768-N828 WeakPolarHBondContact CA-ND2 3.23Å; L768-N828 WeakPolarHBondContact CB-ND2 3.46Å; L768-M831 HydrophobicContact CD1-SD 3.85Å
769	A	87.9	Confident	80.4	Confident	8 Å²	8	45.2 Å²	45.2	7%	0.066	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	157.6	169.8	0	0	0	0	0	112.3	C767 L771 A801 C811 V812 N828	C767-A769 PolarHBondContact O-N 2.84Å; A769-L771 PolarHBondContact O-N 2.8Å; A769-A801 HydrophobicContact CB-CB 3.72Å; A769-C811 HydrophobicContact CB-CB 4.27Å; A769-V812 PolarHBondContact N-O 3.3Å; A769-N828 PolarHBondContact N-ND2 2.97Å; A769-N828 PolarHBondContact O-ND2 3.34Å
770	D	82.5	Confident	79.6	Confident	130 Å²	130	49.9 Å²	49.9	70%	0.695	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	12.8	172.7	-49.1	-27.8	0	0	0	116.8	H813	D770-H813 IonicContact OD2-CD2 2.7Å; D770-H813 IonicContact OD2-CE1 3.58Å; D770-H813 PolarHBondContact OD2-CE1 3.26Å; D770-H813 IonicContact OD2-NE2 2.86Å; D770-H813 PolarHBondContact OD2-NE2 2.98Å
771	L	78.4	Confident	79	Confident	27 Å²	27	54.6 Å²	54.6	14%	0.141	35%	0.354	C	S	.	.			trans	-85.5	120.7	165.7	-64.9	-174	0	0	0	110.3	L768 A769 V773 W778 N828 M831 A832 F837	L768-L771 HydrophobicContact CB-CD1 3.7Å; L768-L771 HydrophobicContact CB-CG 4.13Å; L768-L771 HydrophobicContact CD1-CD1 4.05Å; L768-L771 HydrophobicContact CG-CD1 4.45Å; A769-L771 PolarHBondContact O-N 2.8Å; L771-V773 HydrophobicContact CB-CB 4.46Å; L771-V773 HydrophobicContact CB-CG2 4.3Å; L771-V773 PolarHBondContact O-N 2.89Å; L771-W778 HydrophobicContact CD1-CH2 3.91Å; L771-W778 HydrophobicContact CD1-CZ2 3.64Å; L771-N828 WeakPolarHBondContact CD2-O 3.24Å; L771-M831 HydrophobicContact CD2-CB 4.24Å; L771-A832 HydrophobicContact CD2-CB 4.01Å; L771-F837 HydrophobicContact CD1-CE2 4.39Å; L771-F837 HydrophobicContact CD1-CZ 4.16Å; L771-F837 HydrophobicContact CD2-CE2 4.28Å
772	A	61.4	Low	78.5	Confident	113 Å²	113	52.1 Å²	52.1	93%	0.934	34%	0.338	S	S	*	.			trans	-78.6	46.3	175.9	0	0	0	0	0	112.4
773	V	61.7	Low	78.1	Confident	36 Å²	36	52.3 Å²	52.3	22%	0.218	34%	0.339	C	S	.	.			trans	-127.9	117.9	-168.2	-176.4	0	0	0	0	109	L771 S777 F837	L771-V773 HydrophobicContact CB-CB 4.46Å; L771-V773 HydrophobicContact CB-CG2 4.3Å; L771-V773 PolarHBondContact O-N 2.89Å; V773-S777 WeakPolarHBondContact CG1-O 3.27Å; V773-F837 HydrophobicContact CB-CE1 4.42Å; V773-F837 HydrophobicContact CG1-CD1 4.05Å; V773-F837 HydrophobicContact CG1-CE1 3.87Å; V773-F837 HydrophobicContact CG2-CD1 3.88Å; V773-F837 HydrophobicContact CG2-CD2 4.17Å; V773-F837 HydrophobicContact CG2-CE1 3.93Å; V773-F837 HydrophobicContact CG2-CE2 4.18Å; V773-F837 HydrophobicContact CG2-CG 4.02Å; V773-F837 HydrophobicContact CG2-CZ 4.07Å
774	S	54.8	Low	77.6	Confident	80 Å²	80	55.7 Å²	55.7	56%	0.559	35%	0.353	S	S	*	.			trans	-68.9	155.6	175.5	35	0	0	0	0	112.5	G776 S777	S774-G776 PolarHBondContact O-N 2.8Å; S774-S777 WeakPolarHBondContact O-CB 3.38Å; S774-S777 PolarHBondContact O-N 2.64Å; S774-S777 PolarHBondContact OG-OG 2.88Å
775	V	48.5	Very low	77.5	Confident	126 Å²	126	57.6 Å²	57.6	76%	0.764	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	120.9	169.6	-179.3	0	0	0	0	108.5	D660	D660-V775 HydrophobicContact CB-CG1 4.26Å
776	G	49.7	Very low	77.3	Confident	68 Å²	68	54.1 Å²	54.1	70%	0.701	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	100	-10	-172.8	0	0	0	0	0	115.6	S774	S774-G776 PolarHBondContact O-N 2.8Å
777	S	65.1	Low	77.2	Confident	65 Å²	65	58.1 Å²	58.1	46%	0.455	36%	0.358	S	S	.	.			trans	-95.1	14.2	175.8	-54.4	0	0	0	0	113.6	V773 S774	V773-S777 WeakPolarHBondContact CG1-O 3.27Å; S774-S777 WeakPolarHBondContact O-CB 3.38Å; S774-S777 PolarHBondContact O-N 2.64Å; S774-S777 PolarHBondContact OG-OG 2.88Å
778	W	77.4	Confident	77.1	Confident	35 Å²	35	62 Å²	62	13%	0.133	37%	0.372	C	S	.	.			trans	-83.5	119	174.8	-78.8	71.8	0	0	0	110.4	D660 L768 L771 A782 V783 L786 M831 F837	D660-W778 VanDerWaalsContact O-CD1 3.29Å; L768-W778 HydrophobicContact CD1-CH2 4.12Å; L771-W778 HydrophobicContact CD1-CH2 3.91Å; L771-W778 HydrophobicContact CD1-CZ2 3.64Å; W778-A782 HydrophobicContact CE3-CB 4.11Å; W778-V783 HydrophobicContact CB-CG2 4.03Å; W778-V783 HydrophobicContact CE3-CG2 3.89Å; W778-L786 HydrophobicContact CH2-CD2 3.86Å; W778-L786 HydrophobicContact CZ3-CD2 3.71Å; W778-M831 HydrophobicContact CE3-CE 4.45Å; W778-M831 HydrophobicContact CH2-CE 4.15Å; W778-M831 HydrophobicContact CH2-SD 4.4Å; W778-M831 HydrophobicContact CZ3-CE 3.68Å; W778-M831 HydrophobicContact CZ3-SD 4.4Å; W778-F837 HydrophobicContact CD2-CE1 4.14Å; W778-F837 HydrophobicContact CD2-CZ 4.4Å; W778-F837 HydrophobicContact CE3-CE1 4.32Å; W778-F837 HydrophobicContact CE3-CZ 4.37Å; W778-F837 HydrophobicContact CG-CE1 4.39Å; W778-F837 HydrophobicContact CZ3-CZ 4.47Å
779	S	79.5	Confident	77.1	Confident	38 Å²	38	65.5 Å²	65.5	27%	0.266	39%	0.387	S	S	.	.			trans	-70.3	153.3	172.2	65.9	0	0	0	0	110.7	D781 A782 V783 L836	S779-D781 PolarHBondContact O-N 3.01Å; S779-A782 PolarHBondContact O-N 3.33Å; S779-A782 VanDerWaalsContact O-N 3.15Å; S779-A782 VanDerWaalsContact OG-CB 3.24Å; S779-A782 WeakPolarHBondContact OG-CB 3.37Å; S779-A782 PolarHBondContact OG-N 3.46Å; S779-V783 WeakPolarHBondContact O-CG2 3.46Å; S779-V783 PolarHBondContact O-N 2.91Å; S779-V783 VanDerWaalsContact O-N 3.08Å; S779-L836 PolarHBondContact OG-O 3.13Å
780	S	81.3	Confident	77.1	Confident	98 Å²	98	65.1 Å²	65.1	69%	0.685	38%	0.384	S	S	*	.	H	α-helix	trans	-56.6	-35.4	173	-172.2	0	0	0	0	111.4	V783 Q784	S780-V783 PolarHBondContact O-N 3.35Å; S780-Q784 WeakPolarHBondContact O-CB 3.48Å; S780-Q784 PolarHBondContact O-N 3.39Å
781	D	83.7	Confident	77.3	Confident	111 Å²	111	62.5 Å²	62.5	59%	0.594	37%	0.369	S	S	*	.	H	α-helix	trans	-67.3	-41.7	177.7	-62.2	-18.2	0	0	0	112.1	S779 Q784 W785 L836	S779-D781 PolarHBondContact O-N 3.01Å; D781-Q784 PolarHBondContact O-N 3.39Å; D781-W785 WeakPolarHBondContact O-CB 3.43Å; D781-W785 PolarHBondContact O-N 3.39Å; D781-L836 HydrophobicContact CB-CD2 4.28Å
782	A	85.1	Confident	77.3	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-63.1	-42.7	175.1	0	0	0	0	0	111.9	W778 S779 L786 M831 L836 F837	W778-A782 HydrophobicContact CE3-CB 4.11Å; S779-A782 PolarHBondContact O-N 3.33Å; S779-A782 VanDerWaalsContact O-N 3.15Å; S779-A782 VanDerWaalsContact OG-CB 3.24Å; S779-A782 WeakPolarHBondContact OG-CB 3.37Å; S779-A782 PolarHBondContact OG-N 3.46Å; A782-L786 WeakPolarHBondContact O-CB 3.41Å; A782-L786 PolarHBondContact O-N 3.44Å; A782-L786 VanDerWaalsContact O-N 3.08Å; A782-M831 HydrophobicContact CB-CE 3.83Å; A782-M831 WeakPolarHBondContact O-CE 3.44Å; A782-L836 HydrophobicContact CB-CB 4.09Å; A782-F837 HydrophobicContact CB-CD1 4.25Å; A782-F837 HydrophobicContact CB-CE1 3.71Å; A782-F837 HydrophobicContact CB-CZ 3.99Å
783	V	86.5	Confident	78.3	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.036	37%	0.366	C	S	.	.	H	α-helix	trans	-66.4	-44.2	176.5	176.4	0	0	0	0	111	V657 S659 W778 S779 S780 L786 R787	V657-V783 HydrophobicContact CG1-CG1 4.4Å; S659-V783 WeakPolarHBondContact O-CG2 3.39Å; W778-V783 HydrophobicContact CB-CG2 4.03Å; W778-V783 HydrophobicContact CE3-CG2 3.89Å; S779-V783 WeakPolarHBondContact O-CG2 3.46Å; S779-V783 PolarHBondContact O-N 2.91Å; S779-V783 VanDerWaalsContact O-N 3.08Å; S780-V783 PolarHBondContact O-N 3.35Å; V783-L786 PolarHBondContact O-N 2.82Å; V783-R787 WeakPolarHBondContact O-CB 3.36Å; V783-R787 VanDerWaalsContact O-CG 3.28Å; V783-R787 WeakPolarHBondContact O-CG 3.3Å; V783-R787 PolarHBondContact O-N 3.42Å
784	Q	86.7	Confident	78.7	Confident	85 Å²	85	67 Å²	67	40%	0.397	38%	0.383	S	S	.	.	H	α-helix	trans	-65.8	-45.9	179.9	-178.7	59.1	22.4	0	0	111.6	S780 D781 L786 R787 E788	S780-Q784 WeakPolarHBondContact O-CB 3.48Å; S780-Q784 PolarHBondContact O-N 3.39Å; D781-Q784 PolarHBondContact O-N 3.39Å; Q784-L786 VanDerWaalsContact C-N 3.31Å; Q784-L786 PolarHBondContact O-N 2.91Å; Q784-R787 WeakPolarHBondContact O-CB 3.45Å; Q784-R787 PolarHBondContact O-N 3.09Å; Q784-E788 PolarHBondContact NE2-OE1 2.9Å; Q784-E788 WeakPolarHBondContact O-CG 3.41Å; Q784-E788 PolarHBondContact O-N 3.42Å
785	W	90.5	Very high	79.9	Confident	55 Å²	55	66.5 Å²	66.5	21%	0.208	37%	0.374	C	S	.	.	H	α-helix	trans	-56.3	-46.1	174.1	-177.9	97.5	0	0	0	111.4	D781 E788 K789 L827 Q830 M831 L836	D781-W785 WeakPolarHBondContact O-CB 3.43Å; D781-W785 PolarHBondContact O-N 3.39Å; W785-E788 PolarHBondContact O-N 3.41Å; W785-K789 HydrophobicContact CD2-CG 4.07Å; W785-K789 HydrophobicContact CE3-CG 4.07Å; W785-K789 HydrophobicContact CH2-CG 4.04Å; W785-K789 HydrophobicContact CZ2-CD 4.37Å; W785-K789 HydrophobicContact CZ2-CG 4.05Å; W785-K789 HydrophobicContact CZ3-CG 4.03Å; W785-K789 VanDerWaalsContact O-CG 3.29Å; W785-K789 WeakPolarHBondContact O-CG 3.39Å; W785-K789 PolarHBondContact O-N 3.21Å; W785-K789 VanDerWaalsContact O-N 3.1Å; W785-L827 HydrophobicContact CH2-CD2 3.69Å; W785-L827 HydrophobicContact CZ3-CB 4.4Å; W785-L827 HydrophobicContact CZ3-CD2 4.01Å; W785-Q830 HydrophobicContact CH2-CB 4.08Å; W785-Q830 HydrophobicContact CZ2-CB 4.44Å; W785-M831 HydrophobicContact CE3-CE 4.17Å; W785-M831 HydrophobicContact CE3-CG 3.64Å; W785-M831 HydrophobicContact CE3-SD 3.84Å; W785-M831 HydrophobicContact CH2-CG 3.87Å; W785-M831 HydrophobicContact CZ3-CG 3.24Å; W785-M831 HydrophobicContact CZ3-SD 3.68Å; W785-L836 HydrophobicContact CB-CD1 3.89Å; W785-L836 HydrophobicContact CB-CD2 4.27Å; W785-L836 HydrophobicContact CD2-CD1 3.78Å; W785-L836 HydrophobicContact CE3-CD1 4.23Å; W785-L836 HydrophobicContact CG-CD1 3.61Å; W785-L836 HydrophobicContact CG-CD2 4.46Å
786	L	90	Very high	81.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-46.8	178.4	179.7	61.3	0	0	0	111	V657 I663 L768 W778 A782 V783 Q784 E788 K789 V790 L827 M831	V657-L786 HydrophobicContact CG1-CD2 3.79Å; V657-L786 HydrophobicContact CG1-CG 4.17Å; I663-L786 HydrophobicContact CD1-CD1 4.41Å; I663-L786 HydrophobicContact CD1-CD2 3.83Å; I663-L786 HydrophobicContact CG1-CD2 4.06Å; L768-L786 HydrophobicContact CD1-CD1 4.27Å; L768-L786 HydrophobicContact CD1-CD2 4.35Å; W778-L786 HydrophobicContact CH2-CD2 3.86Å; W778-L786 HydrophobicContact CZ3-CD2 3.71Å; A782-L786 WeakPolarHBondContact O-CB 3.41Å; A782-L786 PolarHBondContact O-N 3.44Å; A782-L786 VanDerWaalsContact O-N 3.08Å; V783-L786 PolarHBondContact O-N 2.82Å; Q784-L786 VanDerWaalsContact C-N 3.31Å; Q784-L786 PolarHBondContact O-N 2.91Å; L786-E788 VanDerWaalsContact C-N 3.35Å; L786-E788 PolarHBondContact O-N 2.83Å; L786-K789 PolarHBondContact O-N 3.1Å; L786-K789 VanDerWaalsContact O-N 3.16Å; L786-V790 HydrophobicContact CD1-CG1 3.86Å; L786-V790 WeakPolarHBondContact O-CG1 3.48Å; L786-V790 VanDerWaalsContact O-CG2 3.23Å; L786-V790 WeakPolarHBondContact O-CG2 3.26Å; L786-V790 PolarHBondContact O-N 2.78Å; L786-V790 VanDerWaalsContact O-N 3.12Å; L786-L827 HydrophobicContact CD1-CD1 4.16Å; L786-M831 HydrophobicContact CB-CE 4.41Å; L786-M831 HydrophobicContact CB-SD 4.36Å; L786-M831 HydrophobicContact CD1-SD 4.3Å
787	R	90.3	Very high	83.9	Confident	85 Å²	85	57.2 Å²	57.2	32%	0.321	30%	0.304	S	S	.	.	H	α-helix	trans	-54.6	-48	175.8	-78.1	172.8	177.1	162.9	1.2	112.2	V657 V783 Q784 K789 V790 L791	V657-R787 HydrophobicContact CB-CG 3.77Å; V657-R787 HydrophobicContact CG1-CG 4.05Å; V657-R787 HydrophobicContact CG2-CG 4.33Å; V657-R787 PolarHBondContact O-NE 3.33Å; V657-R787 PolarHBondContact O-NH2 3.48Å; V783-R787 WeakPolarHBondContact O-CB 3.36Å; V783-R787 VanDerWaalsContact O-CG 3.28Å; V783-R787 WeakPolarHBondContact O-CG 3.3Å; V783-R787 PolarHBondContact O-N 3.42Å; Q784-R787 WeakPolarHBondContact O-CB 3.45Å; Q784-R787 PolarHBondContact O-N 3.09Å; R787-K789 VanDerWaalsContact C-N 3.31Å; R787-K789 PolarHBondContact O-N 2.76Å; R787-V790 PolarHBondContact O-N 3.07Å; R787-L791 HydrophobicContact CB-CD1 3.91Å; R787-L791 HydrophobicContact CB-CG 4.45Å; R787-L791 HydrophobicContact CG-CD1 3.83Å; R787-L791 WeakPolarHBondContact O-CB 3.32Å; R787-L791 PolarHBondContact O-N 3.22Å
788	E	88.8	Confident	85.2	Confident	122 Å²	122	54.1 Å²	54.1	57%	0.57	28%	0.282	S	S	*	.	H	α-helix	trans	-61.9	-36.4	178.6	-73.8	174.1	-168.6	0	0	112.7	Q784 W785 L786	Q784-E788 PolarHBondContact NE2-OE1 2.9Å; Q784-E788 WeakPolarHBondContact O-CG 3.41Å; Q784-E788 PolarHBondContact O-N 3.42Å; W785-E788 PolarHBondContact O-N 3.41Å; L786-E788 VanDerWaalsContact C-N 3.35Å; L786-E788 PolarHBondContact O-N 2.83Å
789	K	88.4	Confident	86	Confident	87 Å²	87	56.1 Å²	56.1	38%	0.378	29%	0.292	S	S	.	.	H	α-helix	trans	-74.4	-28.4	178.7	-68.7	-68.8	179.7	179.8	0	114.4	W785 L786 R787 T793 T816 L827	W785-K789 HydrophobicContact CD2-CG 4.07Å; W785-K789 HydrophobicContact CE3-CG 4.07Å; W785-K789 HydrophobicContact CH2-CG 4.04Å; W785-K789 HydrophobicContact CZ2-CD 4.37Å; W785-K789 HydrophobicContact CZ2-CG 4.05Å; W785-K789 HydrophobicContact CZ3-CG 4.03Å; W785-K789 VanDerWaalsContact O-CG 3.29Å; W785-K789 WeakPolarHBondContact O-CG 3.39Å; W785-K789 PolarHBondContact O-N 3.21Å; W785-K789 VanDerWaalsContact O-N 3.1Å; L786-K789 PolarHBondContact O-N 3.1Å; L786-K789 VanDerWaalsContact O-N 3.16Å; R787-K789 VanDerWaalsContact C-N 3.31Å; R787-K789 PolarHBondContact O-N 2.76Å; K789-T793 PolarHBondContact O-OG1 2.87Å; K789-T816 HydrophobicContact CB-CG2 4.42Å; K789-T816 WeakPolarHBondContact O-CG2 3.25Å; K789-L827 HydrophobicContact CB-CD1 4.41Å; K789-L827 HydrophobicContact CB-CD2 4.23Å; K789-L827 HydrophobicContact CG-CD2 4.37Å
790	V	89.6	Confident	86.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-116.7	-36.9	-166.7	-52.7	0	0	0	0	115.1	V654 V657 L786 R787 N792 T793 L814 L827	V654-V790 HydrophobicContact CB-CB 3.91Å; V654-V790 HydrophobicContact CB-CG2 3.88Å; V654-V790 HydrophobicContact CG1-CB 4.09Å; V654-V790 HydrophobicContact CG1-CG2 3.51Å; V654-V790 HydrophobicContact CG2-CB 3.95Å; V654-V790 HydrophobicContact CG2-CG2 4.3Å; V657-V790 HydrophobicContact CG2-CG2 3.68Å; L786-V790 HydrophobicContact CD1-CG1 3.86Å; L786-V790 WeakPolarHBondContact O-CG1 3.48Å; L786-V790 VanDerWaalsContact O-CG2 3.23Å; L786-V790 WeakPolarHBondContact O-CG2 3.26Å; L786-V790 PolarHBondContact O-N 2.78Å; L786-V790 VanDerWaalsContact O-N 3.12Å; R787-V790 PolarHBondContact O-N 3.07Å; V790-N792 VanDerWaalsContact C-N 3.27Å; V790-N792 PolarHBondContact O-N 3.11Å; V790-T793 PolarHBondContact O-N 3.43Å; V790-T793 VanDerWaalsContact O-N 3.13Å; V790-L814 HydrophobicContact CG1-CD2 3.82Å; V790-L827 HydrophobicContact CG1-CD1 3.46Å; V790-L827 VanDerWaalsContact CG1-CD1 3.46Å
791	L	85.3	Confident	87.1	Confident	76 Å²	76	51.1 Å²	51.1	40%	0.398	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.7	-169.5	-68.4	179.6	0	0	0	114.1	V654 V657 R787	V654-L791 HydrophobicContact CG1-CD2 4.29Å; V657-L791 HydrophobicContact CG2-CD2 4.22Å; V657-L791 HydrophobicContact CG2-CG 4.46Å; R787-L791 HydrophobicContact CB-CD1 3.91Å; R787-L791 HydrophobicContact CB-CG 4.45Å; R787-L791 HydrophobicContact CG-CD1 3.83Å; R787-L791 WeakPolarHBondContact O-CB 3.32Å; R787-L791 PolarHBondContact O-N 3.22Å
792	N	78.6	Confident	87.4	Confident	144 Å²	144	51.9 Å²	51.9	77%	0.77	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	10.8	175.2	-65.8	-44.2	0	0	0	112.7	V790 P794	V790-N792 VanDerWaalsContact C-N 3.27Å; V790-N792 PolarHBondContact O-N 3.11Å; N792-P794 WeakPolarHBondContact O-CD 3.17Å
793	T	82.8	Confident	87.5	Confident	37 Å²	37	54.8 Å²	54.8	23%	0.227	27%	0.271	C	S	.	.			trans	-113.5	97.8	-172.7	-56.5	0	0	0	0	109.9	K789 V790 D795 C796	K789-T793 PolarHBondContact O-OG1 2.87Å; V790-T793 PolarHBondContact O-N 3.43Å; V790-T793 VanDerWaalsContact O-N 3.13Å; T793-D795 VanDerWaalsContact C-N 3.34Å; T793-D795 PolarHBondContact O-N 3.13Å; T793-C796 PolarHBondContact O-SG 2.86Å; T793-C796 VanDerWaalsContact O-SG 3.38Å
794	P	70.6	Confident	87.1	Confident	90 Å²	90	56.2 Å²	56.2	58%	0.584	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-24.7	-170.4	28.4	-35.6	0	0	0	114.1	N792	N792-P794 WeakPolarHBondContact O-CD 3.17Å
795	D	78.6	Confident	86.5	Confident	68 Å²	68	60.2 Å²	60.2	36%	0.364	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	48.7	-172.8	-77.9	7.5	0	0	0	111.6	T793 K818	T793-D795 VanDerWaalsContact C-N 3.34Å; T793-D795 PolarHBondContact O-N 3.13Å; D795-K818 VanDerWaalsContact OD2-CE 3.24Å; D795-K818 WeakPolarHBondContact OD2-CE 3.43Å; D795-K818 IonicContact OD2-NZ 3.84Å; D795-K818 PolarHBondContact OD2-NZ 3.19Å
796	C	91.4	Very high	85.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	156.7	172	-62.2	0	0	0	0	110.6	N651 V652 T793 L814 F815	N651-C796 PolarHBondContact N-O 2.89Å; V652-C796 HydrophobicContact CB-CB 4.25Å; V652-C796 WeakPolarHBondContact CB-O 3.32Å; V652-C796 PolarHBondContact N-O 2.91Å; V652-C796 VanDerWaalsContact O-CB 3.26Å; V652-C796 WeakPolarHBondContact O-CB 3.36Å; V652-C796 PolarHBondContact O-N 3.45Å; V652-C796 VanDerWaalsContact O-N 3.11Å; T793-C796 PolarHBondContact O-SG 2.86Å; T793-C796 VanDerWaalsContact O-SG 3.38Å; C796-L814 HydrophobicContact CB-CD1 4.22Å; C796-F815 CarbonylContact C-O 3.53Å; C796-F815 VanDerWaalsContact CA-O 3.32Å; C796-F815 WeakPolarHBondContact CA-O 3.47Å; C796-F815 WeakPolarHBondContact CB-O 3.13Å
797	S	92.1	Very high	84.3	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	145.2	165.6	-58.5	0	0	0	0	109.6	Y649 F815 D817	Y649-S797 CarbonylContact O-C 3.57Å; Y649-S797 VanDerWaalsContact O-CA 3.23Å; Y649-S797 WeakPolarHBondContact O-CA 3.36Å; Y649-S797 WeakPolarHBondContact O-CB 3.48Å; S797-F815 PolarHBondContact N-O 3.21Å; S797-F815 PolarHBondContact O-N 3.07Å; S797-D817 PolarHBondContact OG-O 3.45Å
798	M	92.8	Very high	83.7	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.3	171.5	78.5	167	68.9	0	0	110.9	L643 A648 Y649 V652 C665 L667 V800 V812 H813 L814	L643-M798 HydrophobicContact CD2-SD 4.42Å; A648-M798 CarbonylContact C-O 3.38Å; A648-M798 VanDerWaalsContact CA-O 3.31Å; A648-M798 WeakPolarHBondContact CA-O 3.23Å; Y649-M798 HydrophobicContact CD2-CG 4.19Å; Y649-M798 PolarHBondContact N-O 2.95Å; Y649-M798 PolarHBondContact O-N 2.7Å; V652-M798 HydrophobicContact CB-CE 4.41Å; V652-M798 HydrophobicContact CG1-CE 3.46Å; V652-M798 VanDerWaalsContact CG1-CE 3.46Å; V652-M798 HydrophobicContact CG2-CB 4.3Å; V652-M798 HydrophobicContact CG2-CE 4.03Å; V652-M798 HydrophobicContact CG2-CG 3.98Å; C665-M798 HydrophobicContact CB-CE 3.43Å; C665-M798 VanDerWaalsContact CB-CE 3.43Å; L667-M798 HydrophobicContact CD1-CE 3.85Å; L667-M798 HydrophobicContact CD2-CE 4.1Å; L667-M798 HydrophobicContact CD2-SD 4.17Å; L667-M798 HydrophobicContact CG-CE 4.11Å; M798-V800 HydrophobicContact SD-CG2 4.5Å; M798-V812 HydrophobicContact CB-CB 4.43Å; M798-V812 HydrophobicContact SD-CG1 3.84Å; M798-H813 CarbonylContact C-O 3.44Å; M798-H813 VanDerWaalsContact CA-O 3.3Å; M798-H813 WeakPolarHBondContact CA-O 3.23Å; M798-L814 HydrophobicContact CB-CD1 4.33Å
799	K	92.7	Very high	83.7	Confident	76 Å²	76	68.2 Å²	68.2	33%	0.33	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.6	164	-174.3	-178.3	178.8	-176.6	0	108.9	N646 S647 A648 A801 V812 H813 F815	N646-K799 WeakPolarHBondContact O-CE 3.36Å; S647-K799 WeakPolarHBondContact O-CA 3.47Å; A648-K799 HydrophobicContact CB-CB 4.41Å; A648-K799 HydrophobicContact CB-CG 4.44Å; K799-A801 PolarHBondContact O-N 2.92Å; K799-V812 CarbonylContact O-C 3.53Å; K799-V812 VanDerWaalsContact O-CA 3.25Å; K799-V812 WeakPolarHBondContact O-CA 3.49Å; K799-H813 HydrophobicContact CB-CB 4.37Å; K799-H813 PolarHBondContact N-O 3.03Å; K799-H813 PolarHBondContact O-N 3.14Å; K799-F815 HydrophobicContact CB-CE2 4.27Å
800	V	93.4	Very high	83.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	117.7	179.7	178.7	0	0	0	0	109.4	L643 Q644 V645 N646 S647 Y649 M798 M803 V810	L643-V800 HydrophobicContact CD2-CG2 4.31Å; Q644-V800 WeakPolarHBondContact O-CB 3.28Å; V645-V800 HydrophobicContact CG2-CG1 4.46Å; N646-V800 VanDerWaalsContact CA-O 3.3Å; N646-V800 WeakPolarHBondContact CA-O 3.43Å; N646-V800 PolarHBondContact N-O 3.26Å; S647-V800 PolarHBondContact O-N 2.88Å; Y649-V800 HydrophobicContact CD2-CG2 4.26Å; Y649-V800 HydrophobicContact CE2-CG2 3.89Å; M798-V800 HydrophobicContact SD-CG2 4.5Å; V800-M803 HydrophobicContact CG1-CE 4.1Å; V800-M803 HydrophobicContact CG1-CG 4.27Å; V800-V810 HydrophobicContact CB-CG1 4.39Å; V800-V810 HydrophobicContact CG1-CG1 3.61Å; V800-V810 HydrophobicContact CG2-CG1 4.08Å
801	A	91.3	Very high	83.9	Confident	31 Å²	31	66.1 Å²	66.1	26%	0.256	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-42.8	177.9	0	0	0	0	0	112	A769 K799 C811	A769-A801 HydrophobicContact CB-CB 3.72Å; K799-A801 PolarHBondContact O-N 2.92Å; A801-C811 WeakPolarHBondContact CB-O 3.44Å; A801-C811 PolarHBondContact N-O 2.92Å
802	K	90	Very high	84.3	Confident	128 Å²	128	62.5 Å²	62.5	56%	0.557	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.5	151.6	180	-178.7	179.1	176.2	-171.5	0	110.3	C811	K802-C811 HydrophobicContact CB-CB 4Å; K802-C811 PolarHBondContact N-O 3.19Å; K802-C811 PolarHBondContact O-N 3.1Å
803	M	86.4	Confident	84.9	Confident	61 Å²	61	57 Å²	57	30%	0.3	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	135.6	165.8	-66.3	176.1	175.8	0	0	109.8	L643 V645 V800 V810	L643-M803 VanDerWaalsContact C-CE 3.42Å; L643-M803 HydrophobicContact CB-CE 3.39Å; L643-M803 WeakPolarHBondContact O-CE 3.4Å; V645-M803 HydrophobicContact CG2-CE 4.49Å; V645-M803 HydrophobicContact CG2-CG 3.99Å; V645-M803 HydrophobicContact CG2-SD 4.14Å; V800-M803 HydrophobicContact CG1-CE 4.1Å; V800-M803 HydrophobicContact CG1-CG 4.27Å; M803-V810 HydrophobicContact CG-CG1 4.39Å
804	D	79	Confident	85.4	Confident	36 Å²	36	55.3 Å²	55.3	19%	0.193	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	95.9	167.2	-172.6	-22.5	0	0	0	108.1	T806 K807 H808 C809	D804-T806 PolarHBondContact O-N 2.68Å; D804-T806 WeakPolarHBondContact OD1-CB 3.29Å; D804-T806 PolarHBondContact OD1-N 3.16Å; D804-T806 PolarHBondContact OD1-OG1 2.89Å; D804-K807 HydrophobicContact CB-CB 4.38Å; D804-K807 PolarHBondContact O-N 2.69Å; D804-K807 PolarHBondContact OD1-N 3.47Å; D804-K807 VanDerWaalsContact OD2-CD 3.29Å; D804-K807 WeakPolarHBondContact OD2-CD 3.49Å; D804-K807 WeakPolarHBondContact OD2-CG 3.43Å; D804-H808 WeakPolarHBondContact O-CA 3.46Å; D804-H808 PolarHBondContact O-N 3.11Å; D804-C809 PolarHBondContact N-O 3.41Å; D804-C809 PolarHBondContact O-N 3.25Å; D804-C809 VanDerWaalsContact O-N 3.07Å
805	E	73.1	Confident	86.5	Confident	168 Å²	168	51.1 Å²	51.1	79%	0.785	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-29.3	178.3	-62.5	-173.3	167.2	0	0	112	H808	E805-H808 PolarHBondContact O-CE1 3.3Å; E805-H808 PolarHBondContact O-ND1 3.46Å
806	T	66.5	Low	86.8	Confident	116 Å²	116	50.5 Å²	50.5	71%	0.712	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-47.1	179.8	70.1	0	0	0	0	110.8	D804 H808	D804-T806 PolarHBondContact O-N 2.68Å; D804-T806 WeakPolarHBondContact OD1-CB 3.29Å; D804-T806 PolarHBondContact OD1-N 3.16Å; D804-T806 PolarHBondContact OD1-OG1 2.89Å; T806-H808 VanDerWaalsContact C-N 3.3Å; T806-H808 PolarHBondContact O-N 3.16Å; T806-H808 PolarHBondContact O-ND1 2.86Å
807	K	68.1	Low	86	Confident	145 Å²	145	53.2 Å²	53.2	63%	0.63	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	0.5	-179.7	-60.4	-175.9	-170.3	174.9	0	114	D804 C809	D804-K807 HydrophobicContact CB-CB 4.38Å; D804-K807 PolarHBondContact O-N 2.69Å; D804-K807 PolarHBondContact OD1-N 3.47Å; D804-K807 VanDerWaalsContact OD2-CD 3.29Å; D804-K807 WeakPolarHBondContact OD2-CD 3.49Å; D804-K807 WeakPolarHBondContact OD2-CG 3.43Å; K807-C809 HydrophobicContact CB-CB 4.13Å; K807-C809 PolarHBondContact O-N 3.15Å
808	H	79.1	Confident	84.9	Confident	155 Å²	155	58.5 Å²	58.5	72%	0.718	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	43.8	-173.9	-64.6	60.9	0	0	0	111.4	D804 E805 T806	D804-H808 WeakPolarHBondContact O-CA 3.46Å; D804-H808 PolarHBondContact O-N 3.11Å; E805-H808 PolarHBondContact O-CE1 3.3Å; E805-H808 PolarHBondContact O-ND1 3.46Å; T806-H808 VanDerWaalsContact C-N 3.3Å; T806-H808 PolarHBondContact O-N 3.16Å; T806-H808 PolarHBondContact O-ND1 2.86Å
809	C	86.9	Confident	83.7	Confident	15 Å²	15	61.7 Å²	61.7	10%	0.101	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.2	-170.3	-166.9	0	0	0	0	111	K765 D804 K807	K765-C809 WeakPolarHBondContact O-CA 3.3Å; D804-C809 PolarHBondContact N-O 3.41Å; D804-C809 PolarHBondContact O-N 3.25Å; D804-C809 VanDerWaalsContact O-N 3.07Å; K807-C809 HydrophobicContact CB-CB 4.13Å; K807-C809 PolarHBondContact O-N 3.15Å
810	V	91.4	Very high	82.6	Confident	15 Å²	15	60 Å²	60	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119	-177	-171.1	0	0	0	0	109.8	L643 V764 K765 C766 C767 V800 M803 V812	L643-V810 HydrophobicContact CD1-CG2 3.94Å; V764-V810 HydrophobicContact CG1-CB 4.26Å; V764-V810 HydrophobicContact CG1-CG2 3.76Å; K765-V810 PolarHBondContact O-N 2.93Å; C766-V810 CarbonylContact C-O 3.6Å; C766-V810 WeakPolarHBondContact CA-O 3.39Å; C767-V810 PolarHBondContact N-O 2.92Å; V800-V810 HydrophobicContact CB-CG1 4.39Å; V800-V810 HydrophobicContact CG1-CG1 3.61Å; V800-V810 HydrophobicContact CG2-CG1 4.08Å; M803-V810 HydrophobicContact CG-CG1 4.39Å; V810-V812 HydrophobicContact CB-CG1 4.32Å; V810-V812 HydrophobicContact CG1-CG1 3.76Å; V810-V812 PolarHBondContact O-N 3.4Å
811	C	91.8	Very high	81.6	Confident	28 Å²	28	66.9 Å²	66.9	19%	0.189	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.3	172	-53.2	0	0	0	0	108.6	C767 A769 A801 K802	C767-C811 WeakPolarHBondContact O-CA 3.5Å; C767-C811 VanDerWaalsContact SG-SG 3.61Å; A769-C811 HydrophobicContact CB-CB 4.27Å; A801-C811 WeakPolarHBondContact CB-O 3.44Å; A801-C811 PolarHBondContact N-O 2.92Å; K802-C811 HydrophobicContact CB-CB 4Å; K802-C811 PolarHBondContact N-O 3.19Å; K802-C811 PolarHBondContact O-N 3.1Å
812	V	93.3	Very high	81.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	149.2	-175.5	-59.6	0	0	0	0	112.5	C766 C767 L768 A769 M798 K799 V810 N828	C766-V812 HydrophobicContact CB-CG2 4.02Å; C767-V812 PolarHBondContact O-N 2.86Å; L768-V812 HydrophobicContact CD2-CG2 4.48Å; A769-V812 PolarHBondContact N-O 3.3Å; M798-V812 HydrophobicContact CB-CB 4.43Å; M798-V812 HydrophobicContact SD-CG1 3.84Å; K799-V812 CarbonylContact O-C 3.53Å; K799-V812 VanDerWaalsContact O-CA 3.25Å; K799-V812 WeakPolarHBondContact O-CA 3.49Å; V810-V812 HydrophobicContact CB-CG1 4.32Å; V810-V812 HydrophobicContact CG1-CG1 3.76Å; V810-V812 PolarHBondContact O-N 3.4Å; V812-N828 PolarHBondContact O-ND2 2.9Å
813	H	92.6	Very high	80.5	Confident	29 Å²	29	66.2 Å²	66.2	13%	0.134	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	124.8	156	-59.6	96.4	0	0	0	108.4	D770 M798 K799 F815 N828	D770-H813 IonicContact OD2-CD2 2.7Å; D770-H813 IonicContact OD2-CE1 3.58Å; D770-H813 PolarHBondContact OD2-CE1 3.26Å; D770-H813 IonicContact OD2-NE2 2.86Å; D770-H813 PolarHBondContact OD2-NE2 2.98Å; M798-H813 CarbonylContact C-O 3.44Å; M798-H813 VanDerWaalsContact CA-O 3.3Å; M798-H813 WeakPolarHBondContact CA-O 3.23Å; K799-H813 HydrophobicContact CB-CB 4.37Å; K799-H813 PolarHBondContact N-O 3.03Å; K799-H813 PolarHBondContact O-N 3.14Å; H813-F815 HydrophobicContact CB-CE2 3.73Å; H813-F815 HydrophobicContact CB-CZ 3.98Å; H813-F815 WeakPolarHBondContact O-CE2 3.24Å; H813-N828 WeakPolarHBondContact CA-OD1 3.4Å
814	L	93	Very high	80.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	139	-175.7	-172.3	64.9	0	0	0	110.7	V654 I663 L768 V790 C796 M798 S826 L827 N828	V654-L814 HydrophobicContact CG2-CD1 4.24Å; V654-L814 HydrophobicContact CG2-CD2 4.03Å; I663-L814 HydrophobicContact CD1-CD2 4.04Å; L768-L814 HydrophobicContact CD2-CB 3.82Å; L768-L814 HydrophobicContact CD2-CD2 4.37Å; V790-L814 HydrophobicContact CG1-CD2 3.82Å; C796-L814 HydrophobicContact CB-CD1 4.22Å; M798-L814 HydrophobicContact CB-CD1 4.33Å; L814-S826 CarbonylContact O-C 3.55Å; L814-S826 WeakPolarHBondContact O-CA 3.45Å; L814-L827 HydrophobicContact CB-CD1 4.44Å; L814-L827 HydrophobicContact CD2-CD1 3.97Å; L814-L827 HydrophobicContact CG-CD1 4.06Å; L814-L827 PolarHBondContact O-N 3.11Å; L814-N828 PolarHBondContact N-OD1 2.99Å
815	F	92.3	Very high	80.5	Confident	3 Å²	3	69.5 Å²	69.5	1%	0.013	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.2	-175.3	-55.3	-96	0	0	0	110.1	C796 S797 K799 H813 F820 D822 R825	C796-F815 CarbonylContact C-O 3.53Å; C796-F815 VanDerWaalsContact CA-O 3.32Å; C796-F815 WeakPolarHBondContact CA-O 3.47Å; C796-F815 WeakPolarHBondContact CB-O 3.13Å; S797-F815 PolarHBondContact N-O 3.21Å; S797-F815 PolarHBondContact O-N 3.07Å; K799-F815 HydrophobicContact CB-CE2 4.27Å; H813-F815 HydrophobicContact CB-CE2 3.73Å; H813-F815 HydrophobicContact CB-CZ 3.98Å; H813-F815 WeakPolarHBondContact O-CE2 3.24Å; F815-F820 HydrophobicContact CD1-CB 4.38Å; F815-F820 HydrophobicContact CD2-CB 3.75Å; F815-F820 HydrophobicContact CE1-CB 4.49Å; F815-F820 HydrophobicContact CE2-CB 3.89Å; F815-F820 HydrophobicContact CG-CB 4.02Å; F815-F820 HydrophobicContact CZ-CB 4.27Å; F815-D822 WeakPolarHBondContact CE1-O 3.3Å; F815-R825 HydrophobicContact CD1-CB 4.47Å
816	T	86.6	Confident	81.3	Confident	54 Å²	54	61.6 Å²	61.6	33%	0.331	32%	0.317	S	S	.	.	S	Bend	trans	-85.9	-8	174.9	52.1	0	0	0	0	113.5	K789 L827	K789-T816 HydrophobicContact CB-CG2 4.42Å; K789-T816 WeakPolarHBondContact O-CG2 3.25Å; T816-L827 HydrophobicContact CG2-CD1 3.97Å; T816-L827 HydrophobicContact CG2-CD2 3.95Å; T816-L827 HydrophobicContact CG2-CG 4.26Å
817	D	74.4	Confident	82.5	Confident	58 Å²	58	56.1 Å²	56.1	31%	0.31	28%	0.283	S	S	.	.	S	Bend	trans	-119.6	172.8	175.7	75.2	22.7	0	0	0	111.2	S797 N819 R825	S797-D817 PolarHBondContact OG-O 3.45Å; D817-N819 PolarHBondContact O-N 2.72Å; D817-N819 WeakPolarHBondContact OD1-CA 3.35Å; D817-N819 WeakPolarHBondContact OD1-CB 3.44Å; D817-N819 PolarHBondContact OD1-N 3.3Å; D817-R825 IonicContact OD2-NH1 2.66Å
818	K	68	Low	83.5	Confident	111 Å²	111	49.4 Å²	49.4	48%	0.483	25%	0.254	S	S	.	.	S	Bend	trans	-82.1	4.1	179.5	-64.8	-178.6	-177.9	179	0	112.9	M650 D795 F820	M650-K818 HydrophobicContact CE-CB 3.72Å; M650-K818 HydrophobicContact CE-CD 3.9Å; M650-K818 HydrophobicContact CE-CG 3.73Å; D795-K818 VanDerWaalsContact OD2-CE 3.24Å; D795-K818 WeakPolarHBondContact OD2-CE 3.43Å; D795-K818 IonicContact OD2-NZ 3.84Å; D795-K818 PolarHBondContact OD2-NZ 3.19Å; K818-F820 WeakPolarHBondContact O-CD1 3.36Å; K818-F820 PolarHBondContact O-N 2.88Å
819	N	67.3	Low	83.9	Confident	67 Å²	67	45.4 Å²	45.4	36%	0.358	24%	0.235	S	C	.	.			trans	-102.5	54.5	-173.6	-164	15.8	0	0	0	111.9	D817 H821	D817-N819 PolarHBondContact O-N 2.72Å; D817-N819 WeakPolarHBondContact OD1-CA 3.35Å; D817-N819 WeakPolarHBondContact OD1-CB 3.44Å; D817-N819 PolarHBondContact OD1-N 3.3Å; N819-H821 PolarHBondContact O-N 3.32Å
820	F	69.6	Low	84	Confident	39 Å²	39	48 Å²	48	17%	0.171	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	6.1	-178.8	58.7	-95.5	0	0	0	114.8	A648 M650 F815 K818	A648-F820 HydrophobicContact CB-CD2 3.59Å; A648-F820 HydrophobicContact CB-CE2 3.58Å; A648-F820 HydrophobicContact CB-CG 4.32Å; A648-F820 HydrophobicContact CB-CZ 4.3Å; M650-F820 HydrophobicContact CE-CE1 4.3Å; M650-F820 HydrophobicContact CG-CD1 4.48Å; M650-F820 HydrophobicContact CG-CE1 3.93Å; M650-F820 HydrophobicContact SD-CE1 3.92Å; F815-F820 HydrophobicContact CD1-CB 4.38Å; F815-F820 HydrophobicContact CD2-CB 3.75Å; F815-F820 HydrophobicContact CE1-CB 4.49Å; F815-F820 HydrophobicContact CE2-CB 3.89Å; F815-F820 HydrophobicContact CG-CB 4.02Å; F815-F820 HydrophobicContact CZ-CB 4.27Å; K818-F820 WeakPolarHBondContact O-CD1 3.36Å; K818-F820 PolarHBondContact O-N 2.88Å
821	H	72.6	Confident	83.8	Confident	145 Å²	145	47.2 Å²	47.2	67%	0.671	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-19.9	179.4	-66	-65.1	0	0	0	113.6	N819 P823	N819-H821 PolarHBondContact O-N 3.32Å; H821-P823 WeakPolarHBondContact O-CD 3.32Å
822	D	80.3	Confident	83.5	Confident	62 Å²	62	48.7 Å²	48.7	33%	0.332	26%	0.256	S	S	.	.			trans	-105.6	103.2	179.7	177.5	2.3	0	0	0	110.3	F815 A824 R825	F815-D822 WeakPolarHBondContact CE1-O 3.3Å; D822-A824 PolarHBondContact O-N 2.84Å; D822-A824 VanDerWaalsContact O-N 3.15Å; D822-A824 WeakPolarHBondContact OD1-CB 3.35Å; D822-A824 PolarHBondContact OD1-N 3.41Å; D822-R825 HydrophobicContact CB-CG 4.16Å; D822-R825 WeakPolarHBondContact O-CB 3.25Å; D822-R825 PolarHBondContact O-N 2.92Å; D822-R825 WeakPolarHBondContact OD2-CG 3.18Å; D822-R825 IonicContact OD2-NE 3.46Å; D822-R825 PolarHBondContact OD2-NE 3.41Å
823	P	78.3	Confident	82.9	Confident	83 Å²	83	55.4 Å²	55.4	54%	0.539	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-59.4	-26	-178.8	-24.3	35	0	0	0	113.9	H821 R825 S826	H821-P823 WeakPolarHBondContact O-CD 3.32Å; P823-R825 PolarHBondContact O-N 2.8Å; P823-S826 WeakPolarHBondContact O-CB 3.39Å; P823-S826 PolarHBondContact O-N 3.21Å; P823-S826 VanDerWaalsContact O-N 3.09Å; P823-S826 PolarHBondContact O-OG 3.41Å
824	A	80.1	Confident	82.4	Confident	49 Å²	49	55.6 Å²	55.6	41%	0.405	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-68.3	-20.2	179.2	0	0	0	0	0	112.5	D822 H829	D822-A824 PolarHBondContact O-N 2.84Å; D822-A824 VanDerWaalsContact O-N 3.15Å; D822-A824 WeakPolarHBondContact OD1-CB 3.35Å; D822-A824 PolarHBondContact OD1-N 3.41Å; A824-H829 VanDerWaalsContact CA-CD2 3.5Å; A824-H829 WeakPolarHBondContact CA-CD2 3.46Å; A824-H829 PolarHBondContact O-CD2 3.36Å
825	R	85.1	Confident	81.7	Confident	117 Å²	117	60.8 Å²	60.8	44%	0.442	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-82	-11.2	173.1	-67	179.3	-178	-131.4	-5.9	114.1	F815 D817 D822 P823 Q830	F815-R825 HydrophobicContact CD1-CB 4.47Å; D817-R825 IonicContact OD2-NH1 2.66Å; D822-R825 HydrophobicContact CB-CG 4.16Å; D822-R825 WeakPolarHBondContact O-CB 3.25Å; D822-R825 PolarHBondContact O-N 2.92Å; D822-R825 WeakPolarHBondContact OD2-CG 3.18Å; D822-R825 IonicContact OD2-NE 3.46Å; D822-R825 PolarHBondContact OD2-NE 3.41Å; P823-R825 PolarHBondContact O-N 2.8Å; R825-Q830 PolarHBondContact O-NE2 3.2Å
826	S	90.9	Very high	80.9	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.021	33%	0.328	C	S	.	.	S	Bend	trans	-59.3	143.5	177.8	65.7	0	0	0	0	110.9	L814 P823 N828 H829 Q830	L814-S826 CarbonylContact O-C 3.55Å; L814-S826 WeakPolarHBondContact O-CA 3.45Å; P823-S826 WeakPolarHBondContact O-CB 3.39Å; P823-S826 PolarHBondContact O-N 3.21Å; P823-S826 VanDerWaalsContact O-N 3.09Å; P823-S826 PolarHBondContact O-OG 3.41Å; S826-N828 PolarHBondContact O-N 2.85Å; S826-H829 PolarHBondContact O-N 3.41Å; S826-H829 VanDerWaalsContact O-N 3.08Å; S826-H829 WeakPolarHBondContact OG-CB 3.39Å; S826-H829 PolarHBondContact OG-N 3.17Å; S826-Q830 WeakPolarHBondContact O-CG 3.25Å; S826-Q830 PolarHBondContact O-N 3.3Å; S826-Q830 VanDerWaalsContact O-N 3.08Å
827	L	90.1	Very high	80.1	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-57	-34.8	173.6	-66.9	178.5	0	0	0	110.6	W785 L786 K789 V790 L814 T816 H829 Q830 M831	W785-L827 HydrophobicContact CH2-CD2 3.69Å; W785-L827 HydrophobicContact CZ3-CB 4.4Å; W785-L827 HydrophobicContact CZ3-CD2 4.01Å; L786-L827 HydrophobicContact CD1-CD1 4.16Å; K789-L827 HydrophobicContact CB-CD1 4.41Å; K789-L827 HydrophobicContact CB-CD2 4.23Å; K789-L827 HydrophobicContact CG-CD2 4.37Å; V790-L827 HydrophobicContact CG1-CD1 3.46Å; V790-L827 VanDerWaalsContact CG1-CD1 3.46Å; L814-L827 HydrophobicContact CB-CD1 4.44Å; L814-L827 HydrophobicContact CD2-CD1 3.97Å; L814-L827 HydrophobicContact CG-CD1 4.06Å; L814-L827 PolarHBondContact O-N 3.11Å; T816-L827 HydrophobicContact CG2-CD1 3.97Å; T816-L827 HydrophobicContact CG2-CD2 3.95Å; T816-L827 HydrophobicContact CG2-CG 4.26Å; L827-H829 PolarHBondContact O-N 3.46Å; L827-Q830 PolarHBondContact O-N 3.25Å; L827-M831 WeakPolarHBondContact O-CB 3.44Å; L827-M831 VanDerWaalsContact O-CG 3.23Å; L827-M831 WeakPolarHBondContact O-CG 3.49Å; L827-M831 PolarHBondContact O-N 3.02Å
828	N	90.9	Very high	79.6	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-50.7	-53.5	172.1	-49.2	55.4	0	0	0	112	L768 A769 L771 V812 H813 L814 S826 M831 A832	L768-N828 WeakPolarHBondContact CA-ND2 3.23Å; L768-N828 WeakPolarHBondContact CB-ND2 3.46Å; A769-N828 PolarHBondContact N-ND2 2.97Å; A769-N828 PolarHBondContact O-ND2 3.34Å; L771-N828 WeakPolarHBondContact CD2-O 3.24Å; V812-N828 PolarHBondContact O-ND2 2.9Å; H813-N828 WeakPolarHBondContact CA-OD1 3.4Å; L814-N828 PolarHBondContact N-OD1 2.99Å; S826-N828 PolarHBondContact O-N 2.85Å; N828-M831 PolarHBondContact O-N 3.26Å; N828-A832 WeakPolarHBondContact O-CB 3.24Å; N828-A832 PolarHBondContact O-N 2.85Å
829	H	86.9	Confident	78.8	Confident	71 Å²	71	70.2 Å²	70.2	33%	0.329	36%	0.358	S	S	.	.	H	α-helix	trans	-68.7	-42.2	-177.8	-165.7	81.9	0	0	0	111.6	A824 S826 L827 M831 A832 Q833	A824-H829 VanDerWaalsContact CA-CD2 3.5Å; A824-H829 WeakPolarHBondContact CA-CD2 3.46Å; A824-H829 PolarHBondContact O-CD2 3.36Å; S826-H829 PolarHBondContact O-N 3.41Å; S826-H829 VanDerWaalsContact O-N 3.08Å; S826-H829 WeakPolarHBondContact OG-CB 3.39Å; S826-H829 PolarHBondContact OG-N 3.17Å; L827-H829 PolarHBondContact O-N 3.46Å; H829-M831 VanDerWaalsContact C-N 3.33Å; H829-M831 PolarHBondContact O-N 3.28Å; H829-A832 PolarHBondContact O-N 3.27Å; H829-Q833 PolarHBondContact NE2-NE2 2.9Å; H829-Q833 WeakPolarHBondContact O-CG 3.33Å; H829-Q833 PolarHBondContact O-N 3.33Å
830	Q	88.1	Confident	77.4	Confident	69 Å²	69	74.7 Å²	74.7	32%	0.322	38%	0.376	S	S	.	.	H	α-helix	trans	-58.8	-43.7	174.7	-65.9	178.1	45.5	0	0	111.7	W785 R825 S826 L827 Q833 S834	W785-Q830 HydrophobicContact CH2-CB 4.08Å; W785-Q830 HydrophobicContact CZ2-CB 4.44Å; R825-Q830 PolarHBondContact O-NE2 3.2Å; S826-Q830 WeakPolarHBondContact O-CG 3.25Å; S826-Q830 PolarHBondContact O-N 3.3Å; S826-Q830 VanDerWaalsContact O-N 3.08Å; L827-Q830 PolarHBondContact O-N 3.25Å; Q830-Q833 PolarHBondContact O-N 3.36Å; Q830-S834 WeakPolarHBondContact O-CB 3.14Å; Q830-S834 PolarHBondContact O-N 3.2Å
831	M	87.9	Confident	75.7	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-68.1	-42.4	177.1	-70.4	-172.7	81.1	0	0	112	L768 L771 W778 A782 W785 L786 L827 N828 H829 Q833 S834 L836 F837	L768-M831 HydrophobicContact CD1-SD 3.85Å; L771-M831 HydrophobicContact CD2-CB 4.24Å; W778-M831 HydrophobicContact CE3-CE 4.45Å; W778-M831 HydrophobicContact CH2-CE 4.15Å; W778-M831 HydrophobicContact CH2-SD 4.4Å; W778-M831 HydrophobicContact CZ3-CE 3.68Å; W778-M831 HydrophobicContact CZ3-SD 4.4Å; A782-M831 HydrophobicContact CB-CE 3.83Å; A782-M831 WeakPolarHBondContact O-CE 3.44Å; W785-M831 HydrophobicContact CE3-CE 4.17Å; W785-M831 HydrophobicContact CE3-CG 3.64Å; W785-M831 HydrophobicContact CE3-SD 3.84Å; W785-M831 HydrophobicContact CH2-CG 3.87Å; W785-M831 HydrophobicContact CZ3-CG 3.24Å; W785-M831 HydrophobicContact CZ3-SD 3.68Å; L786-M831 HydrophobicContact CB-CE 4.41Å; L786-M831 HydrophobicContact CB-SD 4.36Å; L786-M831 HydrophobicContact CD1-SD 4.3Å; L827-M831 WeakPolarHBondContact O-CB 3.44Å; L827-M831 VanDerWaalsContact O-CG 3.23Å; L827-M831 WeakPolarHBondContact O-CG 3.49Å; L827-M831 PolarHBondContact O-N 3.02Å; N828-M831 PolarHBondContact O-N 3.26Å; H829-M831 VanDerWaalsContact C-N 3.33Å; H829-M831 PolarHBondContact O-N 3.28Å; M831-Q833 VanDerWaalsContact C-N 3.26Å; M831-Q833 PolarHBondContact O-N 3.22Å; M831-S834 PolarHBondContact O-N 2.94Å; M831-S834 VanDerWaalsContact O-N 3.12Å; M831-S834 PolarHBondContact O-OG 3.44Å; M831-L836 HydrophobicContact CE-CD1 4.31Å; M831-L836 HydrophobicContact CG-CD1 4.47Å; M831-F837 HydrophobicContact CB-CE2 4.06Å; M831-F837 HydrophobicContact CE-CE2 4.18Å; M831-F837 HydrophobicContact CE-CZ 3.88Å
832	A	84.3	Confident	73.7	Confident	59 Å²	59	78.7 Å²	78.7	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-29.8	177.2	0	0	0	0	0	113.6	L771 N828 H829	L771-A832 HydrophobicContact CD2-CB 4.01Å; N828-A832 WeakPolarHBondContact O-CB 3.24Å; N828-A832 PolarHBondContact O-N 2.85Å; H829-A832 PolarHBondContact O-N 3.27Å
833	Q	82.3	Confident	71.6	Confident	140 Å²	140	81.5 Å²	81.5	65%	0.654	43%	0.429	S	S	*	.	H	α-helix	trans	-87.7	-9.7	176	-70.9	-178.3	-22.6	0	0	113.9	H829 Q830 M831	H829-Q833 PolarHBondContact NE2-NE2 2.9Å; H829-Q833 WeakPolarHBondContact O-CG 3.33Å; H829-Q833 PolarHBondContact O-N 3.33Å; Q830-Q833 PolarHBondContact O-N 3.36Å; M831-Q833 VanDerWaalsContact C-N 3.26Å; M831-Q833 PolarHBondContact O-N 3.22Å
834	S	82.4	Confident	69.3	Low	33 Å²	33	86.7 Å²	86.7	23%	0.231	44%	0.444	C	S	.	.	S	Bend	trans	-86.6	162.5	-177.4	76.4	0	0	0	0	113	Q830 M831 L836	Q830-S834 WeakPolarHBondContact O-CB 3.14Å; Q830-S834 PolarHBondContact O-N 3.2Å; M831-S834 PolarHBondContact O-N 2.94Å; M831-S834 VanDerWaalsContact O-N 3.12Å; M831-S834 PolarHBondContact O-OG 3.44Å; S834-L836 PolarHBondContact O-N 2.85Å; S834-L836 VanDerWaalsContact OG-CB 3.3Å; S834-L836 WeakPolarHBondContact OG-CB 3.36Å; S834-L836 WeakPolarHBondContact OG-CD1 3.43Å; S834-L836 WeakPolarHBondContact OG-CG 3.44Å; S834-L836 PolarHBondContact OG-N 3.4Å
835	D	77.9	Confident	66.9	Low	109 Å²	109	92 Å²	92	58%	0.583	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-78.4	2.6	172.1	-63.2	-24.6	0	0	0	113.1	F837 K838	D835-F837 PolarHBondContact O-N 2.93Å; D835-F837 VanDerWaalsContact O-N 3.1Å; D835-K838 HydrophobicContact CB-CD 4.17Å; D835-K838 WeakPolarHBondContact O-CB 3.43Å; D835-K838 PolarHBondContact O-N 3.4Å; D835-K838 VanDerWaalsContact OD1-CD 3.28Å; D835-K838 WeakPolarHBondContact OD1-CD 3.5Å; D835-K838 WeakPolarHBondContact OD1-CE 3.38Å; D835-K838 IonicContact OD1-NZ 3.68Å; D835-K838 PolarHBondContact OD1-NZ 2.88Å
836	L	75.4	Confident	64.1	Low	36 Å²	36	94.4 Å²	94.4	19%	0.188	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-59.9	-25.1	-175.2	-64.9	170.9	0	0	0	114	S779 D781 A782 W785 M831 S834	S779-L836 PolarHBondContact OG-O 3.13Å; D781-L836 HydrophobicContact CB-CD2 4.28Å; A782-L836 HydrophobicContact CB-CB 4.09Å; W785-L836 HydrophobicContact CB-CD1 3.89Å; W785-L836 HydrophobicContact CB-CD2 4.27Å; W785-L836 HydrophobicContact CD2-CD1 3.78Å; W785-L836 HydrophobicContact CE3-CD1 4.23Å; W785-L836 HydrophobicContact CG-CD1 3.61Å; W785-L836 HydrophobicContact CG-CD2 4.46Å; M831-L836 HydrophobicContact CE-CD1 4.31Å; M831-L836 HydrophobicContact CG-CD1 4.47Å; S834-L836 PolarHBondContact O-N 2.85Å; S834-L836 VanDerWaalsContact OG-CB 3.3Å; S834-L836 WeakPolarHBondContact OG-CB 3.36Å; S834-L836 WeakPolarHBondContact OG-CD1 3.43Å; S834-L836 WeakPolarHBondContact OG-CG 3.44Å; S834-L836 PolarHBondContact OG-N 3.4Å
837	F	69.6	Low	61.1	Low	53 Å²	53	99 Å²	99	23%	0.232	52%	0.516	C	S	.	.	G	3₁₀ helix	trans	-103.2	1.1	176.3	-61.4	-69.6	0	0	0	113.7	L771 V773 W778 A782 M831 D835	L771-F837 HydrophobicContact CD1-CE2 4.39Å; L771-F837 HydrophobicContact CD1-CZ 4.16Å; L771-F837 HydrophobicContact CD2-CE2 4.28Å; V773-F837 HydrophobicContact CB-CE1 4.42Å; V773-F837 HydrophobicContact CG1-CD1 4.05Å; V773-F837 HydrophobicContact CG1-CE1 3.87Å; V773-F837 HydrophobicContact CG2-CD1 3.88Å; V773-F837 HydrophobicContact CG2-CD2 4.17Å; V773-F837 HydrophobicContact CG2-CE1 3.93Å; V773-F837 HydrophobicContact CG2-CE2 4.18Å; V773-F837 HydrophobicContact CG2-CG 4.02Å; V773-F837 HydrophobicContact CG2-CZ 4.07Å; W778-F837 HydrophobicContact CD2-CE1 4.14Å; W778-F837 HydrophobicContact CD2-CZ 4.4Å; W778-F837 HydrophobicContact CE3-CE1 4.32Å; W778-F837 HydrophobicContact CE3-CZ 4.37Å; W778-F837 HydrophobicContact CG-CE1 4.39Å; W778-F837 HydrophobicContact CZ3-CZ 4.47Å; A782-F837 HydrophobicContact CB-CD1 4.25Å; A782-F837 HydrophobicContact CB-CE1 3.71Å; A782-F837 HydrophobicContact CB-CZ 3.99Å; M831-F837 HydrophobicContact CB-CE2 4.06Å; M831-F837 HydrophobicContact CE-CE2 4.18Å; M831-F837 HydrophobicContact CE-CZ 3.88Å; D835-F837 PolarHBondContact O-N 2.93Å; D835-F837 VanDerWaalsContact O-N 3.1Å
838	K	62.8	Low	58.3	Low	145 Å²	145	107.8 Å²	107.8	63%	0.63	56%	0.557	S	S	*	*	S	Bend	trans	-81.2	122.8	173.7	-66	-176.6	-173.5	165.7	0	108.5	D835 Q840	D835-K838 HydrophobicContact CB-CD 4.17Å; D835-K838 WeakPolarHBondContact O-CB 3.43Å; D835-K838 PolarHBondContact O-N 3.4Å; D835-K838 VanDerWaalsContact OD1-CD 3.28Å; D835-K838 WeakPolarHBondContact OD1-CD 3.5Å; D835-K838 WeakPolarHBondContact OD1-CE 3.38Å; D835-K838 IonicContact OD1-NZ 3.68Å; D835-K838 PolarHBondContact OD1-NZ 2.88Å; K838-Q840 PolarHBondContact O-N 3.01Å; K838-Q840 VanDerWaalsContact O-N 3.17Å
839	Q	51.7	Low	55.2	Low	191 Å²	191	113.1 Å²	113.1	89%	0.893	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-60	120.6	172.7	-70.2	-176.3	-25.9	0	0	109.5
840	Q	39.2	Very low	52.8	Low	160 Å²	160	115.2 Å²	115.2	75%	0.748	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-58.8	128.8	155.1	-73	-93.4	-5.4	0	0	106.7	K838 D842	K838-Q840 PolarHBondContact O-N 3.01Å; K838-Q840 VanDerWaalsContact O-N 3.17Å; Q840-D842 PolarHBondContact O-N 2.89Å
841	P	33.4	Very low	49.9	Very low	106 Å²	106	119 Å²	119	69%	0.688	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-63.4	129.4	168	27.7	-32.2	0	0	0	108.1	V843	P841-V843 PolarHBondContact O-N 3.31Å
842	D	30.7	Very low	47.1	Very low	162 Å²	162	128.5 Å²	128.5	87%	0.866	68%	0.684	S	S	*	*			trans	-51.8	113.8	-172.8	-74.4	-58.1	0	0	0	112.2	Q840 F844	Q840-D842 PolarHBondContact O-N 2.89Å; D842-F844 PolarHBondContact O-N 3.11Å
843	V	36	Very low	44.4	Very low	121 Å²	121	132.5 Å²	132.5	73%	0.733	70%	0.702	S	S	*	*			trans	-83.2	64.9	174	-173.6	0	0	0	0	108.9	P841	P841-V843 PolarHBondContact O-N 3.31Å
844	F	28.8	Very low	41.6	Very low	192 Å²	192	130.8 Å²	130.8	84%	0.842	71%	0.706	S	S	*	*	S	Bend	trans	-161.1	145.6	151.8	-95.7	-66	0	0	0	111	D842	D842-F844 PolarHBondContact O-N 3.11Å
845	L	31.6	Very low	38.9	Very low	162 Å²	162	136 Å²	136	85%	0.848	74%	0.736	S	S	*	*			trans	74.1	63.9	179	-53.3	-178.7	0	0	0	118.3
846	I	25.9	Very low	36.4	Very low	167 Å²	167	138 Å²	138	86%	0.856	75%	0.747	S	S	*	*			trans	-127.4	102	138.9	-55.9	-179.5	0	0	0	109.7
847	S	27.1	Very low	34.7	Very low	99 Å²	99	141 Å²	141	69%	0.692	77%	0.768	S	S	*	*			trans	-139.7	57.9	163.7	71.5	0	0	0	0	112.3
848	H	31.1	Very low	32.6	Very low	186 Å²	186	147 Å²	147	86%	0.861	80%	0.795	S	S	*	*			trans	-143.1	146.7	151.9	-80.1	-58.2	0	0	0	110.5
849	S	27.2	Very low	31	Very low	115 Å²	115	144.7 Å²	144.7	80%	0.804	80%	0.797	S	S	*	*			trans	-109.4	-177.2	-167.3	69.9	0	0	0	0	110.8
850	P	36.4	Very low	29.9	Very low	115 Å²	115	139.8 Å²	139.8	75%	0.747	78%	0.783	S	S	*	*				-120.8	153	-107.7	33.7	-16.4	0	0	0	114.8
851	T	27.3	Very low	29.4	Very low	148 Å²	148	141.5 Å²	141.5	91%	0.908	79%	0.789	S	S	*	*			trans	-115.5	118.3	165.5	31.1	0	0	0	0	111.6
852	K	28.6	Very low	29	Very low	199 Å²	199	142 Å²	142	87%	0.865	79%	0.79	S	S	*	*			trans	-73.6	132.3	178	-60.4	169.5	178	174.1	0	110.6
853	V	27	Very low	28.9	Very low	143 Å²	143	139.2 Å²	139.2	87%	0.867	78%	0.783	S	S	*	*			trans	-135.9	128.3	143.5	-177.7	0	0	0	0	108.1
854	S	23.9	Very low	28.6	Very low	105 Å²	105	138.1 Å²	138.1	73%	0.734	78%	0.781	S	S	*	*			trans	-82.5	141	176.2	-61.6	0	0	0	0	111.5
855	T	25.2	Very low	28.5	Very low	143 Å²	143	134.1 Å²	134.1	88%	0.877	78%	0.776	S	S	*	*			trans	-157.6	106.4	131.8	26.4	0	0	0	0	110.3
856	N	25.2	Very low	28.3	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	78%	0.778	S	S	*	*			trans	-69.9	164.8	152.3	-114.6	3.2	0	0	0	108
857	P	39.6	Very low	28.5	Very low	98 Å²	98	129.3 Å²	129.3	64%	0.636	77%	0.771	S	S	*	*				-158.4	178.9	58.9	39.9	-16.5	0	0	0	119.7
858	F	25.5	Very low	28.4	Very low	180 Å²	180	131.6 Å²	131.6	79%	0.789	78%	0.776	S	S	*	*			trans	69.5	105	162.1	-67.6	-63.4	0	0	0	117.5
859	S	30.1	Very low	28.3	Very low	96 Å²	96	127.2 Å²	127.2	67%	0.671	77%	0.766	S	S	*	*				87.5	143.9	71.8	76	0	0	0	0	112.8
860	S	27.9	Very low	28.3	Very low	88 Å²	88	127.9 Å²	127.9	62%	0.615	77%	0.765	S	S	*	*			cis	-172.9	144	8.9	26.3	0	0	0	0	111.9
861	K	28	Very low	27.8	Very low	197 Å²	197	126.2 Å²	126.2	86%	0.857	77%	0.77	S	S	*	*			trans	61.1	160.2	142.7	-55	168.1	-178.4	178.6	0	116
862	T	25.9	Very low	27.7	Very low	117 Å²	117	122.9 Å²	122.9	72%	0.718	77%	0.765	S	S	*	*			cis	-148.2	155	23.4	43.3	0	0	0	0	112.6
863	S	28.3	Very low	27.6	Very low	103 Å²	103	119.2 Å²	119.2	72%	0.72	76%	0.764	S	S	*	*			trans	57.1	143.6	137.8	63.4	0	0	0	0	122.3
864	S	29.2	Very low	28.3	Very low	98 Å²	98	117.8 Å²	117.8	69%	0.685	76%	0.757	S	S	*	*			cis	-178.7	149.5	-11.8	47.5	0	0	0	0	111.4
865	S	27.3	Very low	28.4	Very low	107 Å²	107	119 Å²	119	75%	0.748	76%	0.76	S	S	*	*			trans	48.3	130.4	143.2	63.8	0	0	0	0	120
866	S	28.7	Very low	28.5	Very low	126 Å²	126	117.7 Å²	117.7	88%	0.881	76%	0.758	S	S	*	*				-141.1	163.3	69.8	52	0	0	0	0	115.4
867	S	28.3	Very low	28.5	Very low	103 Å²	103	114.3 Å²	114.3	72%	0.72	75%	0.75	S	S	*	*			trans	-142	145.7	-170.5	53.8	0	0	0	0	111.1
868	D	25.1	Very low	27.9	Very low	146 Å²	146	115 Å²	115	78%	0.781	76%	0.757	S	S	*	*			trans	-170	121.9	136.7	-96.6	-34.2	0	0	0	107.4
869	S	28.9	Very low	28.3	Very low	94 Å²	94	112.6 Å²	112.6	66%	0.657	76%	0.757	S	S	*	*				72.5	134.1	66.4	90.3	0	0	0	0	111.3
870	T	27.2	Very low	28.4	Very low	129 Å²	129	113.9 Å²	113.9	79%	0.791	76%	0.763	S	S	*	*			cis	-142.9	158	17.3	44.9	0	0	0	0	110.9
871	G	26.5	Very low	28.3	Very low	81 Å²	81	114 Å²	114	84%	0.835	77%	0.77	S	S	*	*				61.8	131.3	90.9	0	0	0	0	0	114.5
872	G	26.5	Very low	28.4	Very low	78 Å²	78	113.9 Å²	113.9	80%	0.804	77%	0.769	S	S	*	*			cis	178.3	163.2	2.2	0	0	0	0	0	109.8
873	S	26.2	Very low	29.1	Very low	121 Å²	121	113.8 Å²	113.8	85%	0.846	77%	0.771	S	S	*	*			trans	-75.4	167.7	-176.1	-40.7	0	0	0	0	113.6
874	P	40.4	Very low	29.1	Very low	113 Å²	113	117.3 Å²	117.3	73%	0.734	78%	0.775	S	S	*	*				-152.6	162.4	78.9	41.3	-21.6	0	0	0	118.7
875	T	26.7	Very low	29.6	Very low	130 Å²	130	119 Å²	119	80%	0.798	78%	0.784	S	S	*	*			trans	9	142.7	147	59.9	0	0	0	0	120.2
876	S	27.4	Very low	29.4	Very low	117 Å²	117	124.9 Å²	124.9	82%	0.818	79%	0.79	S	S	*	*			cis	-167.7	-164.3	11.9	47.8	0	0	0	0	108.7
877	A	25.8	Very low	29.2	Very low	78 Å²	78	128.8 Å²	128.8	65%	0.645	79%	0.785	S	S	*	*			cis	-160.7	163.7	11.7	0	0	0	0	0	112.8
878	S	27.2	Very low	29.1	Very low	113 Å²	113	128.6 Å²	128.6	79%	0.79	78%	0.779	S	S	*	*			trans	56.5	150	157.2	76.3	0	0	0	0	119.3
879	V	32.4	Very low	29.1	Very low	130 Å²	130	130 Å²	130	79%	0.788	78%	0.781	S	S	*	*			cis	-136.1	-167	12.6	-140.7	0	0	0	0	110.6
880	P	33.1	Very low	28.9	Very low	123 Å²	123	131.4 Å²	131.4	80%	0.799	79%	0.791	S	S	*	*				-115.4	176.8	-121.1	42.3	-25.6	0	0	0	116.6
881	A	25	Very low	28.7	Very low	91 Å²	91	128.6 Å²	128.6	75%	0.752	79%	0.788	S	S	*	*			trans	-101.5	178	-178.2	0	0	0	0	0	114.8
882	K	29.6	Very low	30	Very low	194 Å²	194	130.3 Å²	130.3	84%	0.843	78%	0.784	S	S	*	*			trans	107.8	159.9	145.9	-75	-172.2	176.6	177.1	0	117.5
883	P	40.7	Very low	30.1	Very low	115 Å²	115	136.6 Å²	136.6	75%	0.747	79%	0.789	S	S	*	*			cis	-141.3	-175.9	-35.6	37.6	-19	0	0	0	115.1
884	H	29	Very low	30.1	Very low	177 Å²	177	134.8 Å²	134.8	82%	0.819	79%	0.79	S	S	*	*			trans	-56.7	170.7	155	-73.5	16.3	0	0	0	112.8
885	P	38.9	Very low	29.3	Very low	132 Å²	132	133.4 Å²	133.4	86%	0.857	80%	0.796	S	S	*	*			cis	-162	-158.5	47.5	46.9	-21.4	0	0	0	120.5
886	R	24.2	Very low	29.3	Very low	232 Å²	232	130.4 Å²	130.4	88%	0.875	79%	0.791	S	S	*	*			trans	-50.3	145.2	-177.2	-94.6	177.7	175.1	-175.9	-0.9	122.1
887	R	25	Very low	29.5	Very low	207 Å²	207	133.9 Å²	133.9	78%	0.781	79%	0.794	S	S	*	*				79	123.7	122.9	-144.2	-168.6	99.6	166	3.7	123.4
888	T	24.9	Very low	29.8	Very low	99 Å²	99	134.6 Å²	134.6	61%	0.607	80%	0.8	S	S	*	*			trans	83.1	135.4	142.3	30.3	0	0	0	0	125.1
889	Q	25.2	Very low	29.9	Very low	175 Å²	175	133.6 Å²	133.6	82%	0.818	80%	0.799	S	S	*	*			trans	98.1	143.9	142.4	-80.8	179.3	16.4	0	0	123.3
890	S	24.4	Very low	29.7	Very low	124 Å²	124	132.5 Å²	132.5	87%	0.867	80%	0.797	S	S	*	*			trans	82.4	142.3	164.8	74.5	0	0	0	0	121
891	G	23.2	Very low	29.4	Very low	70 Å²	70	132.9 Å²	132.9	72%	0.722	80%	0.797	S	S	*	*			trans	-122.1	-150.6	158.5	0	0	0	0	0	108.5
892	P	54.6	Low	29.5	Very low	117 Å²	117	134.1 Å²	134.1	76%	0.76	80%	0.8	S	S	*	*			cis	-131.8	-168.8	-14.9	36.2	-15.7	0	0	0	113.7
893	K	28.7	Very low	30.1	Very low	210 Å²	210	130.5 Å²	130.5	91%	0.913	80%	0.797	S	S	*	*			trans	81.4	145.4	164.2	-59.3	178.8	177	-179.1	0	120.6
894	G	25.4	Very low	30.1	Very low	84 Å²	84	131.1 Å²	131.1	87%	0.866	80%	0.801	S	S	*	*			trans	130.9	100	144.1	0	0	0	0	0	117
895	G	25	Very low	30.2	Very low	83 Å²	83	126.3 Å²	126.3	86%	0.856	80%	0.799	S	S	*	*			trans	-105.3	-165.8	-172.4	0	0	0	0	0	119.2
896	G	26.1	Very low	29.8	Very low	67 Å²	67	124.7 Å²	124.7	69%	0.691	80%	0.797	S	S	*	*			trans	88.9	150.2	171.6	0	0	0	0	0	115.4
897	H	31.6	Very low	30.3	Very low	190 Å²	190	119.9 Å²	119.9	88%	0.88	80%	0.795	S	S	*	*			cis	-157	126.4	-10.8	-94.3	-79.6	0	0	0	106.6
898	A	30.9	Very low	30.6	Very low	93 Å²	93	115.5 Å²	115.5	77%	0.769	80%	0.797	S	S	*	*				79.4	119.4	93.5	0	0	0	0	0	117.9
899	A	29.3	Very low	31.1	Very low	93 Å²	93	115.9 Å²	115.9	77%	0.769	80%	0.804	S	S	*	*			trans	-178.4	122.9	137.8	0	0	0	0	0	114.1
900	S	28.7	Very low	31.7	Very low	107 Å²	107	113 Å²	113	75%	0.748	80%	0.8	S	S	*	*			trans	39.7	140.8	143	61.2	0	0	0	0	122.5
901	T	27.1	Very low	32.3	Very low	130 Å²	130	113.1 Å²	113.1	80%	0.798	80%	0.797	S	S	*	*			cis	-166.8	165.5	17.2	-5.1	0	0	0	0	113.8
902	S	27.8	Very low	32.9	Very low	118 Å²	118	114.1 Å²	114.1	83%	0.825	80%	0.799	S	S	*	*			trans	100.8	149.4	159.4	77.3	0	0	0	0	119.7
903	P	40.8	Very low	32.4	Very low	118 Å²	118	116.8 Å²	116.8	77%	0.766	81%	0.806	S	S	*	*			trans	-125.7	-167.3	-147.9	44.1	-29.7	0	0	0	115.3
904	P	40.7	Very low	33.6	Very low	127 Å²	127	111.1 Å²	111.1	83%	0.825	79%	0.786	S	S	*	*				-122.5	138.8	-51.9	33.1	-17.8	0	0	0	112.2
905	G	31.3	Very low	35.6	Very low	76 Å²	76	114.6 Å²	114.6	78%	0.784	78%	0.779	S	S	*	*			trans	-118.1	131	173.4	0	0	0	0	0	112
906	A	31.4	Very low	38.2	Very low	98 Å²	98	114.1 Å²	114.1	81%	0.81	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-65.6	145	178.9	0	0	0	0	0	111.8	S908	A906-S908 PolarHBondContact O-N 3.36Å
907	P	35	Very low	40.8	Very low	131 Å²	131	111.3 Å²	111.3	85%	0.851	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-72.2	122.4	-171.4	28.3	-34.5	0	0	0	112.1	S909	P907-S909 PolarHBondContact O-N 3.12Å
908	S	31.1	Very low	43.3	Very low	116 Å²	116	105.6 Å²	105.6	81%	0.811	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-67.4	122	162	45.3	0	0	0	0	109.6	A906	A906-S908 PolarHBondContact O-N 3.36Å
909	S	35.4	Very low	45.8	Very low	107 Å²	107	105.5 Å²	105.5	75%	0.748	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-64.4	145.7	166.9	42.9	0	0	0	0	110.2	P907	P907-S909 PolarHBondContact O-N 3.12Å
910	P	36.2	Very low	48.5	Very low	113 Å²	113	102 Å²	102	73%	0.734	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-63.9	151	175.4	27.5	-34.3	0	0	0	110.5	A912	P910-A912 PolarHBondContact O-N 3.07Å
911	P	37.3	Very low	51.1	Low	127 Å²	127	105.7 Å²	105.7	83%	0.825	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-59.9	129.7	179.6	25.4	-33.8	0	0	0	110.3	L913	P911-L913 PolarHBondContact O-N 3.32Å
912	A	36.9	Very low	53.9	Low	92 Å²	92	101.2 Å²	101.2	76%	0.76	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-58.9	120.6	-174.7	0	0	0	0	0	111.4	P910 L914	P910-A912 PolarHBondContact O-N 3.07Å; A912-L914 PolarHBondContact O-N 3.44Å
913	L	43.1	Very low	56.6	Low	173 Å²	173	97.6 Å²	97.6	91%	0.906	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-51.5	130.1	173.5	-76.3	164.2	0	0	0	110	P911 Q915	P911-L913 PolarHBondContact O-N 3.32Å; L913-Q915 PolarHBondContact O-N 3.39Å
914	L	55.4	Low	58.6	Low	91 Å²	91	99.1 Å²	99.1	48%	0.476	61%	0.607	S	S	.	*			trans	-71.2	88.3	-176.1	-77.9	176.9	0	0	0	110.7	A912 L916 R1028	A912-L914 PolarHBondContact O-N 3.44Å; L914-L916 PolarHBondContact O-N 2.82Å; L914-R1028 VanDerWaalsContact C-NH1 3.34Å; L914-R1028 PolarHBondContact O-NH1 3.25Å
915	Q	67.3	Low	60.9	Low	156 Å²	156	98.3 Å²	98.3	73%	0.729	60%	0.595	S	S	*	*			trans	-37.7	120.8	-178.8	-167	173	12.3	0	0	113.2	L913 R1028	L913-Q915 PolarHBondContact O-N 3.39Å; Q915-R1028 WeakPolarHBondContact O-CD 3.47Å; Q915-R1028 PolarHBondContact O-NH1 3.48Å
916	L	78.9	Confident	63.2	Low	73 Å²	73	96.6 Å²	96.6	38%	0.382	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-70.6	160.3	177.9	-68.8	176.3	0	0	0	111.3	L914 I979 P1077 W1078	L914-L916 PolarHBondContact O-N 2.82Å; L916-I979 HydrophobicContact CD2-CD1 3.76Å; L916-P1077 HydrophobicContact CD1-CG 4.4Å; L916-W1078 HydrophobicContact CD2-CH2 4.14Å; L916-W1078 HydrophobicContact CD2-CZ3 3.93Å
917	P	81.5	Confident	65.7	Low	9 Å²	9	96.9 Å²	96.9	6%	0.058	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-60.7	158.6	167.5	-18.9	32.7	0	0	0	112.3	R1028 F1032	P917-R1028 VanDerWaalsContact CA-O 3.24Å; P917-R1028 WeakPolarHBondContact CA-O 3.31Å; P917-R1028 HydrophobicContact CB-CB 4.44Å; P917-R1028 WeakPolarHBondContact CB-O 3.34Å; P917-R1028 HydrophobicContact CG-CB 3.98Å; P917-R1028 HydrophobicContact CG-CG 4.46Å; P917-F1032 HydrophobicContact CG-CD1 4.37Å; P917-F1032 HydrophobicContact CG-CD2 4.43Å; P917-F1032 HydrophobicContact CG-CE1 3.75Å; P917-F1032 HydrophobicContact CG-CE2 3.82Å; P917-F1032 HydrophobicContact CG-CZ 3.44Å; P917-F1032 VanDerWaalsContact CG-CZ 3.44Å
918	P	82.6	Confident	68.2	Low	70 Å²	70	92.8 Å²	92.8	46%	0.455	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-59.3	148.9	172.5	24.8	-31.9	0	0	0	111.1	R1028 Q1029 P1031	P918-R1028 VanDerWaalsContact CD-O 3.31Å; P918-R1028 WeakPolarHBondContact CD-O 3.44Å; P918-Q1029 VanDerWaalsContact CG-O 3.28Å; P918-Q1029 WeakPolarHBondContact CG-O 3.38Å; P918-P1031 HydrophobicContact CG-CG 4.11Å; P918-P1031 VanDerWaalsContact O-CA 3.32Å; P918-P1031 WeakPolarHBondContact O-CA 3.39Å; P918-P1031 VanDerWaalsContact O-CB 3.28Å; P918-P1031 WeakPolarHBondContact O-CB 3.33Å
919	L	84.4	Confident	70.8	Confident	90 Å²	90	88.2 Å²	88.2	47%	0.471	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-67.2	143.9	173.7	-173.3	64.3	0	0	0	109.7	E921 P1077	L919-E921 PolarHBondContact O-N 3.07Å; L919-P1077 HydrophobicContact CD1-CB 3.86Å; L919-P1077 HydrophobicContact CD1-CG 4.39Å
920	L	85.6	Confident	73.2	Confident	19 Å²	19	83.5 Å²	83.5	10%	0.099	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-69.3	126.5	176.3	-177.6	69.7	0	0	0	110.7	L922 P946 P1031 I1035 R1080	L920-L922 HydrophobicContact CD2-CD2 3.88Å; L920-L922 HydrophobicContact CG-CD2 4.15Å; L920-P946 HydrophobicContact CD1-CG 4.05Å; L920-P946 HydrophobicContact CD2-CG 3.51Å; L920-P946 HydrophobicContact CG-CG 4.32Å; L920-P1031 HydrophobicContact CB-CB 3.86Å; L920-P1031 HydrophobicContact CD1-CB 4.01Å; L920-P1031 HydrophobicContact CD1-CG 4.23Å; L920-I1035 HydrophobicContact CD2-CD1 3.53Å; L920-I1035 HydrophobicContact CD2-CG1 3.71Å; L920-R1080 PolarHBondContact O-NH1 3.41Å
921	E	84	Confident	75.7	Confident	186 Å²	186	78.1 Å²	78.1	87%	0.869	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-72.2	129.5	172.9	-65.5	-176.9	179.8	0	0	110.1	L919	L919-E921 PolarHBondContact O-N 3.07Å
922	L	85.5	Confident	78.2	Confident	36 Å²	36	73.3 Å²	73.3	19%	0.188	40%	0.396	C	S	.	.			trans	-120	153.3	-179.2	-65	-176.2	0	0	0	110.2	L920 M929 I1035 M1071 R1080 L1082	L920-L922 HydrophobicContact CD2-CD2 3.88Å; L920-L922 HydrophobicContact CG-CD2 4.15Å; L922-M929 HydrophobicContact CD2-SD 4.24Å; L922-I1035 HydrophobicContact CD2-CD1 3.84Å; L922-M1071 HydrophobicContact CD1-SD 4.01Å; L922-R1080 VanDerWaalsContact CD1-NH1 3.33Å; L922-L1082 HydrophobicContact CD1-CD1 3.92Å; L922-L1082 HydrophobicContact CD1-CD2 3.54Å; L922-L1082 HydrophobicContact CD1-CG 4.32Å
923	P	83.9	Confident	80.8	Confident	42 Å²	42	69 Å²	69	27%	0.273	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-65	165.9	175.9	32.4	-39.7	0	0	0	111.6	H927 M929 L1068	P923-H927 HydrophobicContact CB-CB 4.06Å; P923-M929 HydrophobicContact CG-CB 4.07Å; P923-M929 HydrophobicContact CG-CG 4.12Å; P923-M929 HydrophobicContact CG-SD 4.09Å; P923-L1068 VanDerWaalsContact O-CD2 3.32Å; P923-L1068 WeakPolarHBondContact O-CD2 3.27Å
924	Q	82.9	Confident	82.8	Confident	150 Å²	150	61.1 Å²	61.1	70%	0.701	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-66.7	154	171.8	-67.5	-178	-5.8	0	0	111.2	H927	Q924-H927 VanDerWaalsContact O-CB 3.3Å; Q924-H927 WeakPolarHBondContact O-CB 3.22Å; Q924-H927 PolarHBondContact O-N 3.05Å; Q924-H927 VanDerWaalsContact O-N 3.13Å; Q924-H927 PolarHBondContact O-ND1 3.47Å
925	I	88.2	Confident	84.3	Confident	109 Å²	109	58 Å²	58	56%	0.559	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	142.8	171.7	-68	168.7	0	0	0	110.2	H927 L1068 E1069	I925-H927 VanDerWaalsContact C-N 3.28Å; I925-H927 PolarHBondContact O-N 3.44Å; I925-H927 PolarHBondContact O-ND1 3.11Å; I925-L1068 HydrophobicContact CG1-CD2 4.36Å; I925-L1068 HydrophobicContact CG1-CG 4.41Å; I925-E1069 WeakPolarHBondContact CG2-O 3.45Å
926	G	79.5	Confident	85.5	Confident	41 Å²	41	50.7 Å²	50.7	42%	0.423	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	-14.1	-174.5	0	0	0	0	0	115.1	Q1067 L1068	G926-Q1067 PolarHBondContact O-NE2 3.21Å; G926-L1068 PolarHBondContact N-O 3.16Å
927	H	84.1	Confident	85.7	Confident	104 Å²	104	49.7 Å²	49.7	48%	0.481	27%	0.269	S	S	.	.			trans	-92.6	158.6	-179	-65.4	69.2	0	0	0	112.8	P923 Q924 I925 L1068	P923-H927 HydrophobicContact CB-CB 4.06Å; Q924-H927 VanDerWaalsContact O-CB 3.3Å; Q924-H927 WeakPolarHBondContact O-CB 3.22Å; Q924-H927 PolarHBondContact O-N 3.05Å; Q924-H927 VanDerWaalsContact O-N 3.13Å; Q924-H927 PolarHBondContact O-ND1 3.47Å; I925-H927 VanDerWaalsContact C-N 3.28Å; I925-H927 PolarHBondContact O-N 3.44Å; I925-H927 PolarHBondContact O-ND1 3.11Å; H927-L1068 PolarHBondContact O-N 3.33Å
928	N	88.3	Confident	86.2	Confident	45 Å²	45	52.3 Å²	52.3	24%	0.241	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	144.2	-179.1	-61.2	-13.4	0	0	0	111.7	T121 L123 V1065 A1066 Q1067	T121-N928 PolarHBondContact O-ND2 2.82Å; L123-N928 WeakPolarHBondContact CD1-ND2 3.42Å; L123-N928 WeakPolarHBondContact CG-ND2 3.23Å; N928-V1065 HydrophobicContact CB-CG1 3.76Å; N928-A1066 CarbonylContact C-O 3.35Å; N928-A1066 WeakPolarHBondContact CA-O 3.35Å; N928-Q1067 WeakPolarHBondContact OD1-CB 3.45Å; N928-Q1067 WeakPolarHBondContact OD1-CG 3.46Å
929	M	86.8	Confident	86.6	Confident	20 Å²	20	49 Å²	49	10%	0.099	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.9	164.2	53.3	175.2	-169.8	0	0	111.4	L922 P923 V931 L944 A1066 L1082	L922-M929 HydrophobicContact CD2-SD 4.24Å; P923-M929 HydrophobicContact CG-CB 4.07Å; P923-M929 HydrophobicContact CG-CG 4.12Å; P923-M929 HydrophobicContact CG-SD 4.09Å; M929-V931 HydrophobicContact CE-CG1 3.85Å; M929-V931 HydrophobicContact CG-CG1 3.9Å; M929-V931 PolarHBondContact O-N 2.78Å; M929-V931 HydrophobicContact SD-CG1 4.11Å; M929-L944 HydrophobicContact CE-CD1 4.17Å; M929-A1066 HydrophobicContact CE-CB 4.07Å; M929-A1066 HydrophobicContact CG-CB 4.13Å; M929-A1066 PolarHBondContact N-O 3.09Å; M929-A1066 PolarHBondContact O-N 3.29Å; M929-L1082 HydrophobicContact CE-CD1 3.63Å
930	D	85.6	Confident	86.8	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123	170.5	-52.2	-37.1	0	0	0	108.5	P119 T121 W947 R948	P119-D930 HydrophobicContact CB-CB 4.11Å; P119-D930 HydrophobicContact CG-CB 4.07Å; T121-D930 VanDerWaalsContact CG2-CG 3.48Å; T121-D930 WeakPolarHBondContact CG2-OD1 3.38Å; T121-D930 WeakPolarHBondContact CG2-OD2 3.47Å; D930-W947 HydrophobicContact CB-CB 3.56Å; D930-W947 HydrophobicContact CB-CG 4.1Å; D930-W947 VanDerWaalsContact O-CB 3.26Å; D930-W947 WeakPolarHBondContact O-CB 3.46Å; D930-W947 PolarHBondContact O-N 2.81Å; D930-R948 IonicContact OD2-NE 2.69Å
931	V	88.1	Confident	87.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	158.7	-177.9	-65.1	0	0	0	0	112.1	M929 L944 Q945 P1063 L1064 A1066 L1086	M929-V931 HydrophobicContact CE-CG1 3.85Å; M929-V931 HydrophobicContact CG-CG1 3.9Å; M929-V931 PolarHBondContact O-N 2.78Å; M929-V931 HydrophobicContact SD-CG1 4.11Å; V931-L944 HydrophobicContact CB-CD2 4.23Å; V931-L944 HydrophobicContact CG1-CB 4.43Å; V931-L944 HydrophobicContact CG1-CD1 4.38Å; V931-L944 HydrophobicContact CG2-CD2 3.99Å; V931-Q945 CarbonylContact C-O 3.4Å; V931-Q945 VanDerWaalsContact CA-O 3.29Å; V931-Q945 WeakPolarHBondContact CA-O 3.48Å; V931-P1063 CarbonylContact O-C 3.41Å; V931-P1063 WeakPolarHBondContact O-CA 3.49Å; V931-L1064 HydrophobicContact CG2-CB 4.21Å; V931-L1064 VanDerWaalsContact CG2-O 3.27Å; V931-L1064 WeakPolarHBondContact CG2-O 3.28Å; V931-L1064 PolarHBondContact N-O 2.78Å; V931-L1064 PolarHBondContact O-N 2.93Å; V931-A1066 HydrophobicContact CB-CB 4.46Å; V931-A1066 HydrophobicContact CG1-CB 3.87Å; V931-A1066 HydrophobicContact CG2-CB 3.71Å; V931-L1086 HydrophobicContact CG2-CD2 4.39Å
932	Y	88.9	Confident	87.6	Confident	27 Å²	27	38 Å²	38	11%	0.106	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.6	161.2	-175.9	-109	0	0	0	109	L115 L944 Q945 W947 K1061 K1062	L115-Y932 HydrophobicContact CD1-CE2 4.34Å; L115-Y932 HydrophobicContact CD2-CD2 3.83Å; L115-Y932 HydrophobicContact CD2-CE2 3.33Å; L115-Y932 HydrophobicContact CG-CE2 3.68Å; Y932-L944 CarbonylContact O-C 3.55Å; Y932-L944 WeakPolarHBondContact O-CA 3.44Å; Y932-Q945 PolarHBondContact N-O 2.76Å; Y932-Q945 PolarHBondContact O-N 2.81Å; Y932-W947 HydrophobicContact CD2-CZ3 4.03Å; Y932-W947 HydrophobicContact CG-CZ3 4.47Å; Y932-K1061 WeakPolarHBondContact CE2-O 3.17Å; Y932-K1061 VanDerWaalsContact OH-CA 3.3Å; Y932-K1061 WeakPolarHBondContact OH-CA 3.43Å; Y932-K1061 WeakPolarHBondContact OH-CB 3.43Å; Y932-K1061 PolarHBondContact OH-O 3.25Å; Y932-K1062 WeakPolarHBondContact CD2-O 3.4Å
933	V	91.7	Very high	88.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	102.4	176.2	-167.7	0	0	0	0	108.9	A936 F942 V943 L944 V1059 K1061 K1062 L1064	V933-A936 HydrophobicContact CG1-CB 4.26Å; V933-F942 HydrophobicContact CG1-CB 4.19Å; V933-F942 HydrophobicContact CG1-CD2 4.12Å; V933-V943 CarbonylContact C-O 3.44Å; V933-V943 WeakPolarHBondContact CA-O 3.25Å; V933-V943 WeakPolarHBondContact CG1-O 3.42Å; V933-L944 HydrophobicContact CB-CD2 4.4Å; V933-L944 HydrophobicContact CG1-CD2 4.43Å; V933-L944 HydrophobicContact CG2-CD2 3.76Å; V933-V1059 VanDerWaalsContact CB-O 3.29Å; V933-V1059 WeakPolarHBondContact CB-O 3.43Å; V933-V1059 HydrophobicContact CG1-CG2 4.06Å; V933-V1059 HydrophobicContact CG2-CB 4.23Å; V933-K1061 VanDerWaalsContact O-CA 3.27Å; V933-K1061 WeakPolarHBondContact O-CA 3.32Å; V933-K1061 PolarHBondContact O-N 3.07Å; V933-K1062 PolarHBondContact N-O 3.17Å; V933-K1062 VanDerWaalsContact N-O 3.07Å; V933-L1064 HydrophobicContact CG2-CD1 3.78Å; V933-L1064 HydrophobicContact CG2-CG 4.46Å
934	S	86.4	Confident	88.5	Confident	9 Å²	9	34.3 Å²	34.3	6%	0.063	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-33.3	-172.8	55.8	0	0	0	0	113.6	V943 Y1009	S934-V943 PolarHBondContact N-O 3.34Å; S934-V943 WeakPolarHBondContact OG-CG1 3.29Å; S934-V943 PolarHBondContact OG-O 3.42Å; S934-Y1009 WeakPolarHBondContact CB-O 3.47Å; S934-Y1009 PolarHBondContact OG-O 3.06Å
935	V	86.6	Confident	89	Confident	26 Å²	26	27.5 Å²	27.5	16%	0.158	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	139.5	179.4	178	0	0	0	0	109	F942 V943 Y1009 K1011 E1060	V935-F942 CarbonylContact O-C 3.55Å; V935-F942 WeakPolarHBondContact O-CA 3.42Å; V935-F942 WeakPolarHBondContact O-CB 3.27Å; V935-V943 PolarHBondContact O-N 2.87Å; V935-Y1009 WeakPolarHBondContact CG2-O 3.47Å; V935-K1011 HydrophobicContact CG2-CG 3.68Å; V935-E1060 WeakPolarHBondContact CA-OE1 3.32Å
936	A	91.2	Very high	88.8	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.008	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	117.1	172.8	0	0	0	0	0	112.8	V933 F942 F1055 R1056 V1059 E1060	V933-A936 HydrophobicContact CG1-CB 4.26Å; A936-F942 HydrophobicContact CB-CB 3.78Å; A936-F1055 HydrophobicContact CB-CD1 4.28Å; A936-F1055 HydrophobicContact CB-CE1 3.96Å; A936-R1056 HydrophobicContact CB-CG 4.39Å; A936-R1056 WeakPolarHBondContact O-CD 3.1Å; A936-R1056 WeakPolarHBondContact O-CG 3.28Å; A936-R1056 PolarHBondContact O-NE 2.83Å; A936-V1059 HydrophobicContact CB-CG2 3.59Å; A936-E1060 HydrophobicContact CB-CB 4.04Å; A936-E1060 PolarHBondContact N-OE1 3.2Å
937	C	84.4	Confident	88.6	Confident	53 Å²	53	23 Å²	23	36%	0.358	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-55.7	175.5	-55.2	0	0	0	0	110.7	H941 R1056	C937-H941 WeakPolarHBondContact CB-O 3.47Å; C937-H941 PolarHBondContact N-O 2.99Å; C937-H941 VanDerWaalsContact N-O 3.11Å; C937-H941 PolarHBondContact SG-ND1 2.74Å; C937-H941 VanDerWaalsContact SG-ND1 3.39Å; C937-R1056 PolarHBondContact O-NH2 2.82Å
938	H	90.6	Very high	88.2	Confident	64 Å²	64	25.9 Å²	25.9	30%	0.296	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	167.7	-175.2	58	37.8	0	0	0	109.2	G940 H941 W1047 S1052	H938-G940 PolarHBondContact ND1-N 3.3Å; H938-G940 PolarHBondContact O-N 3.3Å; H938-H941 VanDerWaalsContact CE1-CB 3.4Å; H938-H941 WeakPolarHBondContact CE1-CB 3.46Å; H938-H941 PolarHBondContact CE1-N 2.89Å; H938-H941 PolarHBondContact N-O 3.44Å; H938-H941 PolarHBondContact ND1-N 2.85Å; H938-H941 VanDerWaalsContact ND1-N 3.16Å; H938-H941 CarbonylContact O-C 3.5Å; H938-H941 VanDerWaalsContact O-C 3.32Å; H938-H941 PolarHBondContact O-N 2.77Å; H938-W1047 HydrophobicContact CB-CB 4.05Å; H938-W1047 HydrophobicContact CB-CG 4.01Å; H938-W1047 AromaticContact CD2-CD1 3.89Å; H938-W1047 AromaticContact CG-CD1 3.58Å; H938-W1047 AromaticContact ND1-CD1 3.69Å; H938-S1052 WeakPolarHBondContact CB-OG 3.31Å
939	P	91.4	Very high	87.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.6	-174.5	-23.2	29.5	0	0	0	115.4	H941 F942 Q1038 L1039 W1047 F1055 M1102	P939-H941 VanDerWaalsContact C-N 3.35Å; P939-H941 PolarHBondContact O-N 3.04Å; P939-F942 WeakPolarHBondContact O-CE1 3.4Å; P939-Q1038 CarbonylContact O-C 3.49Å; P939-Q1038 WeakPolarHBondContact O-CA 3.42Å; P939-L1039 HydrophobicContact CB-CB 3.99Å; P939-L1039 HydrophobicContact CB-CD2 4.12Å; P939-L1039 PolarHBondContact O-N 3.34Å; P939-W1047 HydrophobicContact CB-CD2 4.24Å; P939-W1047 HydrophobicContact CB-CE3 4.29Å; P939-W1047 HydrophobicContact CB-CH2 3.75Å; P939-W1047 HydrophobicContact CB-CZ2 3.68Å; P939-W1047 HydrophobicContact CB-CZ3 4.06Å; P939-W1047 HydrophobicContact CG-CD2 3.94Å; P939-W1047 HydrophobicContact CG-CE3 3.73Å; P939-W1047 HydrophobicContact CG-CH2 4Å; P939-W1047 HydrophobicContact CG-CZ2 4.2Å; P939-W1047 HydrophobicContact CG-CZ3 3.76Å; P939-F1055 HydrophobicContact CB-CD2 4.1Å; P939-F1055 HydrophobicContact CB-CE2 4.29Å; P939-F1055 HydrophobicContact CB-CG 4.23Å; P939-F1055 HydrophobicContact CG-CB 3.76Å; P939-F1055 HydrophobicContact CG-CD1 4.14Å; P939-F1055 HydrophobicContact CG-CD2 3.78Å; P939-F1055 HydrophobicContact CG-CE2 4.44Å; P939-F1055 HydrophobicContact CG-CG 3.6Å; P939-M1102 HydrophobicContact CG-CE 3.86Å; P939-M1102 HydrophobicContact CG-CG 4.31Å; P939-M1102 HydrophobicContact CG-SD 4.37Å
940	G	89.7	Confident	86.8	Confident	10 Å²	10	26 Å²	26	10%	0.103	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-8.3	174.9	0	0	0	0	0	116.5	H938 K1081	H938-G940 PolarHBondContact ND1-N 3.3Å; H938-G940 PolarHBondContact O-N 3.3Å; G940-K1081 PolarHBondContact O-NZ 2.65Å
941	H	90.9	Very high	85.3	Confident	53 Å²	53	32.8 Å²	32.8	25%	0.245	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	109	-175.7	-177.1	-108.3	0	0	0	112.2	C937 H938 P939 H1036 A1037	C937-H941 WeakPolarHBondContact CB-O 3.47Å; C937-H941 PolarHBondContact N-O 2.99Å; C937-H941 VanDerWaalsContact N-O 3.11Å; C937-H941 PolarHBondContact SG-ND1 2.74Å; C937-H941 VanDerWaalsContact SG-ND1 3.39Å; H938-H941 VanDerWaalsContact CE1-CB 3.4Å; H938-H941 WeakPolarHBondContact CE1-CB 3.46Å; H938-H941 PolarHBondContact CE1-N 2.89Å; H938-H941 PolarHBondContact N-O 3.44Å; H938-H941 PolarHBondContact ND1-N 2.85Å; H938-H941 VanDerWaalsContact ND1-N 3.16Å; H938-H941 CarbonylContact O-C 3.5Å; H938-H941 VanDerWaalsContact O-C 3.32Å; H938-H941 PolarHBondContact O-N 2.77Å; P939-H941 VanDerWaalsContact C-N 3.35Å; P939-H941 PolarHBondContact O-N 3.04Å; H941-H1036 AromaticContact NE2-CE1 3.73Å; H941-H1036 AromaticContact NE2-ND1 3.93Å; H941-H1036 AromaticContact NE2-NE2 3.81Å; H941-A1037 WeakPolarHBondContact CA-O 3.33Å
942	F	95.2	Very high	84.6	Confident	1 Å²	1	36.3 Å²	36.3	0%	0.004	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	171.9	169.6	53.2	-87	0	0	0	109.6	V933 V935 A936 P939 L944 A1037 Q1038 L1039 F1055 V1084 L1086	V933-F942 HydrophobicContact CG1-CB 4.19Å; V933-F942 HydrophobicContact CG1-CD2 4.12Å; V935-F942 CarbonylContact O-C 3.55Å; V935-F942 WeakPolarHBondContact O-CA 3.42Å; V935-F942 WeakPolarHBondContact O-CB 3.27Å; A936-F942 HydrophobicContact CB-CB 3.78Å; P939-F942 WeakPolarHBondContact O-CE1 3.4Å; F942-L944 HydrophobicContact CD2-CD2 3.84Å; F942-L944 HydrophobicContact CD2-CG 4.12Å; F942-L944 HydrophobicContact CE2-CD1 4.2Å; F942-L944 HydrophobicContact CE2-CD2 3.77Å; F942-L944 HydrophobicContact CE2-CG 3.98Å; F942-A1037 HydrophobicContact CD2-CB 3.71Å; F942-A1037 HydrophobicContact CE1-CB 4.42Å; F942-A1037 HydrophobicContact CE2-CB 3.3Å; F942-A1037 HydrophobicContact CG-CB 4.41Å; F942-A1037 HydrophobicContact CZ-CB 3.72Å; F942-A1037 PolarHBondContact N-O 2.85Å; F942-A1037 PolarHBondContact O-N 2.91Å; F942-Q1038 VanDerWaalsContact CE1-CA 3.49Å; F942-L1039 HydrophobicContact CE1-CB 4.16Å; F942-F1055 HydrophobicContact CB-CE1 4.11Å; F942-F1055 AromaticContact CD1-CE1 3.5Å; F942-F1055 HydrophobicContact CD1-CE1 3.5Å; F942-F1055 AromaticContact CD1-CZ 3.33Å; F942-F1055 HydrophobicContact CD1-CZ 3.33Å; F942-F1055 HydrophobicContact CE1-CE1 4.13Å; F942-F1055 HydrophobicContact CE1-CE2 4.43Å; F942-F1055 AromaticContact CE1-CZ 3.49Å; F942-F1055 HydrophobicContact CE1-CZ 3.49Å; F942-F1055 VanDerWaalsContact CE1-CZ 3.49Å; F942-F1055 HydrophobicContact CG-CE1 4.02Å; F942-F1055 AromaticContact CG-CZ 3.96Å; F942-F1055 HydrophobicContact CG-CZ 3.96Å; F942-F1055 HydrophobicContact CZ-CZ 4.26Å; F942-V1084 HydrophobicContact CE2-CG2 4.05Å; F942-V1084 HydrophobicContact CZ-CG2 3.86Å; F942-L1086 HydrophobicContact CD2-CD1 4.37Å; F942-L1086 HydrophobicContact CE1-CD1 4.49Å; F942-L1086 HydrophobicContact CE2-CD1 3.69Å; F942-L1086 HydrophobicContact CE2-CD2 4.37Å; F942-L1086 HydrophobicContact CE2-CG 4.26Å; F942-L1086 HydrophobicContact CZ-CD1 3.75Å; F942-L1086 HydrophobicContact CZ-CG 4.22Å
943	V	94.8	Very high	84	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.4	-174.1	-174.3	0	0	0	0	110.5	V933 S934 V935 I1035	V933-V943 CarbonylContact C-O 3.44Å; V933-V943 WeakPolarHBondContact CA-O 3.25Å; V933-V943 WeakPolarHBondContact CG1-O 3.42Å; S934-V943 PolarHBondContact N-O 3.34Å; S934-V943 WeakPolarHBondContact OG-CG1 3.29Å; S934-V943 PolarHBondContact OG-O 3.42Å; V935-V943 PolarHBondContact O-N 2.87Å; V943-I1035 CarbonylContact C-O 3.6Å; V943-I1035 VanDerWaalsContact CA-O 3.31Å; V943-I1035 WeakPolarHBondContact CA-O 3.37Å
944	L	93.9	Very high	82.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	143.2	178.9	-60.9	-179.8	0	0	0	111	M929 V931 Y932 V933 F942 Q1033 I1035 A1037 A1066 V1084 L1086	M929-L944 HydrophobicContact CE-CD1 4.17Å; V931-L944 HydrophobicContact CB-CD2 4.23Å; V931-L944 HydrophobicContact CG1-CB 4.43Å; V931-L944 HydrophobicContact CG1-CD1 4.38Å; V931-L944 HydrophobicContact CG2-CD2 3.99Å; Y932-L944 CarbonylContact O-C 3.55Å; Y932-L944 WeakPolarHBondContact O-CA 3.44Å; V933-L944 HydrophobicContact CB-CD2 4.4Å; V933-L944 HydrophobicContact CG1-CD2 4.43Å; V933-L944 HydrophobicContact CG2-CD2 3.76Å; F942-L944 HydrophobicContact CD2-CD2 3.84Å; F942-L944 HydrophobicContact CD2-CG 4.12Å; F942-L944 HydrophobicContact CE2-CD1 4.2Å; F942-L944 HydrophobicContact CE2-CD2 3.77Å; F942-L944 HydrophobicContact CE2-CG 3.98Å; L944-Q1033 VanDerWaalsContact O-O 3.11Å; L944-I1035 HydrophobicContact CB-CD1 4.49Å; L944-I1035 PolarHBondContact N-O 2.91Å; L944-I1035 PolarHBondContact O-N 3.46Å; L944-A1037 HydrophobicContact CD1-CB 3.69Å; L944-A1037 HydrophobicContact CG-CB 3.83Å; L944-A1066 HydrophobicContact CD1-CB 4.36Å; L944-V1084 HydrophobicContact CD1-CG1 4.32Å; L944-V1084 HydrophobicContact CD1-CG2 4.05Å; L944-L1086 HydrophobicContact CD2-CD2 4.33Å
945	Q	91.7	Very high	81.8	Confident	7 Å²	7	42.3 Å²	42.3	3%	0.033	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.9	168	-64.2	179.9	-45.6	0	0	109.7	V931 Y932 W947 D1008 Y1009 Q1033	V931-Q945 CarbonylContact C-O 3.4Å; V931-Q945 VanDerWaalsContact CA-O 3.29Å; V931-Q945 WeakPolarHBondContact CA-O 3.48Å; Y932-Q945 PolarHBondContact N-O 2.76Å; Y932-Q945 PolarHBondContact O-N 2.81Å; Q945-W947 PolarHBondContact O-N 3.22Å; Q945-D1008 PolarHBondContact NE2-O 2.93Å; Q945-Y1009 VanDerWaalsContact NE2-CD1 3.25Å; Q945-Q1033 WeakPolarHBondContact CA-O 3.5Å
946	P	84.9	Confident	81.6	Confident	19 Å²	19	41.7 Å²	41.7	12%	0.123	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	119.8	174.8	-19.2	31.5	0	0	0	111.3	L920 R948 D949 M950 Q1033 I1035	L920-P946 HydrophobicContact CD1-CG 4.05Å; L920-P946 HydrophobicContact CD2-CG 3.51Å; L920-P946 HydrophobicContact CG-CG 4.32Å; P946-R948 PolarHBondContact O-N 3.47Å; P946-R948 VanDerWaalsContact O-N 3.13Å; P946-D949 PolarHBondContact O-N 2.96Å; P946-M950 PolarHBondContact O-N 3.2Å; P946-Q1033 WeakPolarHBondContact CD-O 3.2Å; P946-I1035 HydrophobicContact CG-CD1 4.37Å
947	W	75.5	Confident	80.9	Confident	36 Å²	36	42.9 Å²	42.9	14%	0.136	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-56	-37.2	-177	-173.4	-105.1	0	0	0	112.8	L115 D930 Y932 Q945 D949 M950 P1063	L115-W947 HydrophobicContact CD2-CH2 4.09Å; L115-W947 HydrophobicContact CD2-CZ3 4.08Å; L115-W947 WeakPolarHBondContact O-CH2 3.41Å; D930-W947 HydrophobicContact CB-CB 3.56Å; D930-W947 HydrophobicContact CB-CG 4.1Å; D930-W947 VanDerWaalsContact O-CB 3.26Å; D930-W947 WeakPolarHBondContact O-CB 3.46Å; D930-W947 PolarHBondContact O-N 2.81Å; Y932-W947 HydrophobicContact CD2-CZ3 4.03Å; Y932-W947 HydrophobicContact CG-CZ3 4.47Å; Q945-W947 PolarHBondContact O-N 3.22Å; W947-D949 VanDerWaalsContact C-N 3.29Å; W947-D949 PolarHBondContact O-N 3.24Å; W947-M950 HydrophobicContact CD2-CE 4.34Å; W947-M950 HydrophobicContact CE3-CE 4Å; W947-M950 HydrophobicContact CE3-SD 4.42Å; W947-M950 HydrophobicContact CH2-CE 3.8Å; W947-M950 HydrophobicContact CZ2-CE 4.18Å; W947-M950 HydrophobicContact CZ3-CE 3.69Å; W947-M950 HydrophobicContact CZ3-SD 4.22Å; W947-P1063 HydrophobicContact CE3-CB 4.08Å; W947-P1063 HydrophobicContact CH2-CB 3.92Å; W947-P1063 HydrophobicContact CZ3-CB 3.66Å
948	R	75.2	Confident	80.1	Confident	166 Å²	166	41.9 Å²	41.9	63%	0.626	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-65.8	-27.2	-178.4	-62.9	-177	-176.1	-179.3	2	113.6	D930 P946 Y951	D930-R948 IonicContact OD2-NE 2.69Å; P946-R948 PolarHBondContact O-N 3.47Å; P946-R948 VanDerWaalsContact O-N 3.13Å; R948-Y951 WeakPolarHBondContact O-CD1 3.34Å; R948-Y951 WeakPolarHBondContact O-CE1 3.42Å
949	D	75.3	Confident	79.3	Confident	29 Å²	29	43.4 Å²	43.4	16%	0.155	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-104.3	-3.5	-174.4	-81.5	21	0	0	0	113.2	P946 W947 Y951 K952 L953 Q1033	P946-D949 PolarHBondContact O-N 2.96Å; W947-D949 VanDerWaalsContact C-N 3.29Å; W947-D949 PolarHBondContact O-N 3.24Å; D949-Y951 PolarHBondContact O-N 3.48Å; D949-Y951 VanDerWaalsContact O-N 3.16Å; D949-K952 HydrophobicContact CB-CD 4.14Å; D949-K952 WeakPolarHBondContact O-CA 3.27Å; D949-K952 VanDerWaalsContact O-CB 3.29Å; D949-K952 WeakPolarHBondContact O-CB 3.43Å; D949-K952 PolarHBondContact O-N 3.49Å; D949-K952 VanDerWaalsContact OD1-CE 3.28Å; D949-K952 WeakPolarHBondContact OD1-CE 3.44Å; D949-K952 IonicContact OD1-NZ 2.87Å; D949-K952 PolarHBondContact OD1-NZ 2.95Å; D949-K952 IonicContact OD2-NZ 2.73Å; D949-K952 PolarHBondContact OD2-NZ 3.12Å; D949-L953 PolarHBondContact O-N 2.77Å; D949-L953 VanDerWaalsContact O-N 3.16Å; D949-Q1033 VanDerWaalsContact CB-OE1 3.22Å
950	M	69.8	Low	78.8	Confident	37 Å²	37	43.4 Å²	43.4	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-52.5	-38.7	177.6	-172.1	169.8	65.5	0	0	113	P946 W947 K952 L953 V954	P946-M950 PolarHBondContact O-N 3.2Å; W947-M950 HydrophobicContact CD2-CE 4.34Å; W947-M950 HydrophobicContact CE3-CE 4Å; W947-M950 HydrophobicContact CE3-SD 4.42Å; W947-M950 HydrophobicContact CH2-CE 3.8Å; W947-M950 HydrophobicContact CZ2-CE 4.18Å; W947-M950 HydrophobicContact CZ3-CE 3.69Å; W947-M950 HydrophobicContact CZ3-SD 4.22Å; M950-K952 VanDerWaalsContact C-N 3.32Å; M950-K952 PolarHBondContact O-N 3.03Å; M950-L953 WeakPolarHBondContact O-CB 3.29Å; M950-L953 PolarHBondContact O-N 2.87Å; M950-V954 WeakPolarHBondContact O-CG2 3.5Å; M950-V954 PolarHBondContact O-N 3.17Å; M950-V954 VanDerWaalsContact O-N 3.11Å
951	Y	55.9	Low	78.3	Confident	151 Å²	151	45.5 Å²	45.5	59%	0.592	22%	0.221	S	C	*	.	H	α-helix	trans	-66.2	-32.3	176.1	79	-91	0	0	0	113	R948 D949 L953 V954 V955	R948-Y951 WeakPolarHBondContact O-CD1 3.34Å; R948-Y951 WeakPolarHBondContact O-CE1 3.42Å; D949-Y951 PolarHBondContact O-N 3.48Å; D949-Y951 VanDerWaalsContact O-N 3.16Å; Y951-L953 VanDerWaalsContact C-N 3.34Å; Y951-V954 PolarHBondContact O-N 3.44Å; Y951-V955 WeakPolarHBondContact O-CG2 3.37Å; Y951-V955 PolarHBondContact O-N 2.82Å; Y951-V955 VanDerWaalsContact O-N 3.1Å
952	K	71.6	Confident	77.6	Confident	73 Å²	73	48.9 Å²	48.9	32%	0.317	24%	0.241	S	C	.	.	H	α-helix	trans	-70.2	-35	176.4	-52.7	175.1	-173.9	163.2	0	110.7	D949 M950 V955 L956 L1030	D949-K952 HydrophobicContact CB-CD 4.14Å; D949-K952 WeakPolarHBondContact O-CA 3.27Å; D949-K952 VanDerWaalsContact O-CB 3.29Å; D949-K952 WeakPolarHBondContact O-CB 3.43Å; D949-K952 PolarHBondContact O-N 3.49Å; D949-K952 VanDerWaalsContact OD1-CE 3.28Å; D949-K952 WeakPolarHBondContact OD1-CE 3.44Å; D949-K952 IonicContact OD1-NZ 2.87Å; D949-K952 PolarHBondContact OD1-NZ 2.95Å; D949-K952 IonicContact OD2-NZ 2.73Å; D949-K952 PolarHBondContact OD2-NZ 3.12Å; M950-K952 VanDerWaalsContact C-N 3.32Å; M950-K952 PolarHBondContact O-N 3.03Å; K952-V955 PolarHBondContact O-N 3Å; K952-L956 WeakPolarHBondContact O-CB 3.49Å; K952-L956 PolarHBondContact O-N 3.4Å; K952-L1030 HydrophobicContact CB-CD1 3.61Å; K952-L1030 HydrophobicContact CB-CD2 4.06Å; K952-L1030 HydrophobicContact CD-CD1 3.7Å; K952-L1030 HydrophobicContact CG-CD1 4.32Å
953	L	76.8	Confident	76.7	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-44.2	173.9	-177.6	58.9	0	0	0	111.6	D949 M950 Y951 V955 L956 M957 D1008 Y1009 L1030 Q1033	D949-L953 PolarHBondContact O-N 2.77Å; D949-L953 VanDerWaalsContact O-N 3.16Å; M950-L953 WeakPolarHBondContact O-CB 3.29Å; M950-L953 PolarHBondContact O-N 2.87Å; Y951-L953 VanDerWaalsContact C-N 3.34Å; L953-V955 PolarHBondContact O-N 2.95Å; L953-L956 HydrophobicContact CD1-CD2 4.34Å; L953-L956 WeakPolarHBondContact O-CB 3.25Å; L953-L956 PolarHBondContact O-N 3.32Å; L953-M957 HydrophobicContact CG-SD 4.48Å; L953-M957 WeakPolarHBondContact O-CG 3.17Å; L953-M957 PolarHBondContact O-N 2.98Å; L953-D1008 HydrophobicContact CD1-CB 3.72Å; L953-D1008 HydrophobicContact CD2-CB 4.05Å; L953-Y1009 HydrophobicContact CD2-CE1 4.29Å; L953-Y1009 HydrophobicContact CD2-CE2 4.08Å; L953-L1030 HydrophobicContact CB-CD2 4.28Å; L953-L1030 HydrophobicContact CD1-CD2 4.49Å; L953-Q1033 HydrophobicContact CB-CG 4.24Å; L953-Q1033 HydrophobicContact CD1-CG 4.16Å; L953-Q1033 HydrophobicContact CD2-CB 4.09Å; L953-Q1033 HydrophobicContact CD2-CG 4.18Å; L953-Q1033 HydrophobicContact CG-CG 4.43Å
954	V	67.9	Low	76.1	Confident	77 Å²	77	51 Å²	51	47%	0.467	25%	0.254	S	S	.	.	H	α-helix	trans	-59.7	-46.1	175.1	173.8	0	0	0	0	111.3	M950 Y951 L956 M957 G958	M950-V954 WeakPolarHBondContact O-CG2 3.5Å; M950-V954 PolarHBondContact O-N 3.17Å; M950-V954 VanDerWaalsContact O-N 3.11Å; Y951-V954 PolarHBondContact O-N 3.44Å; V954-L956 PolarHBondContact O-N 3.47Å; V954-M957 PolarHBondContact O-N 3.02Å; V954-G958 PolarHBondContact O-N 2.94Å
955	V	65	Low	75.2	Confident	83 Å²	83	54.7 Å²	54.7	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-59.6	-46.2	174.8	171.6	0	0	0	0	111.2	Y951 K952 L953 M957 G958 E959	Y951-V955 WeakPolarHBondContact O-CG2 3.37Å; Y951-V955 PolarHBondContact O-N 2.82Å; Y951-V955 VanDerWaalsContact O-N 3.1Å; K952-V955 PolarHBondContact O-N 3Å; L953-V955 PolarHBondContact O-N 2.95Å; V955-M957 PolarHBondContact O-N 2.77Å; V955-G958 PolarHBondContact O-N 2.87Å; V955-E959 PolarHBondContact O-N 3.45Å
956	L	81.3	Confident	73.9	Confident	13 Å²	13	62.9 Å²	62.9	7%	0.068	32%	0.315	C	S	.	.	H	α-helix	trans	-57.7	-45.7	177.8	180	72.7	0	0	0	112.1	K952 L953 V954 E959 M960 R990 F1027 L1030	K952-L956 WeakPolarHBondContact O-CB 3.49Å; K952-L956 PolarHBondContact O-N 3.4Å; L953-L956 HydrophobicContact CD1-CD2 4.34Å; L953-L956 WeakPolarHBondContact O-CB 3.25Å; L953-L956 PolarHBondContact O-N 3.32Å; V954-L956 PolarHBondContact O-N 3.47Å; L956-E959 PolarHBondContact O-N 3.09Å; L956-M960 HydrophobicContact CG-SD 4.21Å; L956-M960 WeakPolarHBondContact O-CB 3.31Å; L956-M960 WeakPolarHBondContact O-CG 3.28Å; L956-M960 PolarHBondContact O-N 3.5Å; L956-R990 VanDerWaalsContact CD2-CZ 3.41Å; L956-F1027 HydrophobicContact CD1-CB 4.06Å; L956-F1027 HydrophobicContact CD1-CD1 3.75Å; L956-F1027 HydrophobicContact CD1-CG 4.35Å; L956-L1030 HydrophobicContact CB-CD2 4.4Å; L956-L1030 HydrophobicContact CD2-CB 4.24Å; L956-L1030 HydrophobicContact CD2-CD2 3.96Å
957	M	77.4	Confident	73.1	Confident	26 Å²	26	65.3 Å²	65.3	13%	0.128	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-43.6	177.2	-72.3	-179.9	72.2	0	0	111.6	L953 V954 V955 E959 M960 I961 N987 Y1009	L953-M957 HydrophobicContact CG-SD 4.48Å; L953-M957 WeakPolarHBondContact O-CG 3.17Å; L953-M957 PolarHBondContact O-N 2.98Å; V954-M957 PolarHBondContact O-N 3.02Å; V955-M957 PolarHBondContact O-N 2.77Å; M957-E959 PolarHBondContact O-N 2.72Å; M957-M960 PolarHBondContact O-N 2.97Å; M957-I961 VanDerWaalsContact O-CG1 3.29Å; M957-I961 WeakPolarHBondContact O-CG1 3.4Å; M957-I961 PolarHBondContact O-N 3.05Å; M957-N987 HydrophobicContact CE-CB 4.21Å; M957-Y1009 HydrophobicContact CE-CE2 4.31Å; M957-Y1009 HydrophobicContact SD-CE2 3.76Å; M957-Y1009 PolarHBondContact SD-OH 3.48Å
958	G	67.5	Low	72.4	Confident	32 Å²	32	71.2 Å²	71.2	33%	0.33	36%	0.359	S	S	.	.	H	α-helix	trans	-57.6	-45.2	174.2	0	0	0	0	0	112.8	V954 V955 I961 L962	V954-G958 PolarHBondContact O-N 2.94Å; V955-G958 PolarHBondContact O-N 2.87Å; G958-I961 PolarHBondContact O-N 2.93Å; G958-L962 WeakPolarHBondContact O-CG 3.47Å; G958-L962 PolarHBondContact O-N 3.31Å
959	E	73.7	Confident	72	Confident	95 Å²	95	69.6 Å²	69.6	44%	0.444	36%	0.358	S	S	.	.	H	α-helix	trans	-67	-36.3	175	-65.8	-166.3	160.9	0	0	113.2	V955 L956 M957 L962 S963 F1027	V955-E959 PolarHBondContact O-N 3.45Å; L956-E959 PolarHBondContact O-N 3.09Å; M957-E959 PolarHBondContact O-N 2.72Å; E959-L962 PolarHBondContact O-N 3.48Å; E959-S963 VanDerWaalsContact O-CB 3.24Å; E959-S963 WeakPolarHBondContact O-CB 3.27Å; E959-S963 PolarHBondContact O-N 3.32Å; E959-F1027 HydrophobicContact CB-CE1 3.7Å; E959-F1027 HydrophobicContact CB-CZ 4.4Å; E959-F1027 WeakPolarHBondContact O-CZ 3.49Å
960	M	81	Confident	71.3	Confident	1 Å²	1	76 Å²	76	1%	0.005	39%	0.385	C	S	.	.	H	α-helix	trans	-63	-45	174.7	-77.6	-177.9	60.7	0	0	110.9	L956 M957 S963 Y964 A981 W988 R990 L1023 F1027	L956-M960 HydrophobicContact CG-SD 4.21Å; L956-M960 WeakPolarHBondContact O-CB 3.31Å; L956-M960 WeakPolarHBondContact O-CG 3.28Å; L956-M960 PolarHBondContact O-N 3.5Å; M957-M960 PolarHBondContact O-N 2.97Å; M960-S963 PolarHBondContact O-N 2.82Å; M960-Y964 HydrophobicContact CB-CD2 4.23Å; M960-Y964 HydrophobicContact CE-CE2 4.14Å; M960-Y964 HydrophobicContact CG-CE2 4.31Å; M960-Y964 WeakPolarHBondContact O-CB 3.41Å; M960-Y964 WeakPolarHBondContact O-CD2 3.35Å; M960-Y964 PolarHBondContact O-N 2.79Å; M960-A981 HydrophobicContact CE-CB 3.74Å; M960-W988 HydrophobicContact CB-CB 3.92Å; M960-W988 HydrophobicContact CE-CB 4.27Å; M960-R990 HydrophobicContact CE-CG 3.9Å; M960-R990 HydrophobicContact SD-CG 3.7Å; M960-L1023 HydrophobicContact CE-CD1 4.15Å; M960-F1027 HydrophobicContact CB-CE1 4.48Å; M960-F1027 HydrophobicContact CB-CE2 4.45Å; M960-F1027 HydrophobicContact CB-CZ 4.31Å; M960-F1027 HydrophobicContact CG-CB 4.16Å; M960-F1027 HydrophobicContact CG-CD1 3.55Å; M960-F1027 HydrophobicContact CG-CD2 3.63Å; M960-F1027 HydrophobicContact CG-CE1 3.7Å; M960-F1027 HydrophobicContact CG-CE2 3.77Å; M960-F1027 HydrophobicContact CG-CG 3.5Å; M960-F1027 VanDerWaalsContact CG-CG 3.5Å; M960-F1027 HydrophobicContact CG-CZ 3.78Å; M960-F1027 HydrophobicContact SD-CB 4.1Å; M960-F1027 HydrophobicContact SD-CD1 4.48Å; M960-F1027 HydrophobicContact SD-CD2 4.43Å; M960-F1027 HydrophobicContact SD-CG 4.1Å
961	I	79.8	Confident	71	Confident	53 Å²	53	80.7 Å²	80.7	27%	0.272	42%	0.418	S	S	.	.	H	α-helix	trans	-58.3	-51.5	174.4	-67.4	161.3	0	0	0	110.7	M957 G958 S963 S965 N987 W988	M957-I961 VanDerWaalsContact O-CG1 3.29Å; M957-I961 WeakPolarHBondContact O-CG1 3.4Å; M957-I961 PolarHBondContact O-N 3.05Å; G958-I961 PolarHBondContact O-N 2.93Å; I961-S963 PolarHBondContact O-N 3.04Å; I961-S965 WeakPolarHBondContact O-CB 3.3Å; I961-S965 PolarHBondContact O-N 3.34Å; I961-S965 VanDerWaalsContact O-N 3.11Å; I961-S965 PolarHBondContact O-OG 3.32Å; I961-N987 WeakPolarHBondContact CD1-OD1 3.48Å; I961-W988 HydrophobicContact CG1-CB 4.44Å
962	L	74.8	Confident	72.1	Confident	124 Å²	124	76.8 Å²	76.8	65%	0.649	40%	0.404	S	S	*	.	H	α-helix	trans	-61.8	-31.3	-179.8	-71.7	172.6	0	0	0	113.3	G958 E959	G958-L962 WeakPolarHBondContact O-CG 3.47Å; G958-L962 PolarHBondContact O-N 3.31Å; E959-L962 PolarHBondContact O-N 3.48Å
963	S	77.8	Confident	72.6	Confident	32 Å²	32	81.2 Å²	81.2	22%	0.224	42%	0.423	C	S	.	.	H	α-helix	trans	-85.4	-46.4	-177.5	-163.1	0	0	0	0	113.4	E959 M960 I961 T967 K1026	E959-S963 VanDerWaalsContact O-CB 3.24Å; E959-S963 WeakPolarHBondContact O-CB 3.27Å; E959-S963 PolarHBondContact O-N 3.32Å; M960-S963 PolarHBondContact O-N 2.82Å; I961-S963 PolarHBondContact O-N 3.04Å; S963-T967 PolarHBondContact O-OG1 3.1Å; S963-K1026 VanDerWaalsContact CB-NZ 3.34Å; S963-K1026 WeakPolarHBondContact OG-CE 3.33Å; S963-K1026 PolarHBondContact OG-NZ 2.76Å
964	Y	81.9	Confident	73.2	Confident	14 Å²	14	82 Å²	82	6%	0.055	43%	0.428	C	S	.	.	H	α-helix	trans	-83.6	-27.8	-173.7	-73	-67.6	0	0	0	113	M960 K966 T967 A981 W988 R1021 T1022 L1023 S1024 F1027	M960-Y964 HydrophobicContact CB-CD2 4.23Å; M960-Y964 HydrophobicContact CE-CE2 4.14Å; M960-Y964 HydrophobicContact CG-CE2 4.31Å; M960-Y964 WeakPolarHBondContact O-CB 3.41Å; M960-Y964 WeakPolarHBondContact O-CD2 3.35Å; M960-Y964 PolarHBondContact O-N 2.79Å; Y964-K966 PolarHBondContact O-N 2.65Å; Y964-K966 VanDerWaalsContact O-N 3.11Å; Y964-T967 PolarHBondContact O-N 3.15Å; Y964-T967 VanDerWaalsContact O-N 3.09Å; Y964-A981 HydrophobicContact CD2-CB 4.08Å; Y964-A981 HydrophobicContact CE1-CB 4.24Å; Y964-A981 HydrophobicContact CE2-CB 3.49Å; Y964-A981 VanDerWaalsContact CE2-CB 3.49Å; Y964-W988 HydrophobicContact CD2-CD2 4.24Å; Y964-W988 HydrophobicContact CD2-CE3 4.23Å; Y964-W988 HydrophobicContact CD2-CG 4.43Å; Y964-W988 HydrophobicContact CG-CD2 4.11Å; Y964-W988 HydrophobicContact CG-CE3 4.11Å; Y964-W988 HydrophobicContact CG-CZ3 4.39Å; Y964-R1021 HydrophobicContact CD1-CB 3.8Å; Y964-R1021 HydrophobicContact CD1-CG 3.95Å; Y964-R1021 HydrophobicContact CE1-CB 3.66Å; Y964-R1021 HydrophobicContact CE1-CG 4.33Å; Y964-T1022 PolarHBondContact OH-O 2.74Å; Y964-L1023 WeakPolarHBondContact OH-CA 3.37Å; Y964-S1024 PolarHBondContact OH-N 2.89Å; Y964-F1027 AromaticContact CD2-CE2 3.99Å; Y964-F1027 HydrophobicContact CD2-CE2 3.99Å; Y964-F1027 AromaticContact CE2-CD2 3.53Å; Y964-F1027 HydrophobicContact CE2-CD2 3.53Å; Y964-F1027 AromaticContact CE2-CE2 3.36Å; Y964-F1027 HydrophobicContact CE2-CE2 3.36Å; Y964-F1027 HydrophobicContact CE2-CZ 4.49Å; Y964-F1027 AromaticContact CZ-CE2 3.97Å
965	S	74.9	Confident	74.1	Confident	77 Å²	77	82.9 Å²	82.9	54%	0.538	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-11	178.2	-51.9	0	0	0	0	114.2	I961	I961-S965 WeakPolarHBondContact O-CB 3.3Å; I961-S965 PolarHBondContact O-N 3.34Å; I961-S965 VanDerWaalsContact O-N 3.11Å; I961-S965 PolarHBondContact O-OG 3.32Å
966	K	65	Low	75.2	Confident	179 Å²	179	85.2 Å²	85.2	78%	0.778	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	4.4	175.8	-59	-176.2	-178.9	-176.2	0	113.5	Y964	Y964-K966 PolarHBondContact O-N 2.65Å; Y964-K966 VanDerWaalsContact O-N 3.11Å
967	T	66.6	Low	75.5	Confident	71 Å²	71	89.1 Å²	89.1	44%	0.436	45%	0.452	S	S	.	.			trans	-100.8	122.9	-173.5	-60.1	0	0	0	0	111	S963 Y964	S963-T967 PolarHBondContact O-OG1 3.1Å; Y964-T967 PolarHBondContact O-N 3.15Å; Y964-T967 VanDerWaalsContact O-N 3.09Å
968	E	62	Low	76.1	Confident	159 Å²	159	91.8 Å²	91.8	74%	0.743	46%	0.464	S	S	*	.			trans	-59.6	153.4	176.7	-66.6	179.3	164	0	0	113.6	K970	E968-K970 PolarHBondContact O-N 2.86Å
969	E	66	Low	77.3	Confident	133 Å²	133	90.6 Å²	90.6	62%	0.621	45%	0.45	S	S	*	.			trans	-75.5	104.9	178.2	-80.6	-177.9	-178.8	0	0	112	R1021	E969-R1021 IonicContact OE1-CZ 2.72Å; E969-R1021 IonicContact OE1-NH1 3.49Å; E969-R1021 IonicContact OE1-NH2 3.85Å; E969-R1021 PolarHBondContact OE1-NH2 3Å
970	K	61.7	Low	78.3	Confident	163 Å²	163	87 Å²	87	71%	0.709	43%	0.432	S	S	*	.			trans	-98.5	123	167.7	-66.1	-170.5	177.7	-175.4	0	109.3	E968 F972	E968-K970 PolarHBondContact O-N 2.86Å; K970-F972 WeakPolarHBondContact O-CD1 3.47Å; K970-F972 PolarHBondContact O-N 3.41Å
971	P	63.4	Low	78.9	Confident	136 Å²	136	86.9 Å²	86.9	88%	0.883	43%	0.432	S	S	*	.			trans	-60.9	130.4	172	-20.6	31.9	0	0	0	110.4
972	F	78.1	Confident	79.5	Confident	69 Å²	69	84.4 Å²	84.4	30%	0.303	42%	0.419	S	S	.	.			trans	-141	155	169.7	64.6	-88.8	0	0	0	109.8	K970 V974 Y980 L1020	K970-F972 WeakPolarHBondContact O-CD1 3.47Å; K970-F972 PolarHBondContact O-N 3.41Å; F972-V974 HydrophobicContact CD2-CG2 4.48Å; F972-V974 HydrophobicContact CE2-CG2 3.94Å; F972-V974 PolarHBondContact O-N 3Å; F972-Y980 AromaticContact CD2-CE1 3.97Å; F972-Y980 HydrophobicContact CD2-CE1 3.97Å; F972-Y980 AromaticContact CE2-CD1 3.67Å; F972-Y980 HydrophobicContact CE2-CD1 3.67Å; F972-Y980 AromaticContact CE2-CE1 3.35Å; F972-Y980 HydrophobicContact CE2-CE1 3.35Å; F972-Y980 HydrophobicContact CZ-CD1 4.1Å; F972-Y980 HydrophobicContact CZ-CE1 4.22Å; F972-L1020 WeakPolarHBondContact CE1-O 3.33Å; F972-L1020 HydrophobicContact CZ-CB 3.85Å
973	K	82.8	Confident	80.2	Confident	166 Å²	166	82 Å²	82	72%	0.722	40%	0.403	S	S	*	.			trans	-76.4	122.4	177.1	-169.3	-176.3	178.3	-164.4	0	109.5
974	V	88.1	Confident	80.5	Confident	20 Å²	20	81 Å²	81	12%	0.121	40%	0.395	C	S	.	.			trans	-80.5	130.4	173.8	-176.7	0	0	0	0	108.9	F972 Y980 V993 V996 V1002 L1020	F972-V974 HydrophobicContact CD2-CG2 4.48Å; F972-V974 HydrophobicContact CE2-CG2 3.94Å; F972-V974 PolarHBondContact O-N 3Å; V974-Y980 HydrophobicContact CG1-CE2 4.25Å; V974-V993 HydrophobicContact CG1-CB 4.49Å; V974-V993 HydrophobicContact CG1-CG1 4.11Å; V974-V993 HydrophobicContact CG1-CG2 3.82Å; V974-V996 HydrophobicContact CB-CG2 4.38Å; V974-V996 HydrophobicContact CG1-CG2 4.01Å; V974-V1002 HydrophobicContact CG1-CG1 4.14Å; V974-V1002 HydrophobicContact CG1-CG2 4.38Å; V974-L1020 HydrophobicContact CG1-CD1 3.82Å; V974-L1020 HydrophobicContact CG2-CD1 3.84Å
975	E	87.8	Confident	80.3	Confident	95 Å²	95	88.1 Å²	88.1	44%	0.444	43%	0.429	S	S	.	.			trans	-117.4	141.3	-179.4	-62.5	-167.7	158.2	0	0	111.4	Q978 Y980	E975-Q978 HydrophobicContact CB-CB 4.41Å; E975-Q978 HydrophobicContact CB-CG 3.94Å; E975-Y980 PolarHBondContact N-OH 3.42Å
976	K	88.3	Confident	80.2	Confident	132 Å²	132	90.2 Å²	90.2	57%	0.574	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	144	176	173.7	168.6	172.5	144	0	110.5	Q978 K994	K976-Q978 PolarHBondContact O-N 3.4Å; K976-K994 VanDerWaalsContact CD-O 3.31Å; K976-K994 WeakPolarHBondContact CD-O 3.28Å; K976-K994 WeakPolarHBondContact CE-O 3.42Å; K976-K994 PolarHBondContact NZ-O 3.2Å
977	N	86.4	Confident	80.8	Confident	95 Å²	95	85 Å²	85	51%	0.508	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	21.9	-176.1	-55.5	-12.9	0	0	0	114.4	V993	N977-V993 WeakPolarHBondContact CA-O 3.31Å; N977-V993 PolarHBondContact N-O 3.2Å
978	Q	90.5	Very high	81.9	Confident	81 Å²	81	82 Å²	82	38%	0.379	40%	0.396	S	S	.	.			trans	-107.3	156.2	171.8	-70.6	-61.5	-31	0	0	112.1	E975 K976 Y980 V993	E975-Q978 HydrophobicContact CB-CB 4.41Å; E975-Q978 HydrophobicContact CB-CG 3.94Å; K976-Q978 PolarHBondContact O-N 3.4Å; Q978-Y980 HydrophobicContact CB-CD2 4.43Å; Q978-Y980 HydrophobicContact CB-CE2 3.58Å; Q978-Y980 WeakPolarHBondContact O-CD2 3.33Å; Q978-V993 PolarHBondContact O-N 2.96Å
979	I	93.1	Very high	83.3	Confident	8 Å²	8	75.4 Å²	75.4	4%	0.041	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.5	-176.6	65.7	175.8	0	0	0	113.1	L916 V991 L992 L1007 L1023 F1032 W1078	L916-I979 HydrophobicContact CD2-CD1 3.76Å; I979-V991 CarbonylContact C-O 3.32Å; I979-V991 VanDerWaalsContact CA-O 3.28Å; I979-V991 WeakPolarHBondContact CA-O 3.17Å; I979-L992 HydrophobicContact CG2-CD1 4.14Å; I979-L1007 HydrophobicContact CB-CD1 4.32Å; I979-L1007 HydrophobicContact CG2-CD1 3.75Å; I979-L1023 HydrophobicContact CD1-CD2 3.99Å; I979-L1023 HydrophobicContact CG1-CD2 4.33Å; I979-F1032 HydrophobicContact CD1-CZ 4.04Å; I979-F1032 HydrophobicContact CG2-CZ 4.4Å; I979-W1078 HydrophobicContact CG2-CE3 4.39Å; I979-W1078 HydrophobicContact CG2-CH2 3.99Å; I979-W1078 HydrophobicContact CG2-CZ3 3.61Å
980	Y	93.7	Very high	84.7	Confident	18 Å²	18	69.1 Å²	69.1	7%	0.071	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	169.1	-174.7	-63.5	-85.5	0	0	0	111	F972 V974 E975 Q978 V991 V993 R1021	F972-Y980 AromaticContact CD2-CE1 3.97Å; F972-Y980 HydrophobicContact CD2-CE1 3.97Å; F972-Y980 AromaticContact CE2-CD1 3.67Å; F972-Y980 HydrophobicContact CE2-CD1 3.67Å; F972-Y980 AromaticContact CE2-CE1 3.35Å; F972-Y980 HydrophobicContact CE2-CE1 3.35Å; F972-Y980 HydrophobicContact CZ-CD1 4.1Å; F972-Y980 HydrophobicContact CZ-CE1 4.22Å; V974-Y980 HydrophobicContact CG1-CE2 4.25Å; E975-Y980 PolarHBondContact N-OH 3.42Å; Q978-Y980 HydrophobicContact CB-CD2 4.43Å; Q978-Y980 HydrophobicContact CB-CE2 3.58Å; Q978-Y980 WeakPolarHBondContact O-CD2 3.33Å; Y980-V991 PolarHBondContact N-O 2.89Å; Y980-V991 PolarHBondContact O-N 3.03Å; Y980-V993 HydrophobicContact CD2-CG2 3.52Å; Y980-V993 HydrophobicContact CE2-CB 4.44Å; Y980-V993 HydrophobicContact CE2-CG2 3.74Å; Y980-R1021 WeakPolarHBondContact CB-O 3.46Å
981	A	93.5	Very high	86.3	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130	159.5	0	0	0	0	0	108.1	M960 Y964 W988 H989 L1020 R1021 L1023	M960-A981 HydrophobicContact CE-CB 3.74Å; Y964-A981 HydrophobicContact CD2-CB 4.08Å; Y964-A981 HydrophobicContact CE1-CB 4.24Å; Y964-A981 HydrophobicContact CE2-CB 3.49Å; Y964-A981 VanDerWaalsContact CE2-CB 3.49Å; A981-W988 HydrophobicContact CB-CE3 4.08Å; A981-W988 HydrophobicContact CB-CZ3 4.45Å; A981-H989 CarbonylContact C-O 3.57Å; A981-H989 VanDerWaalsContact CA-O 3.29Å; A981-H989 WeakPolarHBondContact CA-O 3.42Å; A981-L1020 CarbonylContact O-C 3.56Å; A981-L1020 WeakPolarHBondContact O-CA 3.16Å; A981-R1021 PolarHBondContact N-O 3.17Å; A981-R1021 PolarHBondContact O-N 2.89Å; A981-L1023 HydrophobicContact CB-CD1 4.19Å
982	A	93.4	Very high	87.8	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.7	175	0	0	0	0	0	110.7	I984 W988 H989 V991 Q1019 L1020	A982-I984 HydrophobicContact CB-CD1 4.19Å; A982-I984 HydrophobicContact CB-CG1 4.07Å; A982-W988 VanDerWaalsContact C-CE3 3.49Å; A982-W988 WeakPolarHBondContact O-CA 3.37Å; A982-H989 PolarHBondContact N-O 3.28Å; A982-H989 PolarHBondContact O-N 2.61Å; A982-V991 HydrophobicContact CB-CB 4.35Å; A982-V991 HydrophobicContact CB-CG1 3.69Å; A982-V991 HydrophobicContact CB-CG2 3.69Å; A982-Q1019 WeakPolarHBondContact CA-O 3.44Å; A982-L1020 HydrophobicContact CB-CD2 3.73Å
983	K	89.6	Confident	88.5	Confident	73 Å²	73	51.7 Å²	51.7	32%	0.317	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	109.9	166.4	-168.3	177.2	175.4	-174.3	0	109.7	N986 N987 W988 Q1019	K983-N986 VanDerWaalsContact CE-OD1 3.24Å; K983-N986 WeakPolarHBondContact CE-OD1 3.5Å; K983-N986 PolarHBondContact NZ-OD1 2.88Å; K983-N986 VanDerWaalsContact NZ-OD1 3.13Å; K983-N987 CarbonylContact C-O 3.58Å; K983-N987 VanDerWaalsContact CA-O 3.27Å; K983-N987 WeakPolarHBondContact CA-O 3.24Å; K983-W988 HydrophobicContact CB-CD2 4.12Å; K983-W988 HydrophobicContact CB-CE3 4.12Å; K983-W988 HydrophobicContact CB-CH2 3.87Å; K983-W988 HydrophobicContact CB-CZ2 3.88Å; K983-W988 HydrophobicContact CB-CZ3 3.99Å; K983-W988 HydrophobicContact CD-CZ2 4.15Å; K983-W988 HydrophobicContact CG-CZ2 4.32Å; K983-Q1019 HydrophobicContact CB-CB 4.33Å; K983-Q1019 PolarHBondContact N-O 3.5Å
984	I	84.8	Confident	88.8	Confident	11 Å²	11	46.6 Å²	46.6	6%	0.056	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.6	-179.7	-58.5	172.9	0	0	0	106.6	A982 N986 N987 H989 V991 V1004 E1006 E1013 V1015	A982-I984 HydrophobicContact CB-CD1 4.19Å; A982-I984 HydrophobicContact CB-CG1 4.07Å; I984-N986 PolarHBondContact O-N 2.76Å; I984-N987 PolarHBondContact N-O 3.45Å; I984-N987 WeakPolarHBondContact O-CA 3.34Å; I984-N987 PolarHBondContact O-N 3.16Å; I984-N987 VanDerWaalsContact O-O 3.1Å; I984-H989 HydrophobicContact CD1-CB 4.2Å; I984-V991 HydrophobicContact CD1-CG1 4.11Å; I984-V1004 HydrophobicContact CD1-CG2 4.44Å; I984-E1006 HydrophobicContact CD1-CG 3.96Å; I984-E1013 HydrophobicContact CD1-CB 4.31Å; I984-E1013 HydrophobicContact CD1-CG 4.32Å; I984-E1013 HydrophobicContact CG2-CG 4.32Å; I984-V1015 HydrophobicContact CD1-CG1 4.37Å; I984-V1015 HydrophobicContact CG1-CG1 3.78Å
985	E	76.1	Confident	88.6	Confident	164 Å²	164	46.4 Å²	46.4	77%	0.766	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.6	42.5	178.1	-61.4	-173.9	147.6	0	0	114.5	N987	E985-N987 PolarHBondContact O-N 3.16Å
986	N	73.1	Confident	88.4	Confident	122 Å²	122	45.4 Å²	45.4	65%	0.652	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.8	-9.9	-172.5	-76.4	-36.7	0	0	0	118.5	K983 I984	K983-N986 VanDerWaalsContact CE-OD1 3.24Å; K983-N986 WeakPolarHBondContact CE-OD1 3.5Å; K983-N986 PolarHBondContact NZ-OD1 2.88Å; K983-N986 VanDerWaalsContact NZ-OD1 3.13Å; I984-N986 PolarHBondContact O-N 2.76Å
987	N	78.3	Confident	87.8	Confident	70 Å²	70	43 Å²	43	37%	0.374	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	164.9	174.1	-72.3	-46	0	0	0	112.4	M957 I961 K983 I984 E985 H989	M957-N987 HydrophobicContact CE-CB 4.21Å; I961-N987 WeakPolarHBondContact CD1-OD1 3.48Å; K983-N987 CarbonylContact C-O 3.58Å; K983-N987 VanDerWaalsContact CA-O 3.27Å; K983-N987 WeakPolarHBondContact CA-O 3.24Å; I984-N987 PolarHBondContact N-O 3.45Å; I984-N987 WeakPolarHBondContact O-CA 3.34Å; I984-N987 PolarHBondContact O-N 3.16Å; I984-N987 VanDerWaalsContact O-O 3.1Å; E985-N987 PolarHBondContact O-N 3.16Å; N987-H989 WeakPolarHBondContact CB-NE2 3.39Å
988	W	88.5	Confident	87.2	Confident	7 Å²	7	46.1 Å²	46.1	3%	0.027	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.4	178.3	-76.9	92.8	0	0	0	111.3	M960 I961 Y964 A981 A982 K983 R1021	M960-W988 HydrophobicContact CB-CB 3.92Å; M960-W988 HydrophobicContact CE-CB 4.27Å; I961-W988 HydrophobicContact CG1-CB 4.44Å; Y964-W988 HydrophobicContact CD2-CD2 4.24Å; Y964-W988 HydrophobicContact CD2-CE3 4.23Å; Y964-W988 HydrophobicContact CD2-CG 4.43Å; Y964-W988 HydrophobicContact CG-CD2 4.11Å; Y964-W988 HydrophobicContact CG-CE3 4.11Å; Y964-W988 HydrophobicContact CG-CZ3 4.39Å; A981-W988 HydrophobicContact CB-CE3 4.08Å; A981-W988 HydrophobicContact CB-CZ3 4.45Å; A982-W988 VanDerWaalsContact C-CE3 3.49Å; A982-W988 WeakPolarHBondContact O-CA 3.37Å; K983-W988 HydrophobicContact CB-CD2 4.12Å; K983-W988 HydrophobicContact CB-CE3 4.12Å; K983-W988 HydrophobicContact CB-CH2 3.87Å; K983-W988 HydrophobicContact CB-CZ2 3.88Å; K983-W988 HydrophobicContact CB-CZ3 3.99Å; K983-W988 HydrophobicContact CD-CZ2 4.15Å; K983-W988 HydrophobicContact CG-CZ2 4.32Å; W988-R1021 HydrophobicContact CH2-CB 4.5Å; W988-R1021 HydrophobicContact CH2-CG 3.47Å; W988-R1021 VanDerWaalsContact CH2-CG 3.47Å; W988-R1021 HydrophobicContact CZ3-CB 4.14Å; W988-R1021 HydrophobicContact CZ3-CG 3.57Å
989	H	92.3	Very high	86.2	Confident	21 Å²	21	47.5 Å²	47.5	10%	0.097	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.1	-170.8	-64.6	-115	0	0	0	110.9	A981 A982 I984 N987 V991 E1006	A981-H989 CarbonylContact C-O 3.57Å; A981-H989 VanDerWaalsContact CA-O 3.29Å; A981-H989 WeakPolarHBondContact CA-O 3.42Å; A982-H989 PolarHBondContact N-O 3.28Å; A982-H989 PolarHBondContact O-N 2.61Å; I984-H989 HydrophobicContact CD1-CB 4.2Å; N987-H989 WeakPolarHBondContact CB-NE2 3.39Å; H989-V991 HydrophobicContact CB-CG1 4.2Å; H989-E1006 IonicContact CE1-OE2 2.75Å; H989-E1006 PolarHBondContact CE1-OE2 3.47Å; H989-E1006 IonicContact CG-OE2 3.92Å; H989-E1006 IonicContact ND1-OE2 2.81Å; H989-E1006 PolarHBondContact ND1-OE2 2.91Å
990	R	94.8	Very high	85.3	Confident	1 Å²	1	48.7 Å²	48.7	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	122.2	169.6	-56.9	-170	-66.4	-178.2	0.4	108.7	L956 M960 L1007 D1008 L1023 F1027 L1030 P1031 F1032	L956-R990 VanDerWaalsContact CD2-CZ 3.41Å; M960-R990 HydrophobicContact CE-CG 3.9Å; M960-R990 HydrophobicContact SD-CG 3.7Å; R990-L1007 PolarHBondContact O-N 3.03Å; R990-D1008 IonicContact CZ-OD1 3.25Å; R990-D1008 IonicContact CZ-OD2 3.87Å; R990-D1008 IonicContact NE-OD1 3.75Å; R990-D1008 IonicContact NE-OD2 3Å; R990-D1008 PolarHBondContact NE-OD2 3.28Å; R990-D1008 IonicContact NH2-OD1 3.75Å; R990-D1008 PolarHBondContact NH2-OD1 2.88Å; R990-D1008 IonicContact NH2-OD2 2.65Å; R990-D1008 PolarHBondContact NH2-OD2 2.99Å; R990-L1023 HydrophobicContact CG-CD1 3.93Å; R990-L1023 HydrophobicContact CG-CD2 4.38Å; R990-F1027 WeakPolarHBondContact CD-O 3.36Å; R990-F1027 PolarHBondContact NH1-O 3.4Å; R990-L1030 PolarHBondContact NH1-O 2.85Å; R990-P1031 PolarHBondContact NH2-O 2.87Å; R990-F1032 HydrophobicContact CB-CE1 4.46Å
991	V	95.6	Very high	84.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	152.3	-173.6	-56.7	0	0	0	0	113.2	I979 Y980 A982 I984 H989 V1004 Y1005 E1006 L1007 L1020	I979-V991 CarbonylContact C-O 3.32Å; I979-V991 VanDerWaalsContact CA-O 3.28Å; I979-V991 WeakPolarHBondContact CA-O 3.17Å; Y980-V991 PolarHBondContact N-O 2.89Å; Y980-V991 PolarHBondContact O-N 3.03Å; A982-V991 HydrophobicContact CB-CB 4.35Å; A982-V991 HydrophobicContact CB-CG1 3.69Å; A982-V991 HydrophobicContact CB-CG2 3.69Å; I984-V991 HydrophobicContact CD1-CG1 4.11Å; H989-V991 HydrophobicContact CB-CG1 4.2Å; V991-V1004 HydrophobicContact CB-CB 4.01Å; V991-V1004 HydrophobicContact CB-CG1 4.44Å; V991-V1004 HydrophobicContact CG1-CB 4.36Å; V991-V1004 HydrophobicContact CG1-CG2 4.37Å; V991-V1004 HydrophobicContact CG2-CB 4.17Å; V991-V1004 HydrophobicContact CG2-CG1 4.04Å; V991-Y1005 CarbonylContact C-O 3.56Å; V991-Y1005 VanDerWaalsContact CA-O 3.27Å; V991-Y1005 WeakPolarHBondContact CA-O 3.32Å; V991-E1006 HydrophobicContact CG1-CG 4.33Å; V991-L1007 VanDerWaalsContact C-CD1 3.49Å; V991-L1020 HydrophobicContact CG2-CD2 3.91Å
992	L	94.3	Very high	84.5	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.3	167.6	174.8	67.5	0	0	0	109	I979 K994 V1004 Y1005 L1007 W1078	I979-L992 HydrophobicContact CG2-CD1 4.14Å; L992-K994 HydrophobicContact CD2-CD 4.11Å; L992-K994 HydrophobicContact CG-CD 4.44Å; L992-K994 PolarHBondContact O-N 3.26Å; L992-V1004 CarbonylContact O-C 3.52Å; L992-V1004 WeakPolarHBondContact O-CA 3.44Å; L992-Y1005 PolarHBondContact N-O 3.32Å; L992-Y1005 PolarHBondContact O-N 2.92Å; L992-L1007 HydrophobicContact CB-CD1 4.05Å; L992-L1007 HydrophobicContact CB-CD2 3.89Å; L992-L1007 HydrophobicContact CB-CG 3.99Å; L992-W1078 HydrophobicContact CD1-CH2 4.19Å; L992-W1078 HydrophobicContact CD1-CZ2 3.93Å; L992-W1078 HydrophobicContact CD2-CD2 3.9Å; L992-W1078 HydrophobicContact CD2-CG 3.94Å; L992-W1078 HydrophobicContact CD2-CZ2 4.3Å
993	V	94.1	Very high	84.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	115.3	176.1	172.7	0	0	0	0	109.7	V974 N977 Q978 Y980 V996 V1002 V1004 L1020	V974-V993 HydrophobicContact CG1-CB 4.49Å; V974-V993 HydrophobicContact CG1-CG1 4.11Å; V974-V993 HydrophobicContact CG1-CG2 3.82Å; N977-V993 WeakPolarHBondContact CA-O 3.31Å; N977-V993 PolarHBondContact N-O 3.2Å; Q978-V993 PolarHBondContact O-N 2.96Å; Y980-V993 HydrophobicContact CD2-CG2 3.52Å; Y980-V993 HydrophobicContact CE2-CB 4.44Å; Y980-V993 HydrophobicContact CE2-CG2 3.74Å; V993-V996 HydrophobicContact CG1-CG2 4.15Å; V993-V1002 HydrophobicContact CB-CG1 4.23Å; V993-V1002 HydrophobicContact CG1-CG1 3.48Å; V993-V1002 VanDerWaalsContact CG1-CG1 3.48Å; V993-V1002 HydrophobicContact CG2-CG1 3.81Å; V993-V1004 HydrophobicContact CG2-CG1 4.11Å; V993-L1020 HydrophobicContact CG2-CD1 4.4Å
994	K	88.4	Confident	84.4	Confident	58 Å²	58	48.9 Å²	48.9	25%	0.252	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-22.6	177	-64.7	-69.2	-166.5	-179.7	0	112.4	K976 L992 S1003	K976-K994 VanDerWaalsContact CD-O 3.31Å; K976-K994 WeakPolarHBondContact CD-O 3.28Å; K976-K994 WeakPolarHBondContact CE-O 3.42Å; K976-K994 PolarHBondContact NZ-O 3.2Å; L992-K994 HydrophobicContact CD2-CD 4.11Å; L992-K994 HydrophobicContact CG-CD 4.44Å; L992-K994 PolarHBondContact O-N 3.26Å; K994-S1003 PolarHBondContact N-O 2.77Å
995	G	83.3	Confident	84.8	Confident	17 Å²	17	48.6 Å²	48.6	18%	0.175	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	155	173.7	0	0	0	0	0	113.7	V1002 S1003	G995-V1002 CarbonylContact O-C 3.59Å; G995-V1002 WeakPolarHBondContact O-CA 3.37Å; G995-V1002 WeakPolarHBondContact O-CG1 3.24Å; G995-S1003 PolarHBondContact N-O 3.12Å; G995-S1003 PolarHBondContact O-N 2.82Å
996	V	85.1	Confident	85.7	Confident	73 Å²	73	41 Å²	41	44%	0.442	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128	172.7	-178.3	0	0	0	0	107.4	V974 V993 V1002	V974-V996 HydrophobicContact CB-CG2 4.38Å; V974-V996 HydrophobicContact CG1-CG2 4.01Å; V993-V996 HydrophobicContact CG1-CG2 4.15Å; V996-V1002 HydrophobicContact CG1-CG2 4.46Å; V996-V1002 HydrophobicContact CG2-CG1 4.24Å; V996-V1002 HydrophobicContact CG2-CG2 4.42Å
997	L	75.6	Confident	86.7	Confident	82 Å²	82	35.3 Å²	35.3	43%	0.429	21%	0.206	S	C	.	.			trans	-93.5	156.2	-177.6	-60.2	179.2	0	0	0	110.9	N999 G1000 L1001 L1014	L997-N999 VanDerWaalsContact CB-OD1 3.25Å; L997-N999 WeakPolarHBondContact CB-OD1 3.45Å; L997-N999 PolarHBondContact O-N 2.89Å; L997-G1000 PolarHBondContact O-N 2.82Å; L997-G1000 VanDerWaalsContact O-N 3.12Å; L997-L1001 HydrophobicContact CB-CB 4.48Å; L997-L1001 WeakPolarHBondContact CB-O 3.42Å; L997-L1001 HydrophobicContact CD1-CB 4.16Å; L997-L1001 PolarHBondContact N-O 2.81Å; L997-L1014 HydrophobicContact CD1-CD2 3.81Å
998	T	74.1	Confident	87.4	Confident	161 Å²	161	32.2 Å²	32.2	99%	0.988	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.5	-177.6	47.9	0	0	0	0	114	G1000	T998-G1000 VanDerWaalsContact C-N 3.35Å
999	N	68.4	Low	87.4	Confident	110 Å²	110	34.7 Å²	34.7	59%	0.588	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	5.5	176.3	66.5	-6.7	0	0	0	114	L997 L1001	L997-N999 VanDerWaalsContact CB-OD1 3.25Å; L997-N999 WeakPolarHBondContact CB-OD1 3.45Å; L997-N999 PolarHBondContact O-N 2.89Å; N999-L1001 WeakPolarHBondContact OD1-CB 3.45Å; N999-L1001 PolarHBondContact OD1-N 3.35Å
1000	G	74.6	Confident	87.2	Confident	32 Å²	32	33.9 Å²	33.9	33%	0.33	20%	0.197	S	C	.	.	S	Bend	trans	84.6	2.3	179.6	0	0	0	0	0	115.4	L997 T998 C1017	L997-G1000 PolarHBondContact O-N 2.82Å; L997-G1000 VanDerWaalsContact O-N 3.12Å; T998-G1000 VanDerWaalsContact C-N 3.35Å; G1000-C1017 PolarHBondContact O-N 3.11Å; G1000-C1017 PolarHBondContact O-SG 2.86Å; G1000-C1017 VanDerWaalsContact O-SG 3.39Å
1001	L	80.1	Confident	86.8	Confident	61 Å²	61	37.8 Å²	37.8	32%	0.319	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	153.2	166.8	-63.4	-179.2	0	0	0	111.1	L997 N999 V1015	L997-L1001 HydrophobicContact CB-CB 4.48Å; L997-L1001 WeakPolarHBondContact CB-O 3.42Å; L997-L1001 HydrophobicContact CD1-CB 4.16Å; L997-L1001 PolarHBondContact N-O 2.81Å; N999-L1001 WeakPolarHBondContact OD1-CB 3.45Å; N999-L1001 PolarHBondContact OD1-N 3.35Å; L1001-V1015 CarbonylContact C-O 3.48Å
1002	V	89.3	Confident	86.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.8	-178.1	-172	0	0	0	0	108.6	V974 V993 G995 V996 V1004 V1015 C1017 L1020	V974-V1002 HydrophobicContact CG1-CG1 4.14Å; V974-V1002 HydrophobicContact CG1-CG2 4.38Å; V993-V1002 HydrophobicContact CB-CG1 4.23Å; V993-V1002 HydrophobicContact CG1-CG1 3.48Å; V993-V1002 VanDerWaalsContact CG1-CG1 3.48Å; V993-V1002 HydrophobicContact CG2-CG1 3.81Å; G995-V1002 CarbonylContact O-C 3.59Å; G995-V1002 WeakPolarHBondContact O-CA 3.37Å; G995-V1002 WeakPolarHBondContact O-CG1 3.24Å; V996-V1002 HydrophobicContact CG1-CG2 4.46Å; V996-V1002 HydrophobicContact CG2-CG1 4.24Å; V996-V1002 HydrophobicContact CG2-CG2 4.42Å; V1002-V1004 HydrophobicContact CB-CG1 4.43Å; V1002-V1004 HydrophobicContact CG1-CG1 3.88Å; V1002-V1004 PolarHBondContact O-N 3.24Å; V1002-V1015 HydrophobicContact CB-CG2 4.24Å; V1002-V1015 PolarHBondContact N-O 3.15Å; V1002-V1015 PolarHBondContact O-N 3.08Å; V1002-C1017 HydrophobicContact CG2-CB 4.42Å; V1002-C1017 WeakPolarHBondContact CG2-SG 3.34Å; V1002-L1020 HydrophobicContact CB-CD1 4.06Å; V1002-L1020 HydrophobicContact CG1-CD1 3.97Å; V1002-L1020 HydrophobicContact CG2-CD1 3.9Å
1003	S	88.4	Confident	86	Confident	35 Å²	35	46.5 Å²	46.5	25%	0.245	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	118.8	169.2	177.3	0	0	0	0	108.7	K994 G995 E1013	K994-S1003 PolarHBondContact N-O 2.77Å; G995-S1003 PolarHBondContact N-O 3.12Å; G995-S1003 PolarHBondContact O-N 2.82Å; S1003-E1013 WeakPolarHBondContact CA-O 3.47Å
1004	V	94.4	Very high	85.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153.6	-178.6	-64.3	0	0	0	0	110.7	I984 V991 L992 V993 V1002 H1012 E1013 V1015 L1020	I984-V1004 HydrophobicContact CD1-CG2 4.44Å; V991-V1004 HydrophobicContact CB-CB 4.01Å; V991-V1004 HydrophobicContact CB-CG1 4.44Å; V991-V1004 HydrophobicContact CG1-CB 4.36Å; V991-V1004 HydrophobicContact CG1-CG2 4.37Å; V991-V1004 HydrophobicContact CG2-CB 4.17Å; V991-V1004 HydrophobicContact CG2-CG1 4.04Å; L992-V1004 CarbonylContact O-C 3.52Å; L992-V1004 WeakPolarHBondContact O-CA 3.44Å; V993-V1004 HydrophobicContact CG2-CG1 4.11Å; V1002-V1004 HydrophobicContact CB-CG1 4.43Å; V1002-V1004 HydrophobicContact CG1-CG1 3.88Å; V1002-V1004 PolarHBondContact O-N 3.24Å; V1004-H1012 WeakPolarHBondContact O-CA 3.49Å; V1004-E1013 HydrophobicContact CG2-CB 3.88Å; V1004-E1013 WeakPolarHBondContact CG2-O 3.4Å; V1004-E1013 PolarHBondContact N-O 2.65Å; V1004-E1013 PolarHBondContact O-N 3.27Å; V1004-V1015 HydrophobicContact CB-CG2 4.49Å; V1004-V1015 HydrophobicContact CG1-CG2 3.69Å; V1004-V1015 HydrophobicContact CG2-CG1 4.04Å; V1004-V1015 HydrophobicContact CG2-CG2 3.94Å; V1004-L1020 HydrophobicContact CG1-CD2 4.33Å
1005	Y	92.5	Very high	85.6	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.5	172.5	174.3	-99	0	0	0	108.5	V991 L992 L1007 G1010 K1011 H1012 H1036	V991-Y1005 CarbonylContact C-O 3.56Å; V991-Y1005 VanDerWaalsContact CA-O 3.27Å; V991-Y1005 WeakPolarHBondContact CA-O 3.32Å; L992-Y1005 PolarHBondContact N-O 3.32Å; L992-Y1005 PolarHBondContact O-N 2.92Å; Y1005-L1007 HydrophobicContact CD1-CD2 4.2Å; Y1005-L1007 HydrophobicContact CE1-CD2 4.38Å; Y1005-L1007 PolarHBondContact O-N 3.42Å; Y1005-G1010 WeakPolarHBondContact CE2-O 3.34Å; Y1005-G1010 VanDerWaalsContact OH-CA 3.28Å; Y1005-G1010 WeakPolarHBondContact OH-CA 3.45Å; Y1005-K1011 CarbonylContact C-O 3.55Å; Y1005-K1011 WeakPolarHBondContact CA-O 3.38Å; Y1005-H1012 AromaticContact CD2-CD2 3.79Å; Y1005-H1012 AromaticContact CD2-CE1 3.66Å; Y1005-H1012 AromaticContact CD2-NE2 3.46Å; Y1005-H1012 WeakPolarHBondContact CD2-NE2 3.25Å; Y1005-H1012 AromaticContact CE2-NE2 3.99Å; Y1005-H1036 AromaticContact CZ-NE2 3.52Å; Y1005-H1036 PolarHBondContact OH-CD2 3.01Å; Y1005-H1036 PolarHBondContact OH-NE2 3.15Å
1006	E	94.9	Very high	85.8	Confident	5 Å²	5	49.8 Å²	49.8	2%	0.023	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	113.9	176.9	-71.6	-168.5	-122.9	0	0	110.6	I984 H989 V991 D1008 Y1009 G1010 K1011	I984-E1006 HydrophobicContact CD1-CG 3.96Å; H989-E1006 IonicContact CE1-OE2 2.75Å; H989-E1006 PolarHBondContact CE1-OE2 3.47Å; H989-E1006 IonicContact CG-OE2 3.92Å; H989-E1006 IonicContact ND1-OE2 2.81Å; H989-E1006 PolarHBondContact ND1-OE2 2.91Å; V991-E1006 HydrophobicContact CG1-CG 4.33Å; E1006-D1008 PolarHBondContact O-N 3.1Å; E1006-Y1009 VanDerWaalsContact OE2-CD2 3.3Å; E1006-Y1009 WeakPolarHBondContact OE2-CD2 3.24Å; E1006-G1010 VanDerWaalsContact O-CA 3.29Å; E1006-G1010 WeakPolarHBondContact O-CA 3.36Å; E1006-G1010 PolarHBondContact O-N 3.41Å; E1006-K1011 HydrophobicContact CB-CB 4.49Å; E1006-K1011 HydrophobicContact CG-CB 4.4Å; E1006-K1011 PolarHBondContact N-O 3.27Å
1007	L	94.3	Very high	85.7	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.01	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.6	-174.3	-71.7	162	0	0	0	113.4	I979 R990 V991 L992 Y1005 F1032 G1034 W1078	I979-L1007 HydrophobicContact CB-CD1 4.32Å; I979-L1007 HydrophobicContact CG2-CD1 3.75Å; R990-L1007 PolarHBondContact O-N 3.03Å; V991-L1007 VanDerWaalsContact C-CD1 3.49Å; L992-L1007 HydrophobicContact CB-CD1 4.05Å; L992-L1007 HydrophobicContact CB-CD2 3.89Å; L992-L1007 HydrophobicContact CB-CG 3.99Å; Y1005-L1007 HydrophobicContact CD1-CD2 4.2Å; Y1005-L1007 HydrophobicContact CE1-CD2 4.38Å; Y1005-L1007 PolarHBondContact O-N 3.42Å; L1007-F1032 HydrophobicContact CB-CB 4.38Å; L1007-F1032 HydrophobicContact CB-CD1 3.52Å; L1007-F1032 HydrophobicContact CB-CE1 3.92Å; L1007-F1032 HydrophobicContact CB-CG 3.98Å; L1007-F1032 HydrophobicContact CD1-CD1 4.02Å; L1007-F1032 HydrophobicContact CD1-CE1 3.5Å; L1007-F1032 VanDerWaalsContact CD1-CE1 3.5Å; L1007-F1032 HydrophobicContact CD1-CE2 4.32Å; L1007-F1032 HydrophobicContact CD1-CZ 3.66Å; L1007-F1032 HydrophobicContact CD2-CD2 4.5Å; L1007-F1032 HydrophobicContact CG-CD1 4.26Å; L1007-F1032 HydrophobicContact CG-CE1 4.23Å; L1007-G1034 PolarHBondContact O-N 2.79Å; L1007-W1078 HydrophobicContact CD2-CB 3.56Å; L1007-W1078 HydrophobicContact CD2-CD2 3.92Å; L1007-W1078 HydrophobicContact CD2-CE3 3.68Å; L1007-W1078 HydrophobicContact CD2-CG 3.88Å
1008	D	92.9	Very high	86.2	Confident	6 Å²	6	47.6 Å²	47.6	3%	0.032	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-33.2	-179.8	-67.5	-52.2	0	0	0	113.2	Q945 L953 R990 E1006 Q1033 G1034	Q945-D1008 PolarHBondContact NE2-O 2.93Å; L953-D1008 HydrophobicContact CD1-CB 3.72Å; L953-D1008 HydrophobicContact CD2-CB 4.05Å; R990-D1008 IonicContact CZ-OD1 3.25Å; R990-D1008 IonicContact CZ-OD2 3.87Å; R990-D1008 IonicContact NE-OD1 3.75Å; R990-D1008 IonicContact NE-OD2 3Å; R990-D1008 PolarHBondContact NE-OD2 3.28Å; R990-D1008 IonicContact NH2-OD1 3.75Å; R990-D1008 PolarHBondContact NH2-OD1 2.88Å; R990-D1008 IonicContact NH2-OD2 2.65Å; R990-D1008 PolarHBondContact NH2-OD2 2.99Å; E1006-D1008 PolarHBondContact O-N 3.1Å; D1008-Q1033 HydrophobicContact CB-CB 4.3Å; D1008-Q1033 PolarHBondContact OD1-N 2.99Å; D1008-G1034 WeakPolarHBondContact O-CA 3.4Å; D1008-G1034 PolarHBondContact O-N 3.11Å; D1008-G1034 VanDerWaalsContact O-N 3.13Å
1009	Y	89	Confident	86.9	Confident	58 Å²	58	43.6 Å²	43.6	23%	0.227	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-18.6	-175.2	-67.2	-82.9	0	0	0	114.4	S934 V935 Q945 L953 M957 E1006	S934-Y1009 WeakPolarHBondContact CB-O 3.47Å; S934-Y1009 PolarHBondContact OG-O 3.06Å; V935-Y1009 WeakPolarHBondContact CG2-O 3.47Å; Q945-Y1009 VanDerWaalsContact NE2-CD1 3.25Å; L953-Y1009 HydrophobicContact CD2-CE1 4.29Å; L953-Y1009 HydrophobicContact CD2-CE2 4.08Å; M957-Y1009 HydrophobicContact CE-CE2 4.31Å; M957-Y1009 HydrophobicContact SD-CE2 3.76Å; M957-Y1009 PolarHBondContact SD-OH 3.48Å; E1006-Y1009 VanDerWaalsContact OE2-CD2 3.3Å; E1006-Y1009 WeakPolarHBondContact OE2-CD2 3.24Å
1010	G	87.4	Confident	88	Confident	5 Å²	5	38.4 Å²	38.4	5%	0.052	21%	0.21	C	C	.	.			trans	77.5	14	177.6	0	0	0	0	0	116.5	Y1005 E1006	Y1005-G1010 WeakPolarHBondContact CE2-O 3.34Å; Y1005-G1010 VanDerWaalsContact OH-CA 3.28Å; Y1005-G1010 WeakPolarHBondContact OH-CA 3.45Å; E1006-G1010 VanDerWaalsContact O-CA 3.29Å; E1006-G1010 WeakPolarHBondContact O-CA 3.36Å; E1006-G1010 PolarHBondContact O-N 3.41Å
1011	K	86.3	Confident	88.7	Confident	82 Å²	82	38.3 Å²	38.3	36%	0.357	20%	0.2	S	C	.	.			trans	-77.7	155.3	172.1	-66.5	-178.1	178	-178.6	0	111.9	V935 Y1005 E1006	V935-K1011 HydrophobicContact CG2-CG 3.68Å; Y1005-K1011 CarbonylContact C-O 3.55Å; Y1005-K1011 WeakPolarHBondContact CA-O 3.38Å; E1006-K1011 HydrophobicContact CB-CB 4.49Å; E1006-K1011 HydrophobicContact CG-CB 4.4Å; E1006-K1011 PolarHBondContact N-O 3.27Å
1012	H	83.6	Confident	89.2	Confident	116 Å²	116	39 Å²	39	54%	0.537	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.8	169.1	-82.7	-85.6	0	0	0	109.5	V1004 Y1005	V1004-H1012 WeakPolarHBondContact O-CA 3.49Å; Y1005-H1012 AromaticContact CD2-CD2 3.79Å; Y1005-H1012 AromaticContact CD2-CE1 3.66Å; Y1005-H1012 AromaticContact CD2-NE2 3.46Å; Y1005-H1012 WeakPolarHBondContact CD2-NE2 3.25Å; Y1005-H1012 AromaticContact CE2-NE2 3.99Å
1013	E	88.3	Confident	89.2	Confident	70 Å²	70	39.1 Å²	39.1	33%	0.327	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	160.2	-176	-71.2	-59.8	156	0	0	112	I984 S1003 V1004	I984-E1013 HydrophobicContact CD1-CB 4.31Å; I984-E1013 HydrophobicContact CD1-CG 4.32Å; I984-E1013 HydrophobicContact CG2-CG 4.32Å; S1003-E1013 WeakPolarHBondContact CA-O 3.47Å; V1004-E1013 HydrophobicContact CG2-CB 3.88Å; V1004-E1013 WeakPolarHBondContact CG2-O 3.4Å; V1004-E1013 PolarHBondContact N-O 2.65Å; V1004-E1013 PolarHBondContact O-N 3.27Å
1014	L	85.8	Confident	89.2	Confident	102 Å²	102	39.8 Å²	39.8	53%	0.534	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	109.1	172.1	-79.2	168.8	0	0	0	109.8	L997	L997-L1014 HydrophobicContact CD1-CD2 3.81Å
1015	V	88.8	Confident	88.6	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.024	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	153.6	179.9	-61.3	0	0	0	0	111.2	I984 L1001 V1002 V1004 Q1019 L1020	I984-V1015 HydrophobicContact CD1-CG1 4.37Å; I984-V1015 HydrophobicContact CG1-CG1 3.78Å; L1001-V1015 CarbonylContact C-O 3.48Å; V1002-V1015 HydrophobicContact CB-CG2 4.24Å; V1002-V1015 PolarHBondContact N-O 3.15Å; V1002-V1015 PolarHBondContact O-N 3.08Å; V1004-V1015 HydrophobicContact CB-CG2 4.49Å; V1004-V1015 HydrophobicContact CG1-CG2 3.69Å; V1004-V1015 HydrophobicContact CG2-CG1 4.04Å; V1004-V1015 HydrophobicContact CG2-CG2 3.94Å; V1015-Q1019 HydrophobicContact CB-CB 4.36Å; V1015-L1020 HydrophobicContact CG2-CD1 4.43Å; V1015-L1020 HydrophobicContact CG2-CD2 4.21Å; V1015-L1020 HydrophobicContact CG2-CG 4.18Å
1016	S	87.1	Confident	88.1	Confident	37 Å²	37	51.2 Å²	51.2	26%	0.259	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	146.5	167.6	173.5	0	0	0	0	110.7	S1018 Q1019	S1016-S1018 PolarHBondContact O-N 2.73Å; S1016-S1018 VanDerWaalsContact O-N 3.1Å; S1016-S1018 PolarHBondContact OG-N 3.13Å; S1016-S1018 VanDerWaalsContact OG-N 3.08Å; S1016-S1018 PolarHBondContact OG-OG 2.68Å; S1016-Q1019 WeakPolarHBondContact O-CB 3.24Å; S1016-Q1019 PolarHBondContact O-N 2.77Å
1017	C	84.8	Confident	87.8	Confident	47 Å²	47	51 Å²	51	32%	0.318	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-48.4	-34.8	165	-78.7	0	0	0	0	112.8	G1000 V1002 Q1019 L1020	G1000-C1017 PolarHBondContact O-N 3.11Å; G1000-C1017 PolarHBondContact O-SG 2.86Å; G1000-C1017 VanDerWaalsContact O-SG 3.39Å; V1002-C1017 HydrophobicContact CG2-CB 4.42Å; V1002-C1017 WeakPolarHBondContact CG2-SG 3.34Å; C1017-Q1019 PolarHBondContact O-N 3.25Å; C1017-L1020 PolarHBondContact O-N 2.93Å
1018	S	85.3	Confident	87.4	Confident	63 Å²	63	51.7 Å²	51.7	44%	0.441	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-69.6	-15.5	178.2	61.9	0	0	0	0	114.4	S1016 R1021	S1016-S1018 PolarHBondContact O-N 2.73Å; S1016-S1018 VanDerWaalsContact O-N 3.1Å; S1016-S1018 PolarHBondContact OG-N 3.13Å; S1016-S1018 VanDerWaalsContact OG-N 3.08Å; S1016-S1018 PolarHBondContact OG-OG 2.68Å; S1018-R1021 PolarHBondContact O-NH1 2.87Å
1019	Q	89.4	Confident	86.8	Confident	77 Å²	77	58.5 Å²	58.5	36%	0.36	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-89.3	-5.3	176.3	-70.1	166.7	-42.3	0	0	112.9	A982 K983 V1015 S1016 C1017	A982-Q1019 WeakPolarHBondContact CA-O 3.44Å; K983-Q1019 HydrophobicContact CB-CB 4.33Å; K983-Q1019 PolarHBondContact N-O 3.5Å; V1015-Q1019 HydrophobicContact CB-CB 4.36Å; S1016-Q1019 WeakPolarHBondContact O-CB 3.24Å; S1016-Q1019 PolarHBondContact O-N 2.77Å; C1017-Q1019 PolarHBondContact O-N 3.25Å
1020	L	90.6	Very high	86.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	148.6	178.7	-68	166.8	0	0	0	112	F972 V974 A981 A982 V991 V993 V1002 V1004 V1015 C1017	F972-L1020 WeakPolarHBondContact CE1-O 3.33Å; F972-L1020 HydrophobicContact CZ-CB 3.85Å; V974-L1020 HydrophobicContact CG1-CD1 3.82Å; V974-L1020 HydrophobicContact CG2-CD1 3.84Å; A981-L1020 CarbonylContact O-C 3.56Å; A981-L1020 WeakPolarHBondContact O-CA 3.16Å; A982-L1020 HydrophobicContact CB-CD2 3.73Å; V991-L1020 HydrophobicContact CG2-CD2 3.91Å; V993-L1020 HydrophobicContact CG2-CD1 4.4Å; V1002-L1020 HydrophobicContact CB-CD1 4.06Å; V1002-L1020 HydrophobicContact CG1-CD1 3.97Å; V1002-L1020 HydrophobicContact CG2-CD1 3.9Å; V1004-L1020 HydrophobicContact CG1-CD2 4.33Å; V1015-L1020 HydrophobicContact CG2-CD1 4.43Å; V1015-L1020 HydrophobicContact CG2-CD2 4.21Å; V1015-L1020 HydrophobicContact CG2-CG 4.18Å; C1017-L1020 PolarHBondContact O-N 2.93Å
1021	R	89.6	Confident	86.7	Confident	31 Å²	31	57.4 Å²	57.4	12%	0.117	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.4	170.5	-58.9	-68.8	-177.6	-83.4	-6.1	109.2	Y964 E969 Y980 A981 W988 S1018 L1023	Y964-R1021 HydrophobicContact CD1-CB 3.8Å; Y964-R1021 HydrophobicContact CD1-CG 3.95Å; Y964-R1021 HydrophobicContact CE1-CB 3.66Å; Y964-R1021 HydrophobicContact CE1-CG 4.33Å; E969-R1021 IonicContact OE1-CZ 2.72Å; E969-R1021 IonicContact OE1-NH1 3.49Å; E969-R1021 IonicContact OE1-NH2 3.85Å; E969-R1021 PolarHBondContact OE1-NH2 3Å; Y980-R1021 WeakPolarHBondContact CB-O 3.46Å; A981-R1021 PolarHBondContact N-O 3.17Å; A981-R1021 PolarHBondContact O-N 2.89Å; W988-R1021 HydrophobicContact CH2-CB 4.5Å; W988-R1021 HydrophobicContact CH2-CG 3.47Å; W988-R1021 VanDerWaalsContact CH2-CG 3.47Å; W988-R1021 HydrophobicContact CZ3-CB 4.14Å; W988-R1021 HydrophobicContact CZ3-CG 3.57Å; S1018-R1021 PolarHBondContact O-NH1 2.87Å; R1021-L1023 PolarHBondContact O-N 2.93Å
1022	T	90.1	Very high	87.1	Confident	74 Å²	74	54.1 Å²	54.1	45%	0.454	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	130.2	173.5	-51.7	0	0	0	0	111	Y964 S1024	Y964-T1022 PolarHBondContact OH-O 2.74Å; T1022-S1024 PolarHBondContact O-N 3.46Å; T1022-S1024 VanDerWaalsContact O-N 3.15Å
1023	L	90.8	Very high	87.5	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	25%	0.253	C	S	.	.			trans	-68.8	112	178.6	-173.9	64.8	0	0	0	110.9	M960 Y964 I979 A981 R990 R1021 F1027 R1028	M960-L1023 HydrophobicContact CE-CD1 4.15Å; Y964-L1023 WeakPolarHBondContact OH-CA 3.37Å; I979-L1023 HydrophobicContact CD1-CD2 3.99Å; I979-L1023 HydrophobicContact CG1-CD2 4.33Å; A981-L1023 HydrophobicContact CB-CD1 4.19Å; R990-L1023 HydrophobicContact CG-CD1 3.93Å; R990-L1023 HydrophobicContact CG-CD2 4.38Å; R1021-L1023 PolarHBondContact O-N 2.93Å; L1023-F1027 HydrophobicContact CD1-CB 3.81Å; L1023-R1028 HydrophobicContact CD2-CG 4.08Å; L1023-R1028 HydrophobicContact CG-CG 4.26Å; L1023-R1028 PolarHBondContact O-NE 3.27Å; L1023-R1028 VanDerWaalsContact O-NE 3.11Å; L1023-R1028 PolarHBondContact O-NH2 3.15Å
1024	S	87.4	Confident	87.8	Confident	49 Å²	49	45.8 Å²	45.8	34%	0.343	24%	0.242	S	C	.	.			trans	-68	145.6	-175.7	-174.9	0	0	0	0	111.5	Y964 T1022 K1026 F1027	Y964-S1024 PolarHBondContact OH-N 2.89Å; T1022-S1024 PolarHBondContact O-N 3.46Å; T1022-S1024 VanDerWaalsContact O-N 3.15Å; S1024-K1026 PolarHBondContact O-N 3.25Å; S1024-K1026 VanDerWaalsContact O-N 3.15Å; S1024-F1027 PolarHBondContact O-N 3.45Å
1025	K	82.2	Confident	88.1	Confident	158 Å²	158	41.4 Å²	41.4	69%	0.687	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-56.8	-32.9	-175	-68.1	-171.5	177.5	-172.9	0	113.5	F1027 R1028	K1025-F1027 VanDerWaalsContact C-N 3.26Å; K1025-F1027 PolarHBondContact O-N 2.95Å; K1025-R1028 WeakPolarHBondContact O-CB 3.09Å; K1025-R1028 PolarHBondContact O-N 3.09Å
1026	K	81.3	Confident	88.4	Confident	87 Å²	87	43 Å²	43	38%	0.378	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-61.8	-31.7	176	55	166.5	174.2	163.6	0	113.4	S963 S1024 R1028 Q1029	S963-K1026 VanDerWaalsContact CB-NZ 3.34Å; S963-K1026 WeakPolarHBondContact OG-CE 3.33Å; S963-K1026 PolarHBondContact OG-NZ 2.76Å; S1024-K1026 PolarHBondContact O-N 3.25Å; S1024-K1026 VanDerWaalsContact O-N 3.15Å; K1026-R1028 PolarHBondContact O-N 3.23Å; K1026-Q1029 WeakPolarHBondContact O-CG 3.24Å
1027	F	88.1	Confident	88.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-85.2	10.5	-180	-54.6	-45.5	0	0	0	114	L956 E959 M960 Y964 R990 L1023 S1024 K1025	L956-F1027 HydrophobicContact CD1-CB 4.06Å; L956-F1027 HydrophobicContact CD1-CD1 3.75Å; L956-F1027 HydrophobicContact CD1-CG 4.35Å; E959-F1027 HydrophobicContact CB-CE1 3.7Å; E959-F1027 HydrophobicContact CB-CZ 4.4Å; E959-F1027 WeakPolarHBondContact O-CZ 3.49Å; M960-F1027 HydrophobicContact CB-CE1 4.48Å; M960-F1027 HydrophobicContact CB-CE2 4.45Å; M960-F1027 HydrophobicContact CB-CZ 4.31Å; M960-F1027 HydrophobicContact CG-CB 4.16Å; M960-F1027 HydrophobicContact CG-CD1 3.55Å; M960-F1027 HydrophobicContact CG-CD2 3.63Å; M960-F1027 HydrophobicContact CG-CE1 3.7Å; M960-F1027 HydrophobicContact CG-CE2 3.77Å; M960-F1027 HydrophobicContact CG-CG 3.5Å; M960-F1027 VanDerWaalsContact CG-CG 3.5Å; M960-F1027 HydrophobicContact CG-CZ 3.78Å; M960-F1027 HydrophobicContact SD-CB 4.1Å; M960-F1027 HydrophobicContact SD-CD1 4.48Å; M960-F1027 HydrophobicContact SD-CD2 4.43Å; M960-F1027 HydrophobicContact SD-CG 4.1Å; Y964-F1027 AromaticContact CD2-CE2 3.99Å; Y964-F1027 HydrophobicContact CD2-CE2 3.99Å; Y964-F1027 AromaticContact CE2-CD2 3.53Å; Y964-F1027 HydrophobicContact CE2-CD2 3.53Å; Y964-F1027 AromaticContact CE2-CE2 3.36Å; Y964-F1027 HydrophobicContact CE2-CE2 3.36Å; Y964-F1027 HydrophobicContact CE2-CZ 4.49Å; Y964-F1027 AromaticContact CZ-CE2 3.97Å; R990-F1027 WeakPolarHBondContact CD-O 3.36Å; R990-F1027 PolarHBondContact NH1-O 3.4Å; L1023-F1027 HydrophobicContact CD1-CB 3.81Å; S1024-F1027 PolarHBondContact O-N 3.45Å; K1025-F1027 VanDerWaalsContact C-N 3.26Å; K1025-F1027 PolarHBondContact O-N 2.95Å
1028	R	86	Confident	89.3	Confident	16 Å²	16	41.5 Å²	41.5	6%	0.06	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-107.9	12.2	176.5	-51	-175.9	-172.9	-147.2	-5	112.7	L914 Q915 P917 P918 L1023 K1025 K1026	L914-R1028 VanDerWaalsContact C-NH1 3.34Å; L914-R1028 PolarHBondContact O-NH1 3.25Å; Q915-R1028 WeakPolarHBondContact O-CD 3.47Å; Q915-R1028 PolarHBondContact O-NH1 3.48Å; P917-R1028 VanDerWaalsContact CA-O 3.24Å; P917-R1028 WeakPolarHBondContact CA-O 3.31Å; P917-R1028 HydrophobicContact CB-CB 4.44Å; P917-R1028 WeakPolarHBondContact CB-O 3.34Å; P917-R1028 HydrophobicContact CG-CB 3.98Å; P917-R1028 HydrophobicContact CG-CG 4.46Å; P918-R1028 VanDerWaalsContact CD-O 3.31Å; P918-R1028 WeakPolarHBondContact CD-O 3.44Å; L1023-R1028 HydrophobicContact CD2-CG 4.08Å; L1023-R1028 HydrophobicContact CG-CG 4.26Å; L1023-R1028 PolarHBondContact O-NE 3.27Å; L1023-R1028 VanDerWaalsContact O-NE 3.11Å; L1023-R1028 PolarHBondContact O-NH2 3.15Å; K1025-R1028 WeakPolarHBondContact O-CB 3.09Å; K1025-R1028 PolarHBondContact O-N 3.09Å; K1026-R1028 PolarHBondContact O-N 3.23Å
1029	Q	81.8	Confident	89.7	Confident	149 Å²	149	39 Å²	39	70%	0.696	19%	0.192	S	C	*	.	S	Bend	trans	-81	-42.6	179.7	-66.5	179.4	11.2	0	0	112.3	P918 K1026	P918-Q1029 VanDerWaalsContact CG-O 3.28Å; P918-Q1029 WeakPolarHBondContact CG-O 3.38Å; K1026-Q1029 WeakPolarHBondContact O-CG 3.24Å
1030	L	84.1	Confident	89.9	Confident	21 Å²	21	35.4 Å²	35.4	11%	0.11	18%	0.176	C	C	.	.	S	Bend	trans	-74.8	134.8	172.8	-169	68.4	0	0	0	109.6	K952 L953 L956 R990 Q1033	K952-L1030 HydrophobicContact CB-CD1 3.61Å; K952-L1030 HydrophobicContact CB-CD2 4.06Å; K952-L1030 HydrophobicContact CD-CD1 3.7Å; K952-L1030 HydrophobicContact CG-CD1 4.32Å; L953-L1030 HydrophobicContact CB-CD2 4.28Å; L953-L1030 HydrophobicContact CD1-CD2 4.49Å; L956-L1030 HydrophobicContact CB-CD2 4.4Å; L956-L1030 HydrophobicContact CD2-CB 4.24Å; L956-L1030 HydrophobicContact CD2-CD2 3.96Å; R990-L1030 PolarHBondContact NH1-O 2.85Å; L1030-Q1033 HydrophobicContact CD2-CG 4Å; L1030-Q1033 HydrophobicContact CG-CG 4.48Å
1031	P	90.2	Very high	89.7	Confident	20 Å²	20	38 Å²	38	13%	0.13	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-52.9	158.7	166.5	-25.6	34.4	0	0	0	112.3	P918 L920 R990 Q1033	P918-P1031 HydrophobicContact CG-CG 4.11Å; P918-P1031 VanDerWaalsContact O-CA 3.32Å; P918-P1031 WeakPolarHBondContact O-CA 3.39Å; P918-P1031 VanDerWaalsContact O-CB 3.28Å; P918-P1031 WeakPolarHBondContact O-CB 3.33Å; L920-P1031 HydrophobicContact CB-CB 3.86Å; L920-P1031 HydrophobicContact CD1-CB 4.01Å; L920-P1031 HydrophobicContact CD1-CG 4.23Å; R990-P1031 PolarHBondContact NH2-O 2.87Å; P1031-Q1033 PolarHBondContact O-N 3.32Å; P1031-Q1033 PolarHBondContact O-NE2 2.85Å
1032	F	94.1	Very high	89.5	Confident	13 Å²	13	37.8 Å²	37.8	6%	0.057	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-63.7	133.1	166.3	-61.3	-54	0	0	0	109.6	P917 I979 R990 L1007 P1077 W1078	P917-F1032 HydrophobicContact CG-CD1 4.37Å; P917-F1032 HydrophobicContact CG-CD2 4.43Å; P917-F1032 HydrophobicContact CG-CE1 3.75Å; P917-F1032 HydrophobicContact CG-CE2 3.82Å; P917-F1032 HydrophobicContact CG-CZ 3.44Å; P917-F1032 VanDerWaalsContact CG-CZ 3.44Å; I979-F1032 HydrophobicContact CD1-CZ 4.04Å; I979-F1032 HydrophobicContact CG2-CZ 4.4Å; R990-F1032 HydrophobicContact CB-CE1 4.46Å; L1007-F1032 HydrophobicContact CB-CB 4.38Å; L1007-F1032 HydrophobicContact CB-CD1 3.52Å; L1007-F1032 HydrophobicContact CB-CE1 3.92Å; L1007-F1032 HydrophobicContact CB-CG 3.98Å; L1007-F1032 HydrophobicContact CD1-CD1 4.02Å; L1007-F1032 HydrophobicContact CD1-CE1 3.5Å; L1007-F1032 VanDerWaalsContact CD1-CE1 3.5Å; L1007-F1032 HydrophobicContact CD1-CE2 4.32Å; L1007-F1032 HydrophobicContact CD1-CZ 3.66Å; L1007-F1032 HydrophobicContact CD2-CD2 4.5Å; L1007-F1032 HydrophobicContact CG-CD1 4.26Å; L1007-F1032 HydrophobicContact CG-CE1 4.23Å; F1032-P1077 HydrophobicContact CD2-CB 4.22Å; F1032-W1078 HydrophobicContact CD2-CE3 4.18Å; F1032-W1078 AromaticContact CE2-CE3 3.71Å; F1032-W1078 HydrophobicContact CE2-CE3 3.71Å; F1032-W1078 AromaticContact CE2-CZ3 3.89Å; F1032-W1078 HydrophobicContact CE2-CZ3 3.89Å; F1032-W1078 HydrophobicContact CZ-CE3 4.45Å; F1032-W1078 HydrophobicContact CZ-CZ3 4.43Å
1033	Q	93.1	Very high	88.9	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.217	C	C	.	.			trans	-92.1	-20	-169.8	-62.7	-61.3	-65	0	0	113.4	L944 Q945 P946 D949 L953 D1008 L1030 P1031	L944-Q1033 VanDerWaalsContact O-O 3.11Å; Q945-Q1033 WeakPolarHBondContact CA-O 3.5Å; P946-Q1033 WeakPolarHBondContact CD-O 3.2Å; D949-Q1033 VanDerWaalsContact CB-OE1 3.22Å; L953-Q1033 HydrophobicContact CB-CG 4.24Å; L953-Q1033 HydrophobicContact CD1-CG 4.16Å; L953-Q1033 HydrophobicContact CD2-CB 4.09Å; L953-Q1033 HydrophobicContact CD2-CG 4.18Å; L953-Q1033 HydrophobicContact CG-CG 4.43Å; D1008-Q1033 HydrophobicContact CB-CB 4.3Å; D1008-Q1033 PolarHBondContact OD1-N 2.99Å; L1030-Q1033 HydrophobicContact CD2-CG 4Å; L1030-Q1033 HydrophobicContact CG-CG 4.48Å; P1031-Q1033 PolarHBondContact O-N 3.32Å; P1031-Q1033 PolarHBondContact O-NE2 2.85Å
1034	G	93.2	Very high	87.6	Confident	10 Å²	10	49.5 Å²	49.5	10%	0.103	25%	0.252	C	S	.	.			trans	-86.4	120.1	177.6	0	0	0	0	0	111.5	L1007 D1008	L1007-G1034 PolarHBondContact O-N 2.79Å; D1008-G1034 WeakPolarHBondContact O-CA 3.4Å; D1008-G1034 PolarHBondContact O-N 3.11Å; D1008-G1034 VanDerWaalsContact O-N 3.13Å
1035	I	93	Very high	86.5	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.051	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131	178.3	-36.1	160.7	0	0	0	109.1	L920 L922 V943 L944 P946 L1082	L920-I1035 HydrophobicContact CD2-CD1 3.53Å; L920-I1035 HydrophobicContact CD2-CG1 3.71Å; L922-I1035 HydrophobicContact CD2-CD1 3.84Å; V943-I1035 CarbonylContact C-O 3.6Å; V943-I1035 VanDerWaalsContact CA-O 3.31Å; V943-I1035 WeakPolarHBondContact CA-O 3.37Å; L944-I1035 HydrophobicContact CB-CD1 4.49Å; L944-I1035 PolarHBondContact N-O 2.91Å; L944-I1035 PolarHBondContact O-N 3.46Å; P946-I1035 HydrophobicContact CG-CD1 4.37Å; I1035-L1082 HydrophobicContact CD1-CD1 4.19Å; I1035-L1082 HydrophobicContact CG2-CD1 3.85Å; I1035-L1082 HydrophobicContact CG2-CD2 4.43Å; I1035-L1082 HydrophobicContact CG2-CG 3.81Å
1036	H	94.5	Very high	85.9	Confident	36 Å²	36	54.1 Å²	54.1	17%	0.167	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	140.8	172.3	-73	-173.4	0	0	0	110.9	H941 Y1005 K1081 L1082	H941-H1036 AromaticContact NE2-CE1 3.73Å; H941-H1036 AromaticContact NE2-ND1 3.93Å; H941-H1036 AromaticContact NE2-NE2 3.81Å; Y1005-H1036 AromaticContact CZ-NE2 3.52Å; Y1005-H1036 PolarHBondContact OH-CD2 3.01Å; Y1005-H1036 PolarHBondContact OH-NE2 3.15Å; H1036-K1081 HydrophobicContact CB-CB 4.4Å; H1036-K1081 HydrophobicContact CB-CG 4.13Å; H1036-K1081 CarbonylContact O-C 3.6Å; H1036-K1081 VanDerWaalsContact O-CA 3.32Å; H1036-K1081 WeakPolarHBondContact O-CA 3.38Å; H1036-L1082 PolarHBondContact O-N 3.21Å
1037	A	95.4	Very high	85.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	160.1	179.3	0	0	0	0	0	112.8	H941 F942 L944 L1082 V1084	H941-A1037 WeakPolarHBondContact CA-O 3.33Å; F942-A1037 HydrophobicContact CD2-CB 3.71Å; F942-A1037 HydrophobicContact CE1-CB 4.42Å; F942-A1037 HydrophobicContact CE2-CB 3.3Å; F942-A1037 HydrophobicContact CG-CB 4.41Å; F942-A1037 HydrophobicContact CZ-CB 3.72Å; F942-A1037 PolarHBondContact N-O 2.85Å; F942-A1037 PolarHBondContact O-N 2.91Å; L944-A1037 HydrophobicContact CD1-CB 3.69Å; L944-A1037 HydrophobicContact CG-CB 3.83Å; A1037-L1082 CarbonylContact C-O 3.6Å; A1037-L1082 VanDerWaalsContact CA-O 3.23Å; A1037-L1082 WeakPolarHBondContact CA-O 3.28Å; A1037-L1082 HydrophobicContact CB-CB 4.37Å; A1037-V1084 HydrophobicContact CB-CG2 4.43Å
1038	Q	94.7	Very high	85.5	Confident	54 Å²	54	53.9 Å²	53.9	25%	0.252	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	156.4	167.7	63.1	179.8	44.3	0	0	109.9	P939 F942 L1082 S1083 V1084	P939-Q1038 CarbonylContact O-C 3.49Å; P939-Q1038 WeakPolarHBondContact O-CA 3.42Å; F942-Q1038 VanDerWaalsContact CE1-CA 3.49Å; Q1038-L1082 WeakPolarHBondContact CG-O 3.38Å; Q1038-L1082 PolarHBondContact N-O 3.41Å; Q1038-S1083 PolarHBondContact NE2-OG 3.35Å; Q1038-V1084 PolarHBondContact O-N 3.44Å
1039	L	94.9	Very high	85	Confident	10 Å²	10	60 Å²	60	5%	0.052	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.9	-179	-169.2	65.7	0	0	0	109.5	P939 F942 V1042 F1055 V1084 L1086 I1098 H1099 M1102	P939-L1039 HydrophobicContact CB-CB 3.99Å; P939-L1039 HydrophobicContact CB-CD2 4.12Å; P939-L1039 PolarHBondContact O-N 3.34Å; F942-L1039 HydrophobicContact CE1-CB 4.16Å; L1039-V1042 HydrophobicContact CD2-CG2 3.84Å; L1039-V1042 HydrophobicContact CG-CG2 4.28Å; L1039-F1055 HydrophobicContact CB-CE2 4.44Å; L1039-F1055 HydrophobicContact CD1-CE2 4.41Å; L1039-F1055 HydrophobicContact CD2-CD2 4.21Å; L1039-F1055 HydrophobicContact CD2-CE2 3.87Å; L1039-F1055 HydrophobicContact CG-CE2 4.49Å; L1039-V1084 WeakPolarHBondContact CA-O 3.43Å; L1039-L1086 HydrophobicContact CD1-CB 4.01Å; L1039-L1086 HydrophobicContact CD1-CD1 4.35Å; L1039-L1086 HydrophobicContact CD1-CG 4.11Å; L1039-I1098 HydrophobicContact CD1-CB 4.41Å; L1039-I1098 HydrophobicContact CD1-CG2 4.49Å; L1039-I1098 HydrophobicContact CD2-CG2 4.24Å; L1039-H1099 HydrophobicContact CD1-CB 4.39Å; L1039-H1099 HydrophobicContact CD2-CB 4.19Å; L1039-H1099 HydrophobicContact CG-CB 4.16Å; L1039-M1102 HydrophobicContact CD2-CB 4.16Å; L1039-M1102 HydrophobicContact CD2-CG 3.79Å
1040	A	92.6	Very high	84.7	Confident	2 Å²	2	57.7 Å²	57.7	2%	0.017	29%	0.289	C	S	.	.	S	Bend	trans	-69.8	163.9	172.1	0	0	0	0	0	111.4	V1042 E1069 V1084 F1085 H1099	A1040-V1042 PolarHBondContact O-N 3.15Å; A1040-E1069 HydrophobicContact CB-CB 3.93Å; A1040-E1069 VanDerWaalsContact CB-CD 3.46Å; A1040-E1069 HydrophobicContact CB-CG 4.25Å; A1040-E1069 WeakPolarHBondContact CB-OE2 3.39Å; A1040-V1084 VanDerWaalsContact CB-C 3.47Å; A1040-V1084 WeakPolarHBondContact CB-O 3.4Å; A1040-V1084 PolarHBondContact N-O 2.97Å; A1040-F1085 HydrophobicContact CB-CD1 3.75Å; A1040-F1085 HydrophobicContact CB-CD2 3.67Å; A1040-F1085 HydrophobicContact CB-CE1 3.7Å; A1040-F1085 HydrophobicContact CB-CE2 3.6Å; A1040-F1085 HydrophobicContact CB-CG 3.74Å; A1040-F1085 HydrophobicContact CB-CZ 3.62Å; A1040-H1099 WeakPolarHBondContact O-CB 3.41Å
1041	G	87	Confident	84.3	Confident	55 Å²	55	57.1 Å²	57.1	57%	0.567	29%	0.288	S	S	*	.	S	Bend	trans	77	-23.7	176.4	0	0	0	0	0	116.5
1042	V	86	Confident	84	Confident	25 Å²	25	56.8 Å²	56.8	15%	0.152	29%	0.286	C	S	.	.	S	Bend	trans	-98.8	133.9	-180	-160.3	0	0	0	0	111.2	L1039 A1040 Q1044 W1047 H1099 M1102	L1039-V1042 HydrophobicContact CD2-CG2 3.84Å; L1039-V1042 HydrophobicContact CG-CG2 4.28Å; A1040-V1042 PolarHBondContact O-N 3.15Å; V1042-Q1044 PolarHBondContact O-N 3.39Å; V1042-W1047 HydrophobicContact CB-CH2 4.05Å; V1042-W1047 HydrophobicContact CG1-CH2 3.61Å; V1042-W1047 HydrophobicContact CG1-CZ3 3.99Å; V1042-H1099 HydrophobicContact CG2-CB 3.87Å; V1042-M1102 HydrophobicContact CG2-CB 3.93Å
1043	K	76.8	Confident	83	Confident	164 Å²	164	59.6 Å²	59.6	71%	0.713	30%	0.301	S	S	*	.			trans	-66.9	130.4	179.6	-70.2	176.1	-177.3	166.9	0	110.7	R1045	K1043-R1045 PolarHBondContact O-N 2.71Å
1044	Q	64.1	Low	82.5	Confident	160 Å²	160	60.8 Å²	60.8	75%	0.748	31%	0.308	S	S	*	.			trans	-66.7	89.3	178.9	-170.1	175.9	4.2	0	0	111.5	V1042	V1042-Q1044 PolarHBondContact O-N 3.39Å
1045	R	63.5	Low	82.3	Confident	126 Å²	126	60.3 Å²	60.3	48%	0.475	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-96.9	172.6	168.8	-65.5	-176.5	177.9	167.5	3.8	109.8	K1043 W1047 A1106	K1043-R1045 PolarHBondContact O-N 2.71Å; R1045-W1047 PolarHBondContact O-N 2.9Å; R1045-A1106 PolarHBondContact NH1-O 2.74Å
1046	L	69.5	Low	81.9	Confident	177 Å²	177	64.2 Å²	64.2	93%	0.927	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-62.9	119.5	157.7	-74.6	164.2	0	0	0	107	S1048	L1046-S1048 PolarHBondContact O-N 2.72Å
1047	W	80.3	Confident	81.2	Confident	53 Å²	53	67 Å²	67	20%	0.201	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-74.2	125.1	177.2	-56.9	107.8	0	0	0	108.9	H938 P939 V1042 R1045	H938-W1047 HydrophobicContact CB-CB 4.05Å; H938-W1047 HydrophobicContact CB-CG 4.01Å; H938-W1047 AromaticContact CD2-CD1 3.89Å; H938-W1047 AromaticContact CG-CD1 3.58Å; H938-W1047 AromaticContact ND1-CD1 3.69Å; P939-W1047 HydrophobicContact CB-CD2 4.24Å; P939-W1047 HydrophobicContact CB-CE3 4.29Å; P939-W1047 HydrophobicContact CB-CH2 3.75Å; P939-W1047 HydrophobicContact CB-CZ2 3.68Å; P939-W1047 HydrophobicContact CB-CZ3 4.06Å; P939-W1047 HydrophobicContact CG-CD2 3.94Å; P939-W1047 HydrophobicContact CG-CE3 3.73Å; P939-W1047 HydrophobicContact CG-CH2 4Å; P939-W1047 HydrophobicContact CG-CZ2 4.2Å; P939-W1047 HydrophobicContact CG-CZ3 3.76Å; V1042-W1047 HydrophobicContact CB-CH2 4.05Å; V1042-W1047 HydrophobicContact CG1-CH2 3.61Å; V1042-W1047 HydrophobicContact CG1-CZ3 3.99Å; R1045-W1047 PolarHBondContact O-N 2.9Å
1048	S	80.6	Confident	80.8	Confident	29 Å²	29	70 Å²	70	20%	0.203	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-67	163.4	169.9	88.7	0	0	0	0	110.1	L1046 E1050 A1051 S1052 Q1109	L1046-S1048 PolarHBondContact O-N 2.72Å; S1048-E1050 VanDerWaalsContact C-N 3.29Å; S1048-E1050 WeakPolarHBondContact CB-OE2 3.26Å; S1048-E1050 PolarHBondContact O-N 3.26Å; S1048-E1050 PolarHBondContact OG-N 3.11Å; S1048-E1050 PolarHBondContact OG-OE2 2.99Å; S1048-A1051 PolarHBondContact O-N 3.42Å; S1048-A1051 PolarHBondContact OG-N 2.9Å; S1048-A1051 VanDerWaalsContact OG-N 3.17Å; S1048-S1052 WeakPolarHBondContact O-CB 3.34Å; S1048-S1052 PolarHBondContact O-N 2.81Å; S1048-S1052 PolarHBondContact O-OG 3.09Å; S1048-Q1109 PolarHBondContact OG-NE2 3.11Å
1049	E	74.8	Confident	80.4	Confident	145 Å²	145	67.5 Å²	67.5	68%	0.678	34%	0.335	S	S	*	.	H	α-helix	trans	-64.8	-39	178.8	-176.9	158.3	-162.4	0	0	110.7	S1052 I1053	E1049-S1052 CarbonylContact O-C 3.59Å; E1049-S1052 WeakPolarHBondContact O-CB 3.27Å; E1049-S1052 PolarHBondContact O-N 3.49Å; E1049-I1053 HydrophobicContact CG-CD1 3.92Å; E1049-I1053 VanDerWaalsContact O-CG1 3.29Å; E1049-I1053 WeakPolarHBondContact O-CG1 3.44Å; E1049-I1053 PolarHBondContact O-N 2.94Å
1050	E	75.8	Confident	80.1	Confident	101 Å²	101	69.1 Å²	69.1	47%	0.472	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-50.5	176.3	-50.1	71.7	-154.7	0	0	111	S1048 S1052 I1053 V1054 F1105	S1048-E1050 VanDerWaalsContact C-N 3.29Å; S1048-E1050 WeakPolarHBondContact CB-OE2 3.26Å; S1048-E1050 PolarHBondContact O-N 3.26Å; S1048-E1050 PolarHBondContact OG-N 3.11Å; S1048-E1050 PolarHBondContact OG-OE2 2.99Å; E1050-S1052 PolarHBondContact O-N 3.13Å; E1050-I1053 PolarHBondContact O-N 2.85Å; E1050-I1053 VanDerWaalsContact O-N 3.16Å; E1050-V1054 WeakPolarHBondContact O-CG2 3.47Å; E1050-V1054 PolarHBondContact O-N 3.14Å; E1050-F1105 HydrophobicContact CB-CE1 4.25Å
1051	A	77.4	Confident	79.4	Confident	9 Å²	9	72.9 Å²	72.9	7%	0.074	36%	0.359	C	S	.	.	H	α-helix	trans	-61.1	-33.2	176.3	0	0	0	0	0	112.1	S1048 F1055 M1102	S1048-A1051 PolarHBondContact O-N 3.42Å; S1048-A1051 PolarHBondContact OG-N 2.9Å; S1048-A1051 VanDerWaalsContact OG-N 3.17Å; A1051-F1055 WeakPolarHBondContact O-CB 3.36Å; A1051-F1055 PolarHBondContact O-N 2.79Å; A1051-M1102 HydrophobicContact CB-CE 4.02Å; A1051-M1102 WeakPolarHBondContact O-CE 3.24Å
1052	S	83.8	Confident	79.2	Confident	13 Å²	13	72.2 Å²	72.2	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-71.5	-38.7	176.3	-56.8	0	0	0	0	112.2	H938 S1048 E1049 E1050 R1056	H938-S1052 WeakPolarHBondContact CB-OG 3.31Å; S1048-S1052 WeakPolarHBondContact O-CB 3.34Å; S1048-S1052 PolarHBondContact O-N 2.81Å; S1048-S1052 PolarHBondContact O-OG 3.09Å; E1049-S1052 CarbonylContact O-C 3.59Å; E1049-S1052 WeakPolarHBondContact O-CB 3.27Å; E1049-S1052 PolarHBondContact O-N 3.49Å; E1050-S1052 PolarHBondContact O-N 3.13Å; S1052-R1056 WeakPolarHBondContact O-CB 3.03Å; S1052-R1056 PolarHBondContact O-N 2.8Å
1053	I	72.4	Confident	79	Confident	71 Å²	71	71.3 Å²	71.3	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-66.5	-48.5	173.7	-70.2	162.8	0	0	0	110.5	E1049 E1050 F1055 R1056 N1057	E1049-I1053 HydrophobicContact CG-CD1 3.92Å; E1049-I1053 VanDerWaalsContact O-CG1 3.29Å; E1049-I1053 WeakPolarHBondContact O-CG1 3.44Å; E1049-I1053 PolarHBondContact O-N 2.94Å; E1050-I1053 PolarHBondContact O-N 2.85Å; E1050-I1053 VanDerWaalsContact O-N 3.16Å; I1053-F1055 VanDerWaalsContact C-N 3.34Å; I1053-F1055 PolarHBondContact O-N 2.9Å; I1053-R1056 PolarHBondContact O-N 2.75Å; I1053-N1057 WeakPolarHBondContact O-CB 3.49Å; I1053-N1057 PolarHBondContact O-N 3.39Å; I1053-N1057 PolarHBondContact O-ND2 3.46Å
1054	V	82.8	Confident	79.6	Confident	26 Å²	26	63.5 Å²	63.5	16%	0.158	30%	0.301	C	S	.	.	H	α-helix	trans	-56	-50.1	176.9	170.4	0	0	0	0	110.1	E1050 R1056 N1057 H1058 I1101 M1102 F1105	E1050-V1054 WeakPolarHBondContact O-CG2 3.47Å; E1050-V1054 PolarHBondContact O-N 3.14Å; V1054-R1056 PolarHBondContact O-N 2.66Å; V1054-N1057 PolarHBondContact O-N 3.01Å; V1054-H1058 PolarHBondContact O-N 3.32Å; V1054-H1058 VanDerWaalsContact O-N 3.13Å; V1054-H1058 PolarHBondContact O-ND1 3.18Å; V1054-I1101 HydrophobicContact CG1-CG2 4.33Å; V1054-M1102 HydrophobicContact CG1-SD 4.07Å; V1054-F1105 HydrophobicContact CG1-CD2 4.44Å; V1054-F1105 HydrophobicContact CG2-CD2 4.33Å; V1054-F1105 HydrophobicContact CG2-CE1 4.06Å; V1054-F1105 HydrophobicContact CG2-CE2 3.84Å; V1054-F1105 HydrophobicContact CG2-CZ 3.69Å
1055	F	88.6	Confident	80.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.5	-49.3	176.4	-179.4	-109.2	0	0	0	112.3	A936 P939 F942 L1039 A1051 I1053 N1057 H1058 V1059 L1086 I1098 M1102	A936-F1055 HydrophobicContact CB-CD1 4.28Å; A936-F1055 HydrophobicContact CB-CE1 3.96Å; P939-F1055 HydrophobicContact CB-CD2 4.1Å; P939-F1055 HydrophobicContact CB-CE2 4.29Å; P939-F1055 HydrophobicContact CB-CG 4.23Å; P939-F1055 HydrophobicContact CG-CB 3.76Å; P939-F1055 HydrophobicContact CG-CD1 4.14Å; P939-F1055 HydrophobicContact CG-CD2 3.78Å; P939-F1055 HydrophobicContact CG-CE2 4.44Å; P939-F1055 HydrophobicContact CG-CG 3.6Å; F942-F1055 HydrophobicContact CB-CE1 4.11Å; F942-F1055 AromaticContact CD1-CE1 3.5Å; F942-F1055 HydrophobicContact CD1-CE1 3.5Å; F942-F1055 AromaticContact CD1-CZ 3.33Å; F942-F1055 HydrophobicContact CD1-CZ 3.33Å; F942-F1055 HydrophobicContact CE1-CE1 4.13Å; F942-F1055 HydrophobicContact CE1-CE2 4.43Å; F942-F1055 AromaticContact CE1-CZ 3.49Å; F942-F1055 HydrophobicContact CE1-CZ 3.49Å; F942-F1055 VanDerWaalsContact CE1-CZ 3.49Å; F942-F1055 HydrophobicContact CG-CE1 4.02Å; F942-F1055 AromaticContact CG-CZ 3.96Å; F942-F1055 HydrophobicContact CG-CZ 3.96Å; F942-F1055 HydrophobicContact CZ-CZ 4.26Å; L1039-F1055 HydrophobicContact CB-CE2 4.44Å; L1039-F1055 HydrophobicContact CD1-CE2 4.41Å; L1039-F1055 HydrophobicContact CD2-CD2 4.21Å; L1039-F1055 HydrophobicContact CD2-CE2 3.87Å; L1039-F1055 HydrophobicContact CG-CE2 4.49Å; A1051-F1055 WeakPolarHBondContact O-CB 3.36Å; A1051-F1055 PolarHBondContact O-N 2.79Å; I1053-F1055 VanDerWaalsContact C-N 3.34Å; I1053-F1055 PolarHBondContact O-N 2.9Å; F1055-N1057 PolarHBondContact O-N 2.87Å; F1055-H1058 PolarHBondContact O-N 2.73Å; F1055-H1058 VanDerWaalsContact O-N 3.08Å; F1055-V1059 HydrophobicContact CD1-CG2 4.04Å; F1055-V1059 HydrophobicContact CD2-CG1 4.13Å; F1055-V1059 HydrophobicContact CD2-CG2 4.44Å; F1055-V1059 HydrophobicContact CE1-CG2 3.58Å; F1055-V1059 HydrophobicContact CE2-CB 4.5Å; F1055-V1059 HydrophobicContact CE2-CG1 3.67Å; F1055-V1059 HydrophobicContact CE2-CG2 4Å; F1055-V1059 HydrophobicContact CG-CG2 4.46Å; F1055-V1059 HydrophobicContact CZ-CB 4.39Å; F1055-V1059 HydrophobicContact CZ-CG1 4.01Å; F1055-V1059 HydrophobicContact CZ-CG2 3.54Å; F1055-V1059 WeakPolarHBondContact O-CG2 3.39Å; F1055-V1059 PolarHBondContact O-N 3.18Å; F1055-L1086 HydrophobicContact CE2-CD1 4.44Å; F1055-L1086 HydrophobicContact CZ-CD1 4.3Å; F1055-I1098 HydrophobicContact CD2-CG2 4Å; F1055-I1098 HydrophobicContact CE2-CG2 3.93Å; F1055-M1102 HydrophobicContact CB-CE 4.31Å; F1055-M1102 HydrophobicContact CB-SD 3.77Å; F1055-M1102 HydrophobicContact CD2-CG 4.11Å; F1055-M1102 HydrophobicContact CD2-SD 4.19Å; F1055-M1102 HydrophobicContact CG-SD 4.48Å
1056	R	84.7	Confident	82.3	Confident	93 Å²	93	49.9 Å²	49.9	35%	0.351	24%	0.243	S	C	.	.	H	α-helix	trans	-59.6	-44.2	-179.2	-166.5	-177.4	-48.5	145.8	16.9	112	A936 C937 S1052 I1053 V1054 H1058 V1059 E1060	A936-R1056 HydrophobicContact CB-CG 4.39Å; A936-R1056 WeakPolarHBondContact O-CD 3.1Å; A936-R1056 WeakPolarHBondContact O-CG 3.28Å; A936-R1056 PolarHBondContact O-NE 2.83Å; C937-R1056 PolarHBondContact O-NH2 2.82Å; S1052-R1056 WeakPolarHBondContact O-CB 3.03Å; S1052-R1056 PolarHBondContact O-N 2.8Å; I1053-R1056 PolarHBondContact O-N 2.75Å; V1054-R1056 PolarHBondContact O-N 2.66Å; R1056-H1058 PolarHBondContact O-N 3.04Å; R1056-V1059 PolarHBondContact O-N 3.21Å; R1056-E1060 HydrophobicContact CG-CB 3.65Å; R1056-E1060 HydrophobicContact CG-CG 4.27Å; R1056-E1060 VanDerWaalsContact O-CB 3.25Å; R1056-E1060 WeakPolarHBondContact O-CB 3.42Å; R1056-E1060 PolarHBondContact O-N 3.11Å
1057	N	80.3	Confident	83.5	Confident	95 Å²	95	43.9 Å²	43.9	51%	0.508	21%	0.21	S	C	.	.	H	α-helix	trans	-62.7	-30.9	176.7	-67.4	-12.9	0	0	0	112.7	I1053 V1054 F1055 K1062	I1053-N1057 WeakPolarHBondContact O-CB 3.49Å; I1053-N1057 PolarHBondContact O-N 3.39Å; I1053-N1057 PolarHBondContact O-ND2 3.46Å; V1054-N1057 PolarHBondContact O-N 3.01Å; F1055-N1057 PolarHBondContact O-N 2.87Å; N1057-K1062 VanDerWaalsContact O-CE 3.31Å; N1057-K1062 WeakPolarHBondContact O-CE 3.4Å; N1057-K1062 PolarHBondContact O-NZ 2.98Å
1058	H	85.8	Confident	84	Confident	63 Å²	63	41.5 Å²	41.5	29%	0.292	20%	0.201	S	C	.	.	H	α-helix	trans	-80.6	-31.3	177.9	-75.2	89.3	0	0	0	113.3	V1054 F1055 R1056 K1062 I1098	V1054-H1058 PolarHBondContact O-N 3.32Å; V1054-H1058 VanDerWaalsContact O-N 3.13Å; V1054-H1058 PolarHBondContact O-ND1 3.18Å; F1055-H1058 PolarHBondContact O-N 2.73Å; F1055-H1058 VanDerWaalsContact O-N 3.08Å; R1056-H1058 PolarHBondContact O-N 3.04Å; H1058-K1062 WeakPolarHBondContact O-CD 3.39Å; H1058-K1062 VanDerWaalsContact O-CE 3.31Å; H1058-K1062 WeakPolarHBondContact O-CE 3.24Å; H1058-K1062 PolarHBondContact O-NZ 3.23Å; H1058-I1098 HydrophobicContact CB-CD1 4.26Å; H1058-I1098 HydrophobicContact CB-CG2 4.5Å
1059	V	87.1	Confident	84.6	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-119	-33.7	-171.6	-48.1	0	0	0	0	116.6	V933 A936 F1055 R1056 K1061 K1062 L1064 L1086 I1098	V933-V1059 VanDerWaalsContact CB-O 3.29Å; V933-V1059 WeakPolarHBondContact CB-O 3.43Å; V933-V1059 HydrophobicContact CG1-CG2 4.06Å; V933-V1059 HydrophobicContact CG2-CB 4.23Å; A936-V1059 HydrophobicContact CB-CG2 3.59Å; F1055-V1059 HydrophobicContact CD1-CG2 4.04Å; F1055-V1059 HydrophobicContact CD2-CG1 4.13Å; F1055-V1059 HydrophobicContact CD2-CG2 4.44Å; F1055-V1059 HydrophobicContact CE1-CG2 3.58Å; F1055-V1059 HydrophobicContact CE2-CB 4.5Å; F1055-V1059 HydrophobicContact CE2-CG1 3.67Å; F1055-V1059 HydrophobicContact CE2-CG2 4Å; F1055-V1059 HydrophobicContact CG-CG2 4.46Å; F1055-V1059 HydrophobicContact CZ-CB 4.39Å; F1055-V1059 HydrophobicContact CZ-CG1 4.01Å; F1055-V1059 HydrophobicContact CZ-CG2 3.54Å; F1055-V1059 WeakPolarHBondContact O-CG2 3.39Å; F1055-V1059 PolarHBondContact O-N 3.18Å; R1056-V1059 PolarHBondContact O-N 3.21Å; V1059-K1061 PolarHBondContact O-N 2.79Å; V1059-K1062 WeakPolarHBondContact O-CB 3.44Å; V1059-K1062 PolarHBondContact O-N 3.02Å; V1059-L1064 HydrophobicContact CB-CD1 3.89Å; V1059-L1064 HydrophobicContact CG1-CD1 3.99Å; V1059-L1086 HydrophobicContact CB-CD1 4.2Å; V1059-L1086 HydrophobicContact CG1-CD1 3.79Å; V1059-I1098 HydrophobicContact CG1-CB 4.43Å; V1059-I1098 HydrophobicContact CG1-CG1 4.05Å; V1059-I1098 HydrophobicContact CG1-CG2 3.68Å
1060	E	87.7	Confident	85.5	Confident	45 Å²	45	39.1 Å²	39.1	21%	0.21	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	134.9	-168.6	-173.8	169.3	-100.2	0	0	111.4	V935 A936 R1056 K1062	V935-E1060 WeakPolarHBondContact CA-OE1 3.32Å; A936-E1060 HydrophobicContact CB-CB 4.04Å; A936-E1060 PolarHBondContact N-OE1 3.2Å; R1056-E1060 HydrophobicContact CG-CB 3.65Å; R1056-E1060 HydrophobicContact CG-CG 4.27Å; R1056-E1060 VanDerWaalsContact O-CB 3.25Å; R1056-E1060 WeakPolarHBondContact O-CB 3.42Å; R1056-E1060 PolarHBondContact O-N 3.11Å; E1060-K1062 PolarHBondContact O-N 3.24Å
1061	K	78.3	Confident	86.2	Confident	81 Å²	81	37.7 Å²	37.7	35%	0.352	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	28.3	-177.9	-64.6	158.2	-176.3	171.7	0	113.7	L113 Y932 V933 V1059	L113-K1061 HydrophobicContact CD1-CD 3.89Å; L113-K1061 HydrophobicContact CD2-CB 3.66Å; L113-K1061 HydrophobicContact CD2-CD 3.81Å; L113-K1061 HydrophobicContact CD2-CG 4.43Å; Y932-K1061 WeakPolarHBondContact CE2-O 3.17Å; Y932-K1061 VanDerWaalsContact OH-CA 3.3Å; Y932-K1061 WeakPolarHBondContact OH-CA 3.43Å; Y932-K1061 WeakPolarHBondContact OH-CB 3.43Å; Y932-K1061 PolarHBondContact OH-O 3.25Å; V933-K1061 VanDerWaalsContact O-CA 3.27Å; V933-K1061 WeakPolarHBondContact O-CA 3.32Å; V933-K1061 PolarHBondContact O-N 3.07Å; V1059-K1061 PolarHBondContact O-N 2.79Å
1062	K	82.3	Confident	86.8	Confident	41 Å²	41	43.4 Å²	43.4	18%	0.178	21%	0.213	C	C	.	.			trans	-112.4	147.8	174.2	-59.8	-165.9	-162.3	166.7	0	113.3	Y932 V933 N1057 H1058 V1059 E1060 L1064	Y932-K1062 WeakPolarHBondContact CD2-O 3.4Å; V933-K1062 PolarHBondContact N-O 3.17Å; V933-K1062 VanDerWaalsContact N-O 3.07Å; N1057-K1062 VanDerWaalsContact O-CE 3.31Å; N1057-K1062 WeakPolarHBondContact O-CE 3.4Å; N1057-K1062 PolarHBondContact O-NZ 2.98Å; H1058-K1062 WeakPolarHBondContact O-CD 3.39Å; H1058-K1062 VanDerWaalsContact O-CE 3.31Å; H1058-K1062 WeakPolarHBondContact O-CE 3.24Å; H1058-K1062 PolarHBondContact O-NZ 3.23Å; V1059-K1062 WeakPolarHBondContact O-CB 3.44Å; V1059-K1062 PolarHBondContact O-N 3.02Å; E1060-K1062 PolarHBondContact O-N 3.24Å; K1062-L1064 HydrophobicContact CB-CD2 4.4Å; K1062-L1064 HydrophobicContact CB-CG 4.34Å
1063	P	82.5	Confident	86.8	Confident	6 Å²	6	47.3 Å²	47.3	4%	0.039	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	125	164.3	32.5	-31.3	0	0	0	109.8	V114 A117 P119 V931 W947	V114-P1063 WeakPolarHBondContact O-CD 3.42Å; V114-P1063 WeakPolarHBondContact O-CG 3.41Å; A117-P1063 HydrophobicContact CB-CG 4.24Å; A117-P1063 VanDerWaalsContact O-CB 3.27Å; A117-P1063 WeakPolarHBondContact O-CB 3.47Å; A117-P1063 WeakPolarHBondContact O-CG 3.47Å; P119-P1063 HydrophobicContact CG-CB 3.91Å; V931-P1063 CarbonylContact O-C 3.41Å; V931-P1063 WeakPolarHBondContact O-CA 3.49Å; W947-P1063 HydrophobicContact CE3-CB 4.08Å; W947-P1063 HydrophobicContact CH2-CB 3.92Å; W947-P1063 HydrophobicContact CZ3-CB 3.66Å
1064	L	89.6	Confident	87.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	163.8	-178.2	-61.8	176.8	0	0	0	110.6	P119 V931 V933 V1059 K1062 L1086 D1088	P119-L1064 WeakPolarHBondContact CB-O 3.26Å; P119-L1064 WeakPolarHBondContact CG-O 3.47Å; V931-L1064 HydrophobicContact CG2-CB 4.21Å; V931-L1064 VanDerWaalsContact CG2-O 3.27Å; V931-L1064 WeakPolarHBondContact CG2-O 3.28Å; V931-L1064 PolarHBondContact N-O 2.78Å; V931-L1064 PolarHBondContact O-N 2.93Å; V933-L1064 HydrophobicContact CG2-CD1 3.78Å; V933-L1064 HydrophobicContact CG2-CG 4.46Å; V1059-L1064 HydrophobicContact CB-CD1 3.89Å; V1059-L1064 HydrophobicContact CG1-CD1 3.99Å; K1062-L1064 HydrophobicContact CB-CD2 4.4Å; K1062-L1064 HydrophobicContact CB-CG 4.34Å; L1064-L1086 HydrophobicContact CD1-CB 4.21Å; L1064-L1086 HydrophobicContact CD1-CD1 4.03Å; L1064-L1086 HydrophobicContact CD1-CD2 4.3Å; L1064-L1086 HydrophobicContact CD1-CG 4.42Å; L1064-D1088 HydrophobicContact CD2-CB 3.62Å
1065	V	91.3	Very high	87.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.9	163.5	-177.8	0	0	0	0	108.1	P119 Q120 L123 N928 V1087 T1089	P119-V1065 HydrophobicContact CB-CG2 3.55Å; Q120-V1065 WeakPolarHBondContact O-CG2 3.34Å; L123-V1065 HydrophobicContact CD2-CB 4.17Å; L123-V1065 HydrophobicContact CD2-CG1 4.08Å; L123-V1065 HydrophobicContact CD2-CG2 4.31Å; L123-V1065 HydrophobicContact CG-CG1 4.43Å; N928-V1065 HydrophobicContact CB-CG1 3.76Å; V1065-V1087 HydrophobicContact CB-CB 4.37Å; V1065-V1087 PolarHBondContact N-O 2.91Å; V1065-V1087 PolarHBondContact O-N 3.36Å; V1065-T1089 HydrophobicContact CB-CG2 4.38Å; V1065-T1089 HydrophobicContact CG2-CG2 3.63Å
1066	A	92.9	Very high	86.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.3	169.8	0	0	0	0	0	109.7	N928 M929 V931 L944 V1084 F1085 L1086	N928-A1066 CarbonylContact C-O 3.35Å; N928-A1066 WeakPolarHBondContact CA-O 3.35Å; M929-A1066 HydrophobicContact CE-CB 4.07Å; M929-A1066 HydrophobicContact CG-CB 4.13Å; M929-A1066 PolarHBondContact N-O 3.09Å; M929-A1066 PolarHBondContact O-N 3.29Å; V931-A1066 HydrophobicContact CB-CB 4.46Å; V931-A1066 HydrophobicContact CG1-CB 3.87Å; V931-A1066 HydrophobicContact CG2-CB 3.71Å; L944-A1066 HydrophobicContact CD1-CB 4.36Å; A1066-V1084 HydrophobicContact CB-CB 4.17Å; A1066-V1084 HydrophobicContact CB-CG1 4.29Å; A1066-V1084 HydrophobicContact CB-CG2 4.33Å; A1066-F1085 CarbonylContact C-O 3.57Å; A1066-F1085 WeakPolarHBondContact CA-O 3.47Å; A1066-L1086 HydrophobicContact CB-CD2 3.96Å
1067	Q	93.8	Very high	86.8	Confident	51 Å²	51	53.3 Å²	53.3	24%	0.238	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.9	167.1	-173.3	178.3	27.8	0	0	109.1	G926 N928 E1069 V1084 F1085	G926-Q1067 PolarHBondContact O-NE2 3.21Å; N928-Q1067 WeakPolarHBondContact OD1-CB 3.45Å; N928-Q1067 WeakPolarHBondContact OD1-CG 3.46Å; Q1067-E1069 PolarHBondContact O-N 3.29Å; Q1067-V1084 CarbonylContact O-C 3.53Å; Q1067-V1084 VanDerWaalsContact O-CA 3.25Å; Q1067-V1084 WeakPolarHBondContact O-CA 3.46Å; Q1067-F1085 HydrophobicContact CB-CB 4.31Å; Q1067-F1085 PolarHBondContact N-O 3.12Å; Q1067-F1085 PolarHBondContact O-N 3.34Å
1068	L	91.8	Very high	87	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	114.4	-174.8	-175.5	62.8	0	0	0	111.5	P923 I925 G926 H927 A1070 L1082 V1084	P923-L1068 VanDerWaalsContact O-CD2 3.32Å; P923-L1068 WeakPolarHBondContact O-CD2 3.27Å; I925-L1068 HydrophobicContact CG1-CD2 4.36Å; I925-L1068 HydrophobicContact CG1-CG 4.41Å; G926-L1068 PolarHBondContact N-O 3.16Å; H927-L1068 PolarHBondContact O-N 3.33Å; L1068-A1070 WeakPolarHBondContact CD1-O 3.26Å; L1068-L1082 HydrophobicContact CD1-CB 4.02Å; L1068-L1082 HydrophobicContact CD1-CD1 4.28Å; L1068-L1082 HydrophobicContact CD1-CD2 4.07Å; L1068-L1082 HydrophobicContact CD1-CG 4.34Å; L1068-V1084 HydrophobicContact CD1-CG1 3.99Å
1069	E	94.1	Very high	87	Confident	83 Å²	83	50.1 Å²	50.1	39%	0.388	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-49.2	176	179	-163.8	-132.6	0	0	111.2	I925 A1040 Q1067 S1083 F1085	I925-E1069 WeakPolarHBondContact CG2-O 3.45Å; A1040-E1069 HydrophobicContact CB-CB 3.93Å; A1040-E1069 VanDerWaalsContact CB-CD 3.46Å; A1040-E1069 HydrophobicContact CB-CG 4.25Å; A1040-E1069 WeakPolarHBondContact CB-OE2 3.39Å; Q1067-E1069 PolarHBondContact O-N 3.29Å; E1069-S1083 WeakPolarHBondContact CB-O 3.36Å; E1069-S1083 PolarHBondContact N-O 3.33Å; E1069-S1083 VanDerWaalsContact OE2-CB 3.25Å; E1069-S1083 WeakPolarHBondContact OE2-CB 3.34Å; E1069-S1083 PolarHBondContact OE2-OG 3.03Å; E1069-F1085 HydrophobicContact CB-CD2 4.29Å; E1069-F1085 HydrophobicContact CB-CE2 4.02Å; E1069-F1085 HydrophobicContact CG-CE2 4.15Å
1070	A	92	Very high	87.1	Confident	41 Å²	41	51.3 Å²	51.3	34%	0.339	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	159.1	-177.4	0	0	0	0	0	111.5	L1068 S1083	L1068-A1070 WeakPolarHBondContact CD1-O 3.26Å; A1070-S1083 PolarHBondContact N-O 2.88Å; A1070-S1083 VanDerWaalsContact N-O 3.15Å; A1070-S1083 PolarHBondContact O-N 2.96Å
1071	M	91.1	Very high	87.3	Confident	71 Å²	71	51 Å²	51	35%	0.35	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124.6	-178.5	-176.2	170.5	74.6	0	0	109.4	L922 R1080 L1082	L922-M1071 HydrophobicContact CD1-SD 4.01Å; M1071-R1080 PolarHBondContact SD-NH2 3.07Å; M1071-L1082 HydrophobicContact CB-CD2 4.26Å; M1071-L1082 HydrophobicContact CG-CD2 3.77Å; M1071-L1082 HydrophobicContact SD-CD2 4.34Å
1072	Q	90.1	Very high	88.1	Confident	130 Å²	130	47.3 Å²	47.3	61%	0.607	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	99.7	172.7	-177.4	170.5	46.2	0	0	108	R1080 K1081	Q1072-R1080 WeakPolarHBondContact O-CA 3.23Å; Q1072-K1081 HydrophobicContact CB-CB 4.36Å; Q1072-K1081 PolarHBondContact N-O 3.3Å; Q1072-K1081 PolarHBondContact O-N 2.98Å
1073	D	84.7	Confident	88.7	Confident	95 Å²	95	45.8 Å²	45.8	51%	0.508	24%	0.244	S	C	.	.			trans	-72.2	154.6	170.5	-66.2	-43.2	0	0	0	110.8	R1080	D1073-R1080 IonicContact OD1-CZ 2.76Å; D1073-R1080 IonicContact OD1-NE 2.65Å; D1073-R1080 PolarHBondContact OD1-NE 3.16Å; D1073-R1080 IonicContact OD1-NH2 2.61Å; D1073-R1080 PolarHBondContact OD1-NH2 2.87Å; D1073-R1080 VanDerWaalsContact OD1-NH2 3.1Å
1074	A	84.2	Confident	89.3	Confident	47 Å²	47	45.5 Å²	45.5	39%	0.388	24%	0.243	S	C	.	.			trans	-144.4	161.8	-177.3	0	0	0	0	0	110.5	N1076 D1079	A1074-N1076 PolarHBondContact O-N 3.1Å; A1074-D1079 HydrophobicContact CB-CB 3.68Å; A1074-D1079 WeakPolarHBondContact CB-O 3.43Å
1075	D	77.4	Confident	89.6	Confident	172 Å²	172	47.4 Å²	47.4	92%	0.92	25%	0.251	S	S	*	.	S	Bend	trans	-60.6	-29.4	-177.2	-64.4	-33.7	0	0	0	113.4
1076	N	83.9	Confident	89.8	Confident	62 Å²	62	47.4 Å²	47.4	33%	0.332	25%	0.251	S	S	.	.	S	Bend	trans	-109.1	142.9	174.1	-51	-68.9	0	0	0	111.5	A1074 W1078 D1079	A1074-N1076 PolarHBondContact O-N 3.1Å; N1076-W1078 HydrophobicContact CB-CD2 4.06Å; N1076-W1078 VanDerWaalsContact CB-CE2 3.44Å; N1076-W1078 HydrophobicContact CB-CG 4.39Å; N1076-W1078 HydrophobicContact CB-CH2 4.44Å; N1076-W1078 HydrophobicContact CB-CZ2 3.67Å; N1076-W1078 PolarHBondContact O-N 3.44Å; N1076-W1078 VanDerWaalsContact O-N 3.11Å; N1076-D1079 WeakPolarHBondContact CB-OD2 3.33Å; N1076-D1079 PolarHBondContact ND2-OD2 3.47Å; N1076-D1079 PolarHBondContact O-N 3.2Å
1077	P	81.3	Confident	89.8	Confident	34 Å²	34	47.4 Å²	47.4	22%	0.221	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-56.1	-31.7	-179.9	-28.5	36	0	0	0	115.6	L916 L919 F1032	L916-P1077 HydrophobicContact CD1-CG 4.4Å; L919-P1077 HydrophobicContact CD1-CB 3.86Å; L919-P1077 HydrophobicContact CD1-CG 4.39Å; F1032-P1077 HydrophobicContact CD2-CB 4.22Å
1078	W	85.3	Confident	89.6	Confident	23 Å²	23	45.5 Å²	45.5	9%	0.087	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-87.6	-4.6	-177.8	55.7	65.4	0	0	0	114.3	L916 I979 L992 L1007 F1032 N1076	L916-W1078 HydrophobicContact CD2-CH2 4.14Å; L916-W1078 HydrophobicContact CD2-CZ3 3.93Å; I979-W1078 HydrophobicContact CG2-CE3 4.39Å; I979-W1078 HydrophobicContact CG2-CH2 3.99Å; I979-W1078 HydrophobicContact CG2-CZ3 3.61Å; L992-W1078 HydrophobicContact CD1-CH2 4.19Å; L992-W1078 HydrophobicContact CD1-CZ2 3.93Å; L992-W1078 HydrophobicContact CD2-CD2 3.9Å; L992-W1078 HydrophobicContact CD2-CG 3.94Å; L992-W1078 HydrophobicContact CD2-CZ2 4.3Å; L1007-W1078 HydrophobicContact CD2-CB 3.56Å; L1007-W1078 HydrophobicContact CD2-CD2 3.92Å; L1007-W1078 HydrophobicContact CD2-CE3 3.68Å; L1007-W1078 HydrophobicContact CD2-CG 3.88Å; F1032-W1078 HydrophobicContact CD2-CE3 4.18Å; F1032-W1078 AromaticContact CE2-CE3 3.71Å; F1032-W1078 HydrophobicContact CE2-CE3 3.71Å; F1032-W1078 AromaticContact CE2-CZ3 3.89Å; F1032-W1078 HydrophobicContact CE2-CZ3 3.89Å; F1032-W1078 HydrophobicContact CZ-CE3 4.45Å; F1032-W1078 HydrophobicContact CZ-CZ3 4.43Å; N1076-W1078 HydrophobicContact CB-CD2 4.06Å; N1076-W1078 VanDerWaalsContact CB-CE2 3.44Å; N1076-W1078 HydrophobicContact CB-CG 4.39Å; N1076-W1078 HydrophobicContact CB-CH2 4.44Å; N1076-W1078 HydrophobicContact CB-CZ2 3.67Å; N1076-W1078 PolarHBondContact O-N 3.44Å; N1076-W1078 VanDerWaalsContact O-N 3.11Å
1079	D	85.9	Confident	89.1	Confident	68 Å²	68	46.1 Å²	46.1	36%	0.364	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-98.9	0.9	175.3	-63.4	-41.2	0	0	0	111.4	A1074 N1076	A1074-D1079 HydrophobicContact CB-CB 3.68Å; A1074-D1079 WeakPolarHBondContact CB-O 3.43Å; N1076-D1079 WeakPolarHBondContact CB-OD2 3.33Å; N1076-D1079 PolarHBondContact ND2-OD2 3.47Å; N1076-D1079 PolarHBondContact O-N 3.2Å
1080	R	89.1	Confident	88.3	Confident	25 Å²	25	44.8 Å²	44.8	9%	0.094	25%	0.246	C	C	.	.			trans	-70.6	130	177.1	-171.6	-172.8	-152.9	-176.7	9.2	110.9	L920 L922 M1071 Q1072 D1073	L920-R1080 PolarHBondContact O-NH1 3.41Å; L922-R1080 VanDerWaalsContact CD1-NH1 3.33Å; M1071-R1080 PolarHBondContact SD-NH2 3.07Å; Q1072-R1080 WeakPolarHBondContact O-CA 3.23Å; D1073-R1080 IonicContact OD1-CZ 2.76Å; D1073-R1080 IonicContact OD1-NE 2.65Å; D1073-R1080 PolarHBondContact OD1-NE 3.16Å; D1073-R1080 IonicContact OD1-NH2 2.61Å; D1073-R1080 PolarHBondContact OD1-NH2 2.87Å; D1073-R1080 VanDerWaalsContact OD1-NH2 3.1Å
1081	K	92.1	Very high	87.3	Confident	40 Å²	40	47.1 Å²	47.1	17%	0.174	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.9	-178.6	-163.4	-176.9	-171.4	-168.5	0	112.5	G940 H1036 Q1072	G940-K1081 PolarHBondContact O-NZ 2.65Å; H1036-K1081 HydrophobicContact CB-CB 4.4Å; H1036-K1081 HydrophobicContact CB-CG 4.13Å; H1036-K1081 CarbonylContact O-C 3.6Å; H1036-K1081 VanDerWaalsContact O-CA 3.32Å; H1036-K1081 WeakPolarHBondContact O-CA 3.38Å; Q1072-K1081 HydrophobicContact CB-CB 4.36Å; Q1072-K1081 PolarHBondContact N-O 3.3Å; Q1072-K1081 PolarHBondContact O-N 2.98Å
1082	L	94.3	Very high	86	Confident	2 Å²	2	52 Å²	52	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	144.6	174.9	-49.8	-176.6	0	0	0	111.5	L922 M929 I1035 H1036 A1037 Q1038 L1068 M1071 V1084	L922-L1082 HydrophobicContact CD1-CD1 3.92Å; L922-L1082 HydrophobicContact CD1-CD2 3.54Å; L922-L1082 HydrophobicContact CD1-CG 4.32Å; M929-L1082 HydrophobicContact CE-CD1 3.63Å; I1035-L1082 HydrophobicContact CD1-CD1 4.19Å; I1035-L1082 HydrophobicContact CG2-CD1 3.85Å; I1035-L1082 HydrophobicContact CG2-CD2 4.43Å; I1035-L1082 HydrophobicContact CG2-CG 3.81Å; H1036-L1082 PolarHBondContact O-N 3.21Å; A1037-L1082 CarbonylContact C-O 3.6Å; A1037-L1082 VanDerWaalsContact CA-O 3.23Å; A1037-L1082 WeakPolarHBondContact CA-O 3.28Å; A1037-L1082 HydrophobicContact CB-CB 4.37Å; Q1038-L1082 WeakPolarHBondContact CG-O 3.38Å; Q1038-L1082 PolarHBondContact N-O 3.41Å; L1068-L1082 HydrophobicContact CD1-CB 4.02Å; L1068-L1082 HydrophobicContact CD1-CD1 4.28Å; L1068-L1082 HydrophobicContact CD1-CD2 4.07Å; L1068-L1082 HydrophobicContact CD1-CG 4.34Å; M1071-L1082 HydrophobicContact CB-CD2 4.26Å; M1071-L1082 HydrophobicContact CG-CD2 3.77Å; M1071-L1082 HydrophobicContact SD-CD2 4.34Å; L1082-V1084 HydrophobicContact CB-CG1 3.85Å; L1082-V1084 HydrophobicContact CD1-CG1 4.45Å
1083	S	94.7	Very high	85	Confident	9 Å²	9	53.8 Å²	53.8	6%	0.063	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.9	159.2	-155.8	0	0	0	0	107.1	Q1038 E1069 A1070	Q1038-S1083 PolarHBondContact NE2-OG 3.35Å; E1069-S1083 WeakPolarHBondContact CB-O 3.36Å; E1069-S1083 PolarHBondContact N-O 3.33Å; E1069-S1083 VanDerWaalsContact OE2-CB 3.25Å; E1069-S1083 WeakPolarHBondContact OE2-CB 3.34Å; E1069-S1083 PolarHBondContact OE2-OG 3.03Å; A1070-S1083 PolarHBondContact N-O 2.88Å; A1070-S1083 VanDerWaalsContact N-O 3.15Å; A1070-S1083 PolarHBondContact O-N 2.96Å
1084	V	96.1	Very high	84.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.3	-175.3	-57.8	0	0	0	0	111.6	F942 L944 A1037 Q1038 L1039 A1040 A1066 Q1067 L1068 L1082 L1086	F942-V1084 HydrophobicContact CE2-CG2 4.05Å; F942-V1084 HydrophobicContact CZ-CG2 3.86Å; L944-V1084 HydrophobicContact CD1-CG1 4.32Å; L944-V1084 HydrophobicContact CD1-CG2 4.05Å; A1037-V1084 HydrophobicContact CB-CG2 4.43Å; Q1038-V1084 PolarHBondContact O-N 3.44Å; L1039-V1084 WeakPolarHBondContact CA-O 3.43Å; A1040-V1084 VanDerWaalsContact CB-C 3.47Å; A1040-V1084 WeakPolarHBondContact CB-O 3.4Å; A1040-V1084 PolarHBondContact N-O 2.97Å; A1066-V1084 HydrophobicContact CB-CB 4.17Å; A1066-V1084 HydrophobicContact CB-CG1 4.29Å; A1066-V1084 HydrophobicContact CB-CG2 4.33Å; Q1067-V1084 CarbonylContact O-C 3.53Å; Q1067-V1084 VanDerWaalsContact O-CA 3.25Å; Q1067-V1084 WeakPolarHBondContact O-CA 3.46Å; L1068-V1084 HydrophobicContact CD1-CG1 3.99Å; L1082-V1084 HydrophobicContact CB-CG1 3.85Å; L1082-V1084 HydrophobicContact CD1-CG1 4.45Å; V1084-L1086 HydrophobicContact CG2-CD2 3.86Å; V1084-L1086 HydrophobicContact CG2-CG 4.07Å
1085	F	95.7	Very high	84.8	Confident	40 Å²	40	53.1 Å²	53.1	18%	0.175	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	128.6	157.9	-63.1	-84.7	0	0	0	107.7	A1040 A1066 Q1067 E1069 W1097 H1099	A1040-F1085 HydrophobicContact CB-CD1 3.75Å; A1040-F1085 HydrophobicContact CB-CD2 3.67Å; A1040-F1085 HydrophobicContact CB-CE1 3.7Å; A1040-F1085 HydrophobicContact CB-CE2 3.6Å; A1040-F1085 HydrophobicContact CB-CG 3.74Å; A1040-F1085 HydrophobicContact CB-CZ 3.62Å; A1066-F1085 CarbonylContact C-O 3.57Å; A1066-F1085 WeakPolarHBondContact CA-O 3.47Å; Q1067-F1085 HydrophobicContact CB-CB 4.31Å; Q1067-F1085 PolarHBondContact N-O 3.12Å; Q1067-F1085 PolarHBondContact O-N 3.34Å; E1069-F1085 HydrophobicContact CB-CD2 4.29Å; E1069-F1085 HydrophobicContact CB-CE2 4.02Å; E1069-F1085 HydrophobicContact CG-CE2 4.15Å; F1085-W1097 HydrophobicContact CB-CE3 4.02Å; F1085-W1097 HydrophobicContact CB-CZ3 3.72Å; F1085-W1097 HydrophobicContact CG-CZ3 4.15Å; F1085-H1099 HydrophobicContact CD1-CB 4.44Å; F1085-H1099 AromaticContact CD1-CD2 3.86Å; F1085-H1099 AromaticContact CD1-CE1 3.69Å; F1085-H1099 AromaticContact CD1-CG 3.76Å; F1085-H1099 AromaticContact CD1-ND1 3.64Å; F1085-H1099 AromaticContact CD1-NE2 3.77Å; F1085-H1099 AromaticContact CE1-CD2 3.76Å; F1085-H1099 AromaticContact CE1-NE2 3.7Å
1086	L	95.7	Very high	85.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.5	171.6	-69.1	180	0	0	0	109.6	V931 F942 L944 L1039 F1055 V1059 L1064 A1066 V1084 I1098	V931-L1086 HydrophobicContact CG2-CD2 4.39Å; F942-L1086 HydrophobicContact CD2-CD1 4.37Å; F942-L1086 HydrophobicContact CE1-CD1 4.49Å; F942-L1086 HydrophobicContact CE2-CD1 3.69Å; F942-L1086 HydrophobicContact CE2-CD2 4.37Å; F942-L1086 HydrophobicContact CE2-CG 4.26Å; F942-L1086 HydrophobicContact CZ-CD1 3.75Å; F942-L1086 HydrophobicContact CZ-CG 4.22Å; L944-L1086 HydrophobicContact CD2-CD2 4.33Å; L1039-L1086 HydrophobicContact CD1-CB 4.01Å; L1039-L1086 HydrophobicContact CD1-CD1 4.35Å; L1039-L1086 HydrophobicContact CD1-CG 4.11Å; F1055-L1086 HydrophobicContact CE2-CD1 4.44Å; F1055-L1086 HydrophobicContact CZ-CD1 4.3Å; V1059-L1086 HydrophobicContact CB-CD1 4.2Å; V1059-L1086 HydrophobicContact CG1-CD1 3.79Å; L1064-L1086 HydrophobicContact CD1-CB 4.21Å; L1064-L1086 HydrophobicContact CD1-CD1 4.03Å; L1064-L1086 HydrophobicContact CD1-CD2 4.3Å; L1064-L1086 HydrophobicContact CD1-CG 4.42Å; A1066-L1086 HydrophobicContact CB-CD2 3.96Å; V1084-L1086 HydrophobicContact CG2-CD2 3.86Å; V1084-L1086 HydrophobicContact CG2-CG 4.07Å; L1086-I1098 HydrophobicContact CB-CB 4.05Å; L1086-I1098 HydrophobicContact CB-CG1 3.78Å; L1086-I1098 WeakPolarHBondContact O-CG1 3.31Å; L1086-I1098 PolarHBondContact O-N 3.02Å
1087	V	92.3	Very high	85.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	125.3	179	-162.4	0	0	0	0	109.2	L123 V1065 T1089 D1095 V1096 W1097	L123-V1087 HydrophobicContact CD1-CG2 4.41Å; L123-V1087 HydrophobicContact CD2-CB 4.03Å; L123-V1087 HydrophobicContact CD2-CG1 3.89Å; L123-V1087 HydrophobicContact CD2-CG2 4.21Å; V1065-V1087 HydrophobicContact CB-CB 4.37Å; V1065-V1087 PolarHBondContact N-O 2.91Å; V1065-V1087 PolarHBondContact O-N 3.36Å; V1087-T1089 HydrophobicContact CG1-CG2 4.3Å; V1087-D1095 HydrophobicContact CG1-CB 3.73Å; V1087-V1096 CarbonylContact C-O 3.53Å; V1087-V1096 WeakPolarHBondContact CA-O 3.37Å; V1087-W1097 HydrophobicContact CG1-CD2 4.2Å; V1087-W1097 HydrophobicContact CG1-CG 4.21Å; V1087-W1097 HydrophobicContact CG2-CD2 3.64Å; V1087-W1097 HydrophobicContact CG2-CE3 3.49Å; V1087-W1097 VanDerWaalsContact CG2-CE3 3.49Å; V1087-W1097 HydrophobicContact CG2-CG 4.33Å; V1087-W1097 HydrophobicContact CG2-CH2 3.95Å; V1087-W1097 HydrophobicContact CG2-CZ2 4.06Å; V1087-W1097 HydrophobicContact CG2-CZ3 3.67Å
1088	D	89.1	Confident	86.4	Confident	12 Å²	12	45.1 Å²	45.1	6%	0.064	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.8	170.5	-166.2	-27.3	0	0	0	108.8	L1064 S1090 V1096 I1098	L1064-D1088 HydrophobicContact CD2-CB 3.62Å; D1088-S1090 WeakPolarHBondContact OD1-CB 3.46Å; D1088-S1090 PolarHBondContact OD1-N 3.28Å; D1088-S1090 PolarHBondContact OD1-OG 2.57Å; D1088-V1096 HydrophobicContact CB-CB 4.32Å; D1088-V1096 PolarHBondContact N-O 2.96Å; D1088-V1096 PolarHBondContact O-N 3.4Å; D1088-I1098 HydrophobicContact CB-CD1 4.25Å
1089	T	82.9	Confident	86.6	Confident	14 Å²	14	45.6 Å²	45.6	9%	0.086	22%	0.221	C	C	.	.			trans	-103.7	21.5	178.2	73.1	0	0	0	0	111.8	Q120 L123 V1065 V1087 H1091	Q120-T1089 PolarHBondContact N-OG1 2.94Å; Q120-T1089 VanDerWaalsContact N-OG1 3.11Å; L123-T1089 HydrophobicContact CD2-CG2 3.86Å; V1065-T1089 HydrophobicContact CB-CG2 4.38Å; V1065-T1089 HydrophobicContact CG2-CG2 3.63Å; V1087-T1089 HydrophobicContact CG1-CG2 4.3Å; T1089-H1091 VanDerWaalsContact C-N 3.35Å
1090	S	75.6	Confident	86.8	Confident	55 Å²	55	46.3 Å²	46.3	39%	0.385	23%	0.225	S	C	.	.			trans	-77.5	-20.9	176.2	65.8	0	0	0	0	113	D1088	D1088-S1090 WeakPolarHBondContact OD1-CB 3.46Å; D1088-S1090 PolarHBondContact OD1-N 3.28Å; D1088-S1090 PolarHBondContact OD1-OG 2.57Å
1091	H	71.9	Confident	86.7	Confident	91 Å²	91	46.9 Å²	46.9	42%	0.421	23%	0.229	S	C	.	.	S	Bend	trans	-73.9	133.2	175.7	-70.8	-86	0	0	0	111.9	T1089 E1093 H1094 V1096	T1089-H1091 VanDerWaalsContact C-N 3.35Å; H1091-E1093 VanDerWaalsContact C-N 3.33Å; H1091-E1093 PolarHBondContact O-N 2.99Å; H1091-H1094 VanDerWaalsContact CB-O 3.29Å; H1091-H1094 WeakPolarHBondContact CB-O 3.42Å; H1091-V1096 VanDerWaalsContact CD2-CG2 3.49Å; H1091-V1096 WeakPolarHBondContact CD2-CG2 3.3Å
1092	E	63.6	Low	86.5	Confident	172 Å²	172	45.1 Å²	45.1	80%	0.804	22%	0.221	S	C	*	.	S	Bend	trans	-73.3	-19.9	-173.5	-64.8	-159.5	151.8	0	0	114.8	R124	R124-E1092 PolarHBondContact NH1-O 3.44Å; R124-E1092 PolarHBondContact NH2-O 3.27Å
1093	E	70.1	Confident	86	Confident	169 Å²	169	46.8 Å²	46.8	79%	0.79	24%	0.236	S	C	*	.	S	Bend	trans	-106.1	-38	-173.2	-62.7	-166	153.5	0	0	113.8	R124 H1091	R124-E1093 PolarHBondContact NH1-O 3.32Å; H1091-E1093 VanDerWaalsContact C-N 3.33Å; H1091-E1093 PolarHBondContact O-N 2.99Å
1094	H	78.1	Confident	85	Confident	103 Å²	103	53 Å²	53	48%	0.477	26%	0.264	S	S	.	.			trans	-145.6	150.3	-172.5	58.7	-88	0	0	0	111.9	H1091	H1091-H1094 VanDerWaalsContact CB-O 3.29Å; H1091-H1094 WeakPolarHBondContact CB-O 3.42Å
1095	D	86.2	Confident	83.6	Confident	24 Å²	24	56.1 Å²	56.1	13%	0.128	28%	0.277	C	S	.	.			trans	-86.4	128.7	175.5	-62.3	-17.3	0	0	0	109.7	L123 R124 V1087	L123-D1095 WeakPolarHBondContact CA-OD2 3.16Å; R124-D1095 PolarHBondContact N-OD2 3.49Å; R124-D1095 IonicContact NE-OD1 3.1Å; V1087-D1095 HydrophobicContact CG1-CB 3.73Å
1096	V	89.1	Confident	82	Confident	29 Å²	29	55.2 Å²	55.2	18%	0.176	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.7	-176.5	175.9	0	0	0	0	110.2	V1087 D1088 H1091 I1101	V1087-V1096 CarbonylContact C-O 3.53Å; V1087-V1096 WeakPolarHBondContact CA-O 3.37Å; D1088-V1096 HydrophobicContact CB-CB 4.32Å; D1088-V1096 PolarHBondContact N-O 2.96Å; D1088-V1096 PolarHBondContact O-N 3.4Å; H1091-V1096 VanDerWaalsContact CD2-CG2 3.49Å; H1091-V1096 WeakPolarHBondContact CD2-CG2 3.3Å; V1096-I1101 HydrophobicContact CG1-CD1 3.76Å; V1096-I1101 HydrophobicContact CG1-CG1 4.44Å
1097	W	92.5	Very high	80.2	Confident	71 Å²	71	59.8 Å²	59.8	27%	0.269	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	116.1	-178	-69.9	75.4	0	0	0	110.5	L123 F1085 V1087 H1099 D1100	L123-W1097 HydrophobicContact CD1-CH2 3.91Å; L123-W1097 HydrophobicContact CD1-CZ2 3.89Å; F1085-W1097 HydrophobicContact CB-CE3 4.02Å; F1085-W1097 HydrophobicContact CB-CZ3 3.72Å; F1085-W1097 HydrophobicContact CG-CZ3 4.15Å; V1087-W1097 HydrophobicContact CG1-CD2 4.2Å; V1087-W1097 HydrophobicContact CG1-CG 4.21Å; V1087-W1097 HydrophobicContact CG2-CD2 3.64Å; V1087-W1097 HydrophobicContact CG2-CE3 3.49Å; V1087-W1097 VanDerWaalsContact CG2-CE3 3.49Å; V1087-W1097 HydrophobicContact CG2-CG 4.33Å; V1087-W1097 HydrophobicContact CG2-CH2 3.95Å; V1087-W1097 HydrophobicContact CG2-CZ2 4.06Å; V1087-W1097 HydrophobicContact CG2-CZ3 3.67Å; W1097-H1099 AromaticContact CD2-CE1 3.95Å; W1097-H1099 AromaticContact CE3-CE1 3.46Å; W1097-H1099 VanDerWaalsContact CE3-CE1 3.46Å; W1097-H1099 AromaticContact CE3-ND1 3.77Å; W1097-H1099 PolarHBondContact O-N 3.34Å; W1097-H1099 VanDerWaalsContact O-N 3.15Å; W1097-D1100 WeakPolarHBondContact CB-OD2 3.47Å; W1097-D1100 PolarHBondContact O-N 3.34Å
1098	I	93.3	Very high	78.3	Confident	1 Å²	1	66 Å²	66	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-28.6	-172.2	-54.5	-52.1	0	0	0	112.3	L1039 F1055 H1058 V1059 L1086 D1088 D1100 I1101 M1102	L1039-I1098 HydrophobicContact CD1-CB 4.41Å; L1039-I1098 HydrophobicContact CD1-CG2 4.49Å; L1039-I1098 HydrophobicContact CD2-CG2 4.24Å; F1055-I1098 HydrophobicContact CD2-CG2 4Å; F1055-I1098 HydrophobicContact CE2-CG2 3.93Å; H1058-I1098 HydrophobicContact CB-CD1 4.26Å; H1058-I1098 HydrophobicContact CB-CG2 4.5Å; V1059-I1098 HydrophobicContact CG1-CB 4.43Å; V1059-I1098 HydrophobicContact CG1-CG1 4.05Å; V1059-I1098 HydrophobicContact CG1-CG2 3.68Å; L1086-I1098 HydrophobicContact CB-CB 4.05Å; L1086-I1098 HydrophobicContact CB-CG1 3.78Å; L1086-I1098 WeakPolarHBondContact O-CG1 3.31Å; L1086-I1098 PolarHBondContact O-N 3.02Å; D1088-I1098 HydrophobicContact CB-CD1 4.25Å; I1098-D1100 VanDerWaalsContact C-N 3.32Å; I1098-D1100 PolarHBondContact O-N 2.89Å; I1098-I1101 HydrophobicContact CD1-CD1 4.33Å; I1098-I1101 PolarHBondContact O-N 3.24Å; I1098-M1102 HydrophobicContact CG2-CG 4.44Å; I1098-M1102 WeakPolarHBondContact O-CG 3.45Å; I1098-M1102 PolarHBondContact O-N 3.04Å; I1098-M1102 VanDerWaalsContact O-N 3.13Å
1099	H	90.7	Very high	76.4	Confident	33 Å²	33	69.7 Å²	69.7	15%	0.153	35%	0.348	C	S	.	.	H	α-helix	trans	-69.2	-25.5	177.8	75.9	-69.7	0	0	0	114	L1039 A1040 V1042 F1085 W1097 A1103	L1039-H1099 HydrophobicContact CD1-CB 4.39Å; L1039-H1099 HydrophobicContact CD2-CB 4.19Å; L1039-H1099 HydrophobicContact CG-CB 4.16Å; A1040-H1099 WeakPolarHBondContact O-CB 3.41Å; V1042-H1099 HydrophobicContact CG2-CB 3.87Å; F1085-H1099 HydrophobicContact CD1-CB 4.44Å; F1085-H1099 AromaticContact CD1-CD2 3.86Å; F1085-H1099 AromaticContact CD1-CE1 3.69Å; F1085-H1099 AromaticContact CD1-CG 3.76Å; F1085-H1099 AromaticContact CD1-ND1 3.64Å; F1085-H1099 AromaticContact CD1-NE2 3.77Å; F1085-H1099 AromaticContact CE1-CD2 3.76Å; F1085-H1099 AromaticContact CE1-NE2 3.7Å; W1097-H1099 AromaticContact CD2-CE1 3.95Å; W1097-H1099 AromaticContact CE3-CE1 3.46Å; W1097-H1099 VanDerWaalsContact CE3-CE1 3.46Å; W1097-H1099 AromaticContact CE3-ND1 3.77Å; W1097-H1099 PolarHBondContact O-N 3.34Å; W1097-H1099 VanDerWaalsContact O-N 3.15Å; H1099-A1103 WeakPolarHBondContact O-CB 3.45Å; H1099-A1103 PolarHBondContact O-N 2.98Å
1100	D	89.4	Confident	74.8	Confident	83 Å²	83	71.8 Å²	71.8	44%	0.444	36%	0.363	S	S	.	.	H	α-helix	trans	-71.1	-47	174.6	-67.4	-33.5	0	0	0	110.2	W1097 I1098 M1102 A1103 E1104	W1097-D1100 WeakPolarHBondContact CB-OD2 3.47Å; W1097-D1100 PolarHBondContact O-N 3.34Å; I1098-D1100 VanDerWaalsContact C-N 3.32Å; I1098-D1100 PolarHBondContact O-N 2.89Å; D1100-M1102 VanDerWaalsContact C-N 3.26Å; D1100-M1102 PolarHBondContact O-N 2.92Å; D1100-A1103 WeakPolarHBondContact O-CB 3.26Å; D1100-A1103 PolarHBondContact O-N 3.49Å; D1100-E1104 PolarHBondContact O-N 3.4Å
1101	I	88.6	Confident	73.2	Confident	37 Å²	37	75.9 Å²	75.9	19%	0.19	38%	0.381	C	S	.	.	H	α-helix	trans	-54.3	-44.9	174	-54.1	178	0	0	0	110.7	V1054 V1096 I1098 A1103 F1105	V1054-I1101 HydrophobicContact CG1-CG2 4.33Å; V1096-I1101 HydrophobicContact CG1-CD1 3.76Å; V1096-I1101 HydrophobicContact CG1-CG1 4.44Å; I1098-I1101 HydrophobicContact CD1-CD1 4.33Å; I1098-I1101 PolarHBondContact O-N 3.24Å; I1101-A1103 VanDerWaalsContact C-N 3.31Å; I1101-A1103 PolarHBondContact O-N 3.32Å; I1101-F1105 PolarHBondContact O-N 3.34Å
1102	M	87.2	Confident	71.8	Confident	2 Å²	2	80.2 Å²	80.2	1%	0.01	40%	0.401	C	S	.	.	H	α-helix	trans	-74.2	-18.3	179.1	-66	-48.9	-46.9	0	0	113.9	P939 L1039 V1042 A1051 V1054 F1055 I1098 D1100 A1106	P939-M1102 HydrophobicContact CG-CE 3.86Å; P939-M1102 HydrophobicContact CG-CG 4.31Å; P939-M1102 HydrophobicContact CG-SD 4.37Å; L1039-M1102 HydrophobicContact CD2-CB 4.16Å; L1039-M1102 HydrophobicContact CD2-CG 3.79Å; V1042-M1102 HydrophobicContact CG2-CB 3.93Å; A1051-M1102 HydrophobicContact CB-CE 4.02Å; A1051-M1102 WeakPolarHBondContact O-CE 3.24Å; V1054-M1102 HydrophobicContact CG1-SD 4.07Å; F1055-M1102 HydrophobicContact CB-CE 4.31Å; F1055-M1102 HydrophobicContact CB-SD 3.77Å; F1055-M1102 HydrophobicContact CD2-CG 4.11Å; F1055-M1102 HydrophobicContact CD2-SD 4.19Å; F1055-M1102 HydrophobicContact CG-SD 4.48Å; I1098-M1102 HydrophobicContact CG2-CG 4.44Å; I1098-M1102 WeakPolarHBondContact O-CG 3.45Å; I1098-M1102 PolarHBondContact O-N 3.04Å; I1098-M1102 VanDerWaalsContact O-N 3.13Å; D1100-M1102 VanDerWaalsContact C-N 3.26Å; D1100-M1102 PolarHBondContact O-N 2.92Å; M1102-A1106 WeakPolarHBondContact O-CB 3.34Å
1103	A	82.6	Confident	70.5	Confident	38 Å²	38	82.4 Å²	82.4	31%	0.314	42%	0.417	S	S	.	.	H	α-helix	trans	-80.2	-45.7	174.5	0	0	0	0	0	111.1	H1099 D1100 I1101 F1105 A1106 D1107	H1099-A1103 WeakPolarHBondContact O-CB 3.45Å; H1099-A1103 PolarHBondContact O-N 2.98Å; D1100-A1103 WeakPolarHBondContact O-CB 3.26Å; D1100-A1103 PolarHBondContact O-N 3.49Å; I1101-A1103 VanDerWaalsContact C-N 3.31Å; I1101-A1103 PolarHBondContact O-N 3.32Å; A1103-F1105 VanDerWaalsContact C-N 3.32Å; A1103-F1105 PolarHBondContact O-N 3.17Å; A1103-A1106 PolarHBondContact O-N 3.16Å; A1103-D1107 PolarHBondContact O-N 2.98Å
1104	E	74.6	Confident	70.5	Confident	138 Å²	138	78.1 Å²	78.1	65%	0.645	40%	0.399	S	S	*	.	H	α-helix	trans	-55.6	-47.4	175.4	-67.8	179.3	167.1	0	0	110.9	D1100 A1106 D1107 E1108	D1100-E1104 PolarHBondContact O-N 3.4Å; E1104-A1106 PolarHBondContact O-N 3.09Å; E1104-D1107 PolarHBondContact O-N 2.91Å; E1104-E1108 PolarHBondContact O-N 3.27Å
1105	F	66.4	Low	70.1	Confident	66 Å²	66	76.8 Å²	76.8	29%	0.289	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-24.2	177.5	-134.8	-93.1	0	0	0	114.3	E1050 V1054 I1101 A1103	E1050-F1105 HydrophobicContact CB-CE1 4.25Å; V1054-F1105 HydrophobicContact CG1-CD2 4.44Å; V1054-F1105 HydrophobicContact CG2-CD2 4.33Å; V1054-F1105 HydrophobicContact CG2-CE1 4.06Å; V1054-F1105 HydrophobicContact CG2-CE2 3.84Å; V1054-F1105 HydrophobicContact CG2-CZ 3.69Å; I1101-F1105 PolarHBondContact O-N 3.34Å; A1103-F1105 VanDerWaalsContact C-N 3.32Å; A1103-F1105 PolarHBondContact O-N 3.17Å
1106	A	61.8	Low	69.2	Low	21 Å²	21	79.7 Å²	79.7	17%	0.174	41%	0.409	C	S	.	.	H	α-helix	trans	-87.6	-17.1	179.7	0	0	0	0	0	113.6	R1045 M1102 A1103 E1104	R1045-A1106 PolarHBondContact NH1-O 2.74Å; M1102-A1106 WeakPolarHBondContact O-CB 3.34Å; A1103-A1106 PolarHBondContact O-N 3.16Å; E1104-A1106 PolarHBondContact O-N 3.09Å
1107	D	57.9	Low	68	Low	96 Å²	96	82.7 Å²	82.7	51%	0.513	42%	0.423	S	S	.	.	H	α-helix	trans	-92.2	-35.2	176.8	-76.8	-11.5	0	0	0	111.4	A1103 E1104 Q1109 S1110 N1111	A1103-D1107 PolarHBondContact O-N 2.98Å; E1104-D1107 PolarHBondContact O-N 2.91Å; D1107-Q1109 PolarHBondContact O-N 3.13Å; D1107-S1110 PolarHBondContact O-N 3.2Å; D1107-S1110 PolarHBondContact O-OG 2.6Å; D1107-N1111 PolarHBondContact O-N 3.42Å
1108	E	53.6	Low	66.5	Low	131 Å²	131	83.4 Å²	83.4	61%	0.612	43%	0.433	S	S	*	.	H	α-helix	trans	-58.3	-48.1	174	-72	-171.7	152	0	0	112.4	E1104 S1110 N1111	E1104-E1108 PolarHBondContact O-N 3.27Å; E1108-S1110 PolarHBondContact O-N 2.86Å; E1108-N1111 PolarHBondContact O-N 3.09Å
1109	Q	48.2	Very low	64.7	Low	89 Å²	89	88.9 Å²	88.9	42%	0.416	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.2	174.9	-71.1	-171.8	-3.9	0	0	114.2	S1048 D1107	S1048-Q1109 PolarHBondContact OG-NE2 3.11Å; D1107-Q1109 PolarHBondContact O-N 3.13Å
1110	S	49.1	Very low	62.9	Low	59 Å²	59	92.9 Å²	92.9	41%	0.413	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-6.7	177.2	72.1	0	0	0	0	114.4	D1107 E1108	D1107-S1110 PolarHBondContact O-N 3.2Å; D1107-S1110 PolarHBondContact O-OG 2.6Å; E1108-S1110 PolarHBondContact O-N 2.86Å
1111	N	43.5	Very low	60.8	Low	141 Å²	141	93.7 Å²	93.7	75%	0.754	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-6.9	173.6	-75	-42.9	0	0	0	113.5	D1107 E1108	D1107-N1111 PolarHBondContact O-N 3.42Å; E1108-N1111 PolarHBondContact O-N 3.09Å
1112	E	41.5	Very low	58.5	Low	181 Å²	181	98.4 Å²	98.4	85%	0.846	51%	0.511	S	S	*	.			trans	-103.3	17.3	176.5	-63.6	-162.3	141.2	0	0	113.9
1113	L	35.8	Very low	55.9	Low	219 Å²	219	107.2 Å²	107.2	100%	1.147	56%	0.557	S	S	*	*			trans	-122.7	0	178.6	-87.8	167.2	0	0	0	113.1

Retrieved 1,113 of 1,113 residues in 1484.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).