A0A5K4FCX7_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FCX7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,369 aa.

						>A0A5K4FCX7_SCHMA|A0A5K4FCX7
MSEEIDVSKLKVPELRAELGRRGLNTFGTKQILMDRLNDALKSASPNSDKKQPADPEEQPHLASANLSRQPSQNSGRDVLDSSPKVSPQRGCENGLANEKDSSPGDQHQKPEQENLKRRRSPSHSPRRRSRSRDRDSRRSPRRRSRSPQVKSRMVPEPDNWEESASVFLDTYNCDLNLMTDATSFQAKPLTEGGFSLMWAGVRANYGSISGKSFFEVRVVKNLPVENYDSLVGGATHVLRVGWSTEDTDFTLGEEPQSFGYGGTGKKSTNNKFTDYGCTFGEGDVVGAFIEWTNVEALLRFSVNGVDQGECFRVQKSQLGEHSALFPHVYVKNVEFACNFGQENQSPWFSPNIPSDDPLSWQQMNCLPLSCRVHGRCPPQSKSECEVIMMVGLPGAGKTYFAEQQKTEHREKQYNILGTNLILDKMKVMGIARQRNYHGRWDVLIDKATKCLNTLISMACMRRRNYILDQTNVYPSAQRRKMRPFEGFKRKAIVIVPTDEEFRRRIAQREKEEGKEVPETAVLEMKANFGIPRPVSEDPSSVFDEVIFTELGLDDAKVLVTQYNQEGQANRQPPEKRQRWDGGNRDRDDSRNSRFRGRDSRDRGRDMPRGRRDDFRSSPNRRNDDRGRRDYRGGYNASRDRSREGDRFDRNSDRESFGRQPSGRYGGGPPGGRFGPPNRGPFPSGMSGPGGFGGFDNSRGGMMRSGPARGGFTAPNFDSRAGRGAYRGSMDRGNPGYGGPNDTMYNRFDGNAGDAEPIGNAYDMSEASLSQPPYEGGPMSGGFRGGYGGSGRGVQMQGSRGAPGRGGTSMGRGAVAPGRAANTDRGVDRGQLGRNAPVSGRGGAQPDRDMIGGFPDDSQQYNMYGGAEGYQNPAEEQYPGPPNDDYRNRRFGGPGPYNANALQKPSGGSYSAYQRGNPPFSGGPAGYPNAPGGGYNRGSLPSYGNPNSASNYPNSYTGDQGNFTNPSSDPYSGGMASDRSGRPGMQQNSGGPFGGSHAYGTSDPDKTAMSQNEHSSTDSSSLYASGAARYSDNHPSATNIPPGPRQSRFDTKPETNTTSQTSAYNSYALGSSYPGGFTSNGNQKATIQPSNPPGGPRSGRSRFDVGPPASQPIPPAAPVQSTTYNPPSQSVNRPQPQVQQTATSTQQAQPQSYGYGYSTQNTKLDGSSNQNAPPVSQSYGAYNYGYGYGTYGSQTAQPSATVNRCAPTTGTTQQSLYASAVADKPQLTQQTAAPAVSSATTTTATSDHSTPAAAAYASYYYGAPQSATGSTQGAGKYDAAMAAAQQFNAWQQQQQPSAVSGSVSSSVPSAPTATVTPQTPAANPYASYYPGYSTYPSGYGTIPVGGAPPGGVPTAAAPPAMSQYYTGYR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	29.3	Very low	69.6	Low	248 Å²	248	116.5 Å²	116.5	100%	1.222	59%	0.59	S	S	*	*				0	118.4	0	-66.3	179.4	-175.6	0	0	107.4
2	S	36.2	Very low	71.5	Confident	116 Å²	116	111 Å²	111	81%	0.811	57%	0.566	S	S	*	*			trans	-165.5	94.1	178.3	46.4	0	0	0	0	107.3
3	E	46.9	Very low	73.1	Confident	185 Å²	185	109.7 Å²	109.7	86%	0.864	57%	0.57	S	S	*	*			trans	-65.5	142.5	179.5	-59.7	173.8	136.2	0	0	109.9	I5	E3-I5 PolarHBondContact O-N 2.88Å
4	E	61.6	Low	74.5	Confident	196 Å²	196	106.9 Å²	106.9	92%	0.916	55%	0.553	S	S	*	*			trans	-65.4	107	176.1	-68.2	-174.3	120.2	0	0	110.1	D6	E4-D6 PolarHBondContact O-N 3.3Å
5	I	71.5	Confident	75.9	Confident	73 Å²	73	99.8 Å²	99.8	37%	0.374	52%	0.516	S	S	.	.			trans	-73.1	94.2	-179.7	-55.2	179.9	0	0	0	108.8	E3 V7 L10	E3-I5 PolarHBondContact O-N 2.88Å; I5-V7 PolarHBondContact O-N 3.29Å; I5-L10 HydrophobicContact CG2-CD1 3.84Å; I5-L10 HydrophobicContact CG2-CD2 4.12Å; I5-L10 HydrophobicContact CG2-CG 4.27Å
6	D	83	Confident	77.1	Confident	65 Å²	65	100.3 Å²	100.3	35%	0.348	51%	0.509	S	S	.	.			trans	-63.9	95.5	172.1	-178.6	-8.8	0	0	0	110.7	E4 S8 K9	E4-D6 PolarHBondContact O-N 3.3Å; D6-S8 VanDerWaalsContact CG-OG 3.3Å; D6-S8 PolarHBondContact O-N 2.86Å; D6-S8 VanDerWaalsContact O-N 3.1Å; D6-S8 WeakPolarHBondContact OD1-CA 2.93Å; D6-S8 WeakPolarHBondContact OD1-CB 3.25Å; D6-S8 PolarHBondContact OD1-N 2.8Å; D6-S8 PolarHBondContact OD1-OG 3.09Å; D6-S8 PolarHBondContact OD2-OG 3.09Å; D6-K9 HydrophobicContact CB-CD 4.14Å; D6-K9 HydrophobicContact CB-CG 4.39Å; D6-K9 PolarHBondContact O-N 3.14Å; D6-K9 VanDerWaalsContact O-N 3.08Å; D6-K9 VanDerWaalsContact OD2-CD 3.29Å; D6-K9 WeakPolarHBondContact OD2-CD 3.48Å; D6-K9 WeakPolarHBondContact OD2-CE 3.14Å; D6-K9 WeakPolarHBondContact OD2-CG 3.15Å; D6-K9 IonicContact OD2-NZ 3.37Å; D6-K9 PolarHBondContact OD2-NZ 3.42Å
7	V	85.2	Confident	78	Confident	6 Å²	6	97.5 Å²	97.5	4%	0.036	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.5	179.9	178.6	0	0	0	0	112.1	I5 K9 L10 L15 M34 L37 N38 L41	I5-V7 PolarHBondContact O-N 3.29Å; V7-K9 VanDerWaalsContact C-N 3.28Å; V7-K9 PolarHBondContact O-N 3.3Å; V7-L10 PolarHBondContact O-N 3.14Å; V7-L15 HydrophobicContact CG1-CD2 4.09Å; V7-M34 HydrophobicContact CG1-CB 3.89Å; V7-M34 HydrophobicContact CG1-CG 4.09Å; V7-M34 VanDerWaalsContact O-CE 3.24Å; V7-M34 WeakPolarHBondContact O-CE 3.28Å; V7-L37 HydrophobicContact CG1-CB 4.4Å; V7-L37 HydrophobicContact CG1-CD2 4.22Å; V7-L37 HydrophobicContact CG1-CG 4.49Å; V7-L37 HydrophobicContact CG2-CD2 3.99Å; V7-L37 HydrophobicContact CG2-CG 4.03Å; V7-N38 WeakPolarHBondContact CB-OD1 3.32Å; V7-N38 WeakPolarHBondContact CG1-OD1 3.08Å; V7-N38 WeakPolarHBondContact CG2-OD1 3.17Å; V7-L41 HydrophobicContact CG2-CD1 3.41Å; V7-L41 VanDerWaalsContact CG2-CD1 3.41Å
8	S	85.2	Confident	78.7	Confident	70 Å²	70	93 Å²	93	49%	0.49	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-38.3	179.3	81.4	0	0	0	0	111.8	D6 K30 M34	D6-S8 VanDerWaalsContact CG-OG 3.3Å; D6-S8 PolarHBondContact O-N 2.86Å; D6-S8 VanDerWaalsContact O-N 3.1Å; D6-S8 WeakPolarHBondContact OD1-CA 2.93Å; D6-S8 WeakPolarHBondContact OD1-CB 3.25Å; D6-S8 PolarHBondContact OD1-N 2.8Å; D6-S8 PolarHBondContact OD1-OG 3.09Å; D6-S8 PolarHBondContact OD2-OG 3.09Å; S8-K30 PolarHBondContact O-NZ 2.91Å; S8-M34 VanDerWaalsContact CA-CE 3.48Å
9	K	87	Confident	79.6	Confident	161 Å²	161	88.1 Å²	88.1	70%	0.7	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-23	-175.6	-67.2	177	179.4	122.1	0	113.6	D6 V7	D6-K9 HydrophobicContact CB-CD 4.14Å; D6-K9 HydrophobicContact CB-CG 4.39Å; D6-K9 PolarHBondContact O-N 3.14Å; D6-K9 VanDerWaalsContact O-N 3.08Å; D6-K9 VanDerWaalsContact OD2-CD 3.29Å; D6-K9 WeakPolarHBondContact OD2-CD 3.48Å; D6-K9 WeakPolarHBondContact OD2-CE 3.14Å; D6-K9 WeakPolarHBondContact OD2-CG 3.15Å; D6-K9 IonicContact OD2-NZ 3.37Å; D6-K9 PolarHBondContact OD2-NZ 3.42Å; V7-K9 VanDerWaalsContact C-N 3.28Å; V7-K9 PolarHBondContact O-N 3.3Å
10	L	87.6	Confident	80.2	Confident	31 Å²	31	85.9 Å²	85.9	16%	0.162	46%	0.456	C	S	.	.			trans	-62.9	136.7	-178.7	-61.6	178	0	0	0	112.4	I5 V7 E14 L15 K30 L37	I5-L10 HydrophobicContact CG2-CD1 3.84Å; I5-L10 HydrophobicContact CG2-CD2 4.12Å; I5-L10 HydrophobicContact CG2-CG 4.27Å; V7-L10 PolarHBondContact O-N 3.14Å; L10-E14 HydrophobicContact CB-CB 4.31Å; L10-E14 HydrophobicContact CD2-CB 4.14Å; L10-L15 HydrophobicContact CB-CD2 3.78Å; L10-L15 HydrophobicContact CB-CG 3.75Å; L10-L15 HydrophobicContact CD1-CD2 3.8Å; L10-L15 HydrophobicContact CD1-CG 4.46Å; L10-L15 HydrophobicContact CG-CD2 4.45Å; L10-K30 WeakPolarHBondContact O-CE 3.38Å; L10-K30 PolarHBondContact O-NZ 3.03Å; L10-K30 VanDerWaalsContact O-NZ 3.08Å; L10-L37 HydrophobicContact CD1-CD2 3.53Å
11	K	92.4	Very high	80.6	Confident	130 Å²	130	91.2 Å²	91.2	57%	0.565	47%	0.47	S	S	*	.			trans	-83.1	164.2	172.5	-54.9	-176	-156.9	83.4	0	110.9	P13 E14 L15	K11-P13 VanDerWaalsContact C-CD 3.5Å; K11-E14 HydrophobicContact CB-CG 4.43Å; K11-E14 WeakPolarHBondContact CD-OE1 3.5Å; K11-E14 WeakPolarHBondContact CG-OE1 3.41Å; K11-E14 WeakPolarHBondContact CG-OE2 3.44Å; K11-E14 PolarHBondContact N-OE2 2.7Å; K11-E14 IonicContact NZ-OE1 2.75Å; K11-E14 PolarHBondContact NZ-OE1 2.72Å; K11-E14 IonicContact NZ-OE2 3.31Å; K11-E14 WeakPolarHBondContact O-CB 3.39Å; K11-E14 PolarHBondContact O-N 3.25Å; K11-L15 WeakPolarHBondContact O-CG 3.17Å; K11-L15 PolarHBondContact O-N 3.17Å
12	V	92	Very high	83.5	Confident	51 Å²	51	83.4 Å²	83.4	31%	0.309	43%	0.427	S	S	.	.	H	α-helix	trans	-53.5	-40.9	179	176.7	0	0	0	0	114.1	R16 K30 L33	V12-R16 WeakPolarHBondContact O-CB 3.44Å; V12-R16 WeakPolarHBondContact O-CG 3.39Å; V12-R16 PolarHBondContact O-N 3.06Å; V12-K30 HydrophobicContact CG2-CB 3.96Å; V12-K30 HydrophobicContact CG2-CG 3.89Å; V12-L33 HydrophobicContact CG1-CD1 4.05Å
13	P	92.8	Very high	86.1	Confident	94 Å²	94	81.4 Å²	81.4	61%	0.61	42%	0.424	S	S	*	.	H	α-helix	trans	-65.8	-37.3	174.9	-21.5	34.7	0	0	0	113.1	K11 R16 A17	K11-P13 VanDerWaalsContact C-CD 3.5Å; P13-R16 PolarHBondContact O-N 3.03Å; P13-A17 WeakPolarHBondContact O-CB 3.46Å; P13-A17 PolarHBondContact O-N 2.84Å
14	E	91.8	Very high	88.2	Confident	71 Å²	71	75.7 Å²	75.7	33%	0.332	40%	0.399	S	S	.	.	H	α-helix	trans	-71.6	-43.7	-179.1	-63.3	149.5	-156.6	0	0	110.4	L10 K11 R16 A17 E18	L10-E14 HydrophobicContact CB-CB 4.31Å; L10-E14 HydrophobicContact CD2-CB 4.14Å; K11-E14 HydrophobicContact CB-CG 4.43Å; K11-E14 WeakPolarHBondContact CD-OE1 3.5Å; K11-E14 WeakPolarHBondContact CG-OE1 3.41Å; K11-E14 WeakPolarHBondContact CG-OE2 3.44Å; K11-E14 PolarHBondContact N-OE2 2.7Å; K11-E14 IonicContact NZ-OE1 2.75Å; K11-E14 PolarHBondContact NZ-OE1 2.72Å; K11-E14 IonicContact NZ-OE2 3.31Å; K11-E14 WeakPolarHBondContact O-CB 3.39Å; K11-E14 PolarHBondContact O-N 3.25Å; E14-R16 VanDerWaalsContact C-N 3.33Å; E14-R16 PolarHBondContact O-N 2.97Å; E14-A17 PolarHBondContact O-N 2.87Å; E14-E18 WeakPolarHBondContact O-CB 3.23Å; E14-E18 PolarHBondContact O-N 3.22Å
15	L	95.4	Very high	89.6	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-57.8	-42.1	170.4	-70.8	165.5	0	0	0	112.1	V7 L10 K11 E18 L19 K30 L33 M34 L37	V7-L15 HydrophobicContact CG1-CD2 4.09Å; L10-L15 HydrophobicContact CB-CD2 3.78Å; L10-L15 HydrophobicContact CB-CG 3.75Å; L10-L15 HydrophobicContact CD1-CD2 3.8Å; L10-L15 HydrophobicContact CD1-CG 4.46Å; L10-L15 HydrophobicContact CG-CD2 4.45Å; K11-L15 WeakPolarHBondContact O-CG 3.17Å; K11-L15 PolarHBondContact O-N 3.17Å; L15-E18 PolarHBondContact O-N 2.84Å; L15-L19 WeakPolarHBondContact O-CB 3.14Å; L15-L19 WeakPolarHBondContact O-CD1 3.19Å; L15-L19 VanDerWaalsContact O-CG 3.23Å; L15-L19 WeakPolarHBondContact O-CG 3.4Å; L15-L19 PolarHBondContact O-N 2.87Å; L15-K30 HydrophobicContact CD1-CD 4.44Å; L15-K30 HydrophobicContact CD1-CG 3.64Å; L15-L33 HydrophobicContact CB-CB 4.06Å; L15-L33 HydrophobicContact CD1-CB 4.22Å; L15-M34 HydrophobicContact CD1-CG 3.55Å; L15-M34 HydrophobicContact CD1-SD 4.4Å; L15-M34 HydrophobicContact CD2-CG 3.82Å; L15-M34 HydrophobicContact CG-CG 4.36Å; L15-L37 HydrophobicContact CD2-CD2 3.81Å
16	R	95.4	Very high	90.7	Very high	107 Å²	107	69.1 Å²	69.1	40%	0.404	37%	0.373	S	S	.	.	H	α-helix	trans	-70.1	-36.7	176.3	-74.5	-173.9	176.3	161.2	7.5	112.9	V12 P13 E14 E18 G20 T26 L33	V12-R16 WeakPolarHBondContact O-CB 3.44Å; V12-R16 WeakPolarHBondContact O-CG 3.39Å; V12-R16 PolarHBondContact O-N 3.06Å; P13-R16 PolarHBondContact O-N 3.03Å; E14-R16 VanDerWaalsContact C-N 3.33Å; E14-R16 PolarHBondContact O-N 2.97Å; R16-E18 VanDerWaalsContact C-N 3.34Å; R16-G20 WeakPolarHBondContact O-CA 3.37Å; R16-G20 PolarHBondContact O-N 2.95Å; R16-T26 HydrophobicContact CB-CG2 4.34Å; R16-T26 WeakPolarHBondContact CD-O 3.49Å; R16-T26 WeakPolarHBondContact CG-O 3.4Å; R16-T26 PolarHBondContact NE-O 3.44Å; R16-T26 WeakPolarHBondContact O-CG2 3.28Å; R16-L33 HydrophobicContact CG-CD1 3.96Å
17	A	92.5	Very high	90.9	Very high	54 Å²	54	73.5 Å²	73.5	45%	0.446	39%	0.389	S	S	.	.	H	α-helix	trans	-65.6	-39.6	173.8	0	0	0	0	0	111	P13 E14 G20 R21	P13-A17 WeakPolarHBondContact O-CB 3.46Å; P13-A17 PolarHBondContact O-N 2.84Å; E14-A17 PolarHBondContact O-N 2.87Å; A17-G20 PolarHBondContact O-N 3.19Å; A17-R21 WeakPolarHBondContact O-CB 3.19Å; A17-R21 WeakPolarHBondContact O-CG 3.4Å; A17-R21 PolarHBondContact O-N 3.22Å
18	E	91	Very high	91.1	Very high	16 Å²	16	74.7 Å²	74.7	8%	0.075	40%	0.402	C	S	.	.	H	α-helix	trans	-76	-42.3	-178.5	-168.4	58.2	-160.2	0	0	113	E14 L15 R16 G20 R21 R22 L37	E14-E18 WeakPolarHBondContact O-CB 3.23Å; E14-E18 PolarHBondContact O-N 3.22Å; L15-E18 PolarHBondContact O-N 2.84Å; R16-E18 VanDerWaalsContact C-N 3.34Å; E18-G20 VanDerWaalsContact C-N 3.31Å; E18-G20 PolarHBondContact O-N 3.13Å; E18-R21 PolarHBondContact O-N 2.71Å; E18-R21 IonicContact OE2-CZ 2.64Å; E18-R21 IonicContact OE2-NE 3.73Å; E18-R21 PolarHBondContact OE2-NE 2.63Å; E18-R21 IonicContact OE2-NH2 2.59Å; E18-R21 PolarHBondContact OE2-NH2 3Å; E18-R22 WeakPolarHBondContact O-CG 3.15Å; E18-R22 PolarHBondContact O-N 2.86Å; E18-R22 VanDerWaalsContact O-N 3.13Å; E18-R22 IonicContact OE1-CZ 2.67Å; E18-R22 VanDerWaalsContact OE1-CZ 3.27Å; E18-R22 IonicContact OE1-NE 2.72Å; E18-R22 PolarHBondContact OE1-NE 2.8Å; E18-R22 IonicContact OE1-NH2 3.98Å; E18-R22 PolarHBondContact OE1-NH2 2.9Å; E18-L37 HydrophobicContact CB-CD1 4.45Å; E18-L37 HydrophobicContact CB-CD2 4.11Å; E18-L37 HydrophobicContact CG-CD1 3.68Å; E18-L37 HydrophobicContact CG-CD2 3.84Å; E18-L37 HydrophobicContact CG-CG 4.44Å
19	L	94.9	Very high	91.5	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-60.7	-42.1	168.3	-70.5	167.8	0	0	0	110.9	L15 R22 G23 L24 T26 L33 R36 L37	L15-L19 WeakPolarHBondContact O-CB 3.14Å; L15-L19 WeakPolarHBondContact O-CD1 3.19Å; L15-L19 VanDerWaalsContact O-CG 3.23Å; L15-L19 WeakPolarHBondContact O-CG 3.4Å; L15-L19 PolarHBondContact O-N 2.87Å; L19-R22 CarbonylContact O-C 3.55Å; L19-R22 WeakPolarHBondContact O-CA 3.23Å; L19-R22 PolarHBondContact O-N 2.89Å; L19-G23 PolarHBondContact O-N 3.44Å; L19-G23 VanDerWaalsContact O-N 3.08Å; L19-L24 HydrophobicContact CB-CB 4.07Å; L19-L24 HydrophobicContact CD2-CB 3.7Å; L19-L24 HydrophobicContact CD2-CD1 3.75Å; L19-L24 HydrophobicContact CD2-CG 4.39Å; L19-L24 HydrophobicContact CG-CB 4.49Å; L19-L24 PolarHBondContact O-N 3.3Å; L19-T26 HydrophobicContact CB-CG2 4.25Å; L19-L33 HydrophobicContact CD1-CB 3.8Å; L19-L33 HydrophobicContact CD1-CD2 3.5Å; L19-L33 VanDerWaalsContact CD1-CD2 3.5Å; L19-L33 HydrophobicContact CD1-CG 4.23Å; L19-R36 HydrophobicContact CD2-CB 3.75Å; L19-L37 HydrophobicContact CD2-CB 4.04Å; L19-L37 HydrophobicContact CG-CB 4.48Å
20	G	92.6	Very high	91.8	Very high	44 Å²	44	71.8 Å²	71.8	45%	0.454	39%	0.389	S	S	.	.	H	α-helix	trans	-61.3	-43.1	175.5	0	0	0	0	0	113.2	R16 A17 E18 R22 G23	R16-G20 WeakPolarHBondContact O-CA 3.37Å; R16-G20 PolarHBondContact O-N 2.95Å; A17-G20 PolarHBondContact O-N 3.19Å; E18-G20 VanDerWaalsContact C-N 3.31Å; E18-G20 PolarHBondContact O-N 3.13Å; G20-R22 PolarHBondContact O-N 2.99Å; G20-G23 PolarHBondContact O-N 3.02Å; G20-G23 VanDerWaalsContact O-N 3.17Å
21	R	89.2	Confident	91.9	Very high	197 Å²	197	75.8 Å²	75.8	74%	0.743	41%	0.406	S	S	*	.	H	α-helix	trans	-62	-23.5	172.3	-79.2	-164.5	-70.7	-153.4	0.6	113.2	A17 E18	A17-R21 WeakPolarHBondContact O-CB 3.19Å; A17-R21 WeakPolarHBondContact O-CG 3.4Å; A17-R21 PolarHBondContact O-N 3.22Å; E18-R21 PolarHBondContact O-N 2.71Å; E18-R21 IonicContact OE2-CZ 2.64Å; E18-R21 IonicContact OE2-NE 3.73Å; E18-R21 PolarHBondContact OE2-NE 2.63Å; E18-R21 IonicContact OE2-NH2 2.59Å; E18-R21 PolarHBondContact OE2-NH2 3Å
22	R	89.4	Confident	91.9	Very high	85 Å²	85	73.1 Å²	73.1	32%	0.321	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	7.7	178.2	-64.6	172.3	-170.9	-121.7	-1.5	113.6	E18 L19 G20 L24	E18-R22 WeakPolarHBondContact O-CG 3.15Å; E18-R22 PolarHBondContact O-N 2.86Å; E18-R22 VanDerWaalsContact O-N 3.13Å; E18-R22 IonicContact OE1-CZ 2.67Å; E18-R22 VanDerWaalsContact OE1-CZ 3.27Å; E18-R22 IonicContact OE1-NE 2.72Å; E18-R22 PolarHBondContact OE1-NE 2.8Å; E18-R22 IonicContact OE1-NH2 3.98Å; E18-R22 PolarHBondContact OE1-NH2 2.9Å; L19-R22 CarbonylContact O-C 3.55Å; L19-R22 WeakPolarHBondContact O-CA 3.23Å; L19-R22 PolarHBondContact O-N 2.89Å; G20-R22 PolarHBondContact O-N 2.99Å; R22-L24 HydrophobicContact CB-CD1 3.92Å; R22-L24 HydrophobicContact CB-CG 4.26Å; R22-L24 PolarHBondContact O-N 2.73Å
23	G	90.6	Very high	92.1	Very high	74 Å²	74	70.7 Å²	70.7	76%	0.763	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	11.1	-178.5	0	0	0	0	0	115.1	L19 G20	L19-G23 PolarHBondContact O-N 3.44Å; L19-G23 VanDerWaalsContact O-N 3.08Å; G20-G23 PolarHBondContact O-N 3.02Å; G20-G23 VanDerWaalsContact O-N 3.17Å
24	L	91	Very high	92.2	Very high	65 Å²	65	67.2 Å²	67.2	34%	0.34	36%	0.359	S	S	.	.			trans	-92	151.6	-174	-67.3	165.1	0	0	0	112.4	L19 R22 T26 A40	L19-L24 HydrophobicContact CB-CB 4.07Å; L19-L24 HydrophobicContact CD2-CB 3.7Å; L19-L24 HydrophobicContact CD2-CD1 3.75Å; L19-L24 HydrophobicContact CD2-CG 4.39Å; L19-L24 HydrophobicContact CG-CB 4.49Å; L19-L24 PolarHBondContact O-N 3.3Å; R22-L24 HydrophobicContact CB-CD1 3.92Å; R22-L24 HydrophobicContact CB-CG 4.26Å; R22-L24 PolarHBondContact O-N 2.73Å; L24-T26 PolarHBondContact O-N 2.98Å; L24-A40 HydrophobicContact CD1-CB 3.42Å; L24-A40 VanDerWaalsContact CD1-CB 3.42Å
25	N	91.3	Very high	92.3	Very high	87 Å²	87	66.8 Å²	66.8	47%	0.465	36%	0.358	S	S	.	.			trans	-57.4	127.2	-178.6	-175.1	-29.4	0	0	0	111.8	F27 R36	N25-F27 WeakPolarHBondContact OD1-CB 3.46Å; N25-F27 PolarHBondContact OD1-N 2.81Å; N25-R36 PolarHBondContact O-NH1 2.85Å
26	T	93.2	Very high	92.2	Very high	43 Å²	43	70.3 Å²	70.3	26%	0.264	37%	0.372	S	S	.	.			trans	-97.6	-0.3	-175.7	58.8	0	0	0	0	114.4	R16 L19 L24 L33	R16-T26 HydrophobicContact CB-CG2 4.34Å; R16-T26 WeakPolarHBondContact CD-O 3.49Å; R16-T26 WeakPolarHBondContact CG-O 3.4Å; R16-T26 PolarHBondContact NE-O 3.44Å; R16-T26 WeakPolarHBondContact O-CG2 3.28Å; L19-T26 HydrophobicContact CB-CG2 4.25Å; L24-T26 PolarHBondContact O-N 2.98Å; T26-L33 WeakPolarHBondContact O-CD2 3.47Å
27	F	88.9	Confident	92.2	Very high	158 Å²	158	65.3 Å²	65.3	69%	0.693	35%	0.353	S	S	*	.			trans	-89	126.9	177.5	-62.7	-80.5	0	0	0	111.9	N25 R36	N25-F27 WeakPolarHBondContact OD1-CB 3.46Å; N25-F27 PolarHBondContact OD1-N 2.81Å; F27-R36 PolarHBondContact O-NH1 2.59Å; F27-R36 PolarHBondContact O-NH2 3.36Å; F27-R36 VanDerWaalsContact O-NH2 3.09Å
28	G	89.3	Confident	92.1	Very high	30 Å²	30	65.6 Å²	65.6	31%	0.309	35%	0.347	S	S	.	.	S	Bend	trans	163.3	173.2	-179.2	0	0	0	0	0	113.2
29	T	92.5	Very high	92.1	Very high	90 Å²	90	68.8 Å²	68.8	55%	0.552	37%	0.365	S	S	*	.			trans	-74.3	169.4	161.5	55.8	0	0	0	0	110.1	Q31 I32 L33	T29-Q31 VanDerWaalsContact C-N 3.27Å; T29-Q31 PolarHBondContact O-N 3.44Å; T29-I32 PolarHBondContact O-N 2.92Å; T29-I32 WeakPolarHBondContact OG1-CD1 2.96Å; T29-L33 WeakPolarHBondContact O-CG 3.44Å; T29-L33 PolarHBondContact O-N 3.36Å
30	K	92.9	Very high	91.9	Very high	81 Å²	81	69.6 Å²	69.6	35%	0.352	37%	0.372	S	S	.	.	H	α-helix	trans	-53.3	-46.7	-179.7	-161.7	-157.3	178	-162	0	111.3	S8 L10 V12 L15 L33 M34	S8-K30 PolarHBondContact O-NZ 2.91Å; L10-K30 WeakPolarHBondContact O-CE 3.38Å; L10-K30 PolarHBondContact O-NZ 3.03Å; L10-K30 VanDerWaalsContact O-NZ 3.08Å; V12-K30 HydrophobicContact CG2-CB 3.96Å; V12-K30 HydrophobicContact CG2-CG 3.89Å; L15-K30 HydrophobicContact CD1-CD 4.44Å; L15-K30 HydrophobicContact CD1-CG 3.64Å; K30-L33 PolarHBondContact O-N 3.25Å; K30-M34 HydrophobicContact CD-CE 4.38Å; K30-M34 HydrophobicContact CD-SD 3.49Å; K30-M34 WeakPolarHBondContact CD-SD 3.37Å; K30-M34 WeakPolarHBondContact CE-SD 3.37Å; K30-M34 HydrophobicContact CG-CG 4.28Å; K30-M34 HydrophobicContact CG-SD 3.65Å; K30-M34 VanDerWaalsContact O-CG 3.25Å; K30-M34 WeakPolarHBondContact O-CG 3.38Å; K30-M34 PolarHBondContact O-N 3.4Å
31	Q	91.2	Very high	91.6	Very high	115 Å²	115	69.9 Å²	69.9	54%	0.537	36%	0.362	S	S	.	.	H	α-helix	trans	-55.4	-56.4	-179.4	-163.1	59.8	46.7	0	0	112	T29 L33 M34 D35	T29-Q31 VanDerWaalsContact C-N 3.27Å; T29-Q31 PolarHBondContact O-N 3.44Å; Q31-L33 PolarHBondContact O-N 3.27Å; Q31-M34 CarbonylContact O-C 3.48Å; Q31-M34 WeakPolarHBondContact O-CA 3.4Å; Q31-M34 WeakPolarHBondContact O-CB 3.39Å; Q31-M34 PolarHBondContact O-N 3.3Å; Q31-D35 VanDerWaalsContact C-OD2 3.26Å; Q31-D35 WeakPolarHBondContact CG-OD2 3.34Å; Q31-D35 PolarHBondContact NE2-OD1 3.08Å; Q31-D35 PolarHBondContact O-N 2.94Å; Q31-D35 VanDerWaalsContact O-OD2 3.04Å
32	I	92.8	Very high	91.3	Very high	73 Å²	73	67.6 Å²	67.6	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-55.9	-31.9	179.9	-63.4	170.4	0	0	0	112.6	T29 R36	T29-I32 PolarHBondContact O-N 2.92Å; T29-I32 WeakPolarHBondContact OG1-CD1 2.96Å; I32-R36 VanDerWaalsContact CG2-NH2 3.33Å; I32-R36 WeakPolarHBondContact O-CG 3.49Å; I32-R36 PolarHBondContact O-N 2.69Å
33	L	95.7	Very high	90.6	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-78.5	-32.3	176.5	-59	171.6	0	0	0	112.4	V12 L15 R16 L19 T26 T29 K30 Q31 L37	V12-L33 HydrophobicContact CG1-CD1 4.05Å; L15-L33 HydrophobicContact CB-CB 4.06Å; L15-L33 HydrophobicContact CD1-CB 4.22Å; R16-L33 HydrophobicContact CG-CD1 3.96Å; L19-L33 HydrophobicContact CD1-CB 3.8Å; L19-L33 HydrophobicContact CD1-CD2 3.5Å; L19-L33 VanDerWaalsContact CD1-CD2 3.5Å; L19-L33 HydrophobicContact CD1-CG 4.23Å; T26-L33 WeakPolarHBondContact O-CD2 3.47Å; T29-L33 WeakPolarHBondContact O-CG 3.44Å; T29-L33 PolarHBondContact O-N 3.36Å; K30-L33 PolarHBondContact O-N 3.25Å; Q31-L33 PolarHBondContact O-N 3.27Å; L33-L37 WeakPolarHBondContact O-CB 3.16Å; L33-L37 PolarHBondContact O-N 2.87Å
34	M	94.6	Very high	89.6	Confident	22 Å²	22	67.7 Å²	67.7	11%	0.108	36%	0.363	C	S	.	.	H	α-helix	trans	-72	-43	173.9	-64.4	166	92.5	0	0	110.9	V7 S8 L15 K30 Q31 L37 N38	V7-M34 HydrophobicContact CG1-CB 3.89Å; V7-M34 HydrophobicContact CG1-CG 4.09Å; V7-M34 VanDerWaalsContact O-CE 3.24Å; V7-M34 WeakPolarHBondContact O-CE 3.28Å; S8-M34 VanDerWaalsContact CA-CE 3.48Å; L15-M34 HydrophobicContact CD1-CG 3.55Å; L15-M34 HydrophobicContact CD1-SD 4.4Å; L15-M34 HydrophobicContact CD2-CG 3.82Å; L15-M34 HydrophobicContact CG-CG 4.36Å; K30-M34 HydrophobicContact CD-CE 4.38Å; K30-M34 HydrophobicContact CD-SD 3.49Å; K30-M34 WeakPolarHBondContact CD-SD 3.37Å; K30-M34 WeakPolarHBondContact CE-SD 3.37Å; K30-M34 HydrophobicContact CG-CG 4.28Å; K30-M34 HydrophobicContact CG-SD 3.65Å; K30-M34 VanDerWaalsContact O-CG 3.25Å; K30-M34 WeakPolarHBondContact O-CG 3.38Å; K30-M34 PolarHBondContact O-N 3.4Å; Q31-M34 CarbonylContact O-C 3.48Å; Q31-M34 WeakPolarHBondContact O-CA 3.4Å; Q31-M34 WeakPolarHBondContact O-CB 3.39Å; Q31-M34 PolarHBondContact O-N 3.3Å; M34-L37 PolarHBondContact O-N 2.83Å; M34-N38 WeakPolarHBondContact O-CB 3.35Å; M34-N38 VanDerWaalsContact O-CG 3.24Å; M34-N38 PolarHBondContact O-N 2.88Å; M34-N38 PolarHBondContact O-ND2 3.4Å
35	D	93.6	Very high	87.6	Confident	61 Å²	61	69.1 Å²	69.1	33%	0.326	38%	0.379	S	S	.	.	H	α-helix	trans	-60.6	-51.7	179.5	-52.1	-32.3	0	0	0	110.3	Q31 L37 N38 D39	Q31-D35 VanDerWaalsContact C-OD2 3.26Å; Q31-D35 WeakPolarHBondContact CG-OD2 3.34Å; Q31-D35 PolarHBondContact NE2-OD1 3.08Å; Q31-D35 PolarHBondContact O-N 2.94Å; Q31-D35 VanDerWaalsContact O-OD2 3.04Å; D35-L37 VanDerWaalsContact C-N 3.28Å; D35-L37 PolarHBondContact O-N 2.68Å; D35-N38 PolarHBondContact O-N 2.87Å; D35-D39 PolarHBondContact O-N 3.05Å
36	R	94.5	Very high	85.3	Confident	75 Å²	75	70.6 Å²	70.6	28%	0.283	39%	0.393	S	S	.	.	H	α-helix	trans	-56	-38.9	173.7	-73.9	-178.5	-163.5	140.5	9.7	113.5	L19 N25 F27 I32 A40	L19-R36 HydrophobicContact CD2-CB 3.75Å; N25-R36 PolarHBondContact O-NH1 2.85Å; F27-R36 PolarHBondContact O-NH1 2.59Å; F27-R36 PolarHBondContact O-NH2 3.36Å; F27-R36 VanDerWaalsContact O-NH2 3.09Å; I32-R36 VanDerWaalsContact CG2-NH2 3.33Å; I32-R36 WeakPolarHBondContact O-CG 3.49Å; I32-R36 PolarHBondContact O-N 2.69Å; R36-A40 VanDerWaalsContact O-CB 3.22Å; R36-A40 WeakPolarHBondContact O-CB 3.42Å; R36-A40 PolarHBondContact O-N 3.31Å
37	L	93.7	Very high	82.6	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.005	42%	0.424	C	S	.	.	H	α-helix	trans	-75.3	-37.2	-178.9	-176.8	58.4	0	0	0	111.6	V7 L10 L15 E18 L19 L33 M34 D35 A40 L41	V7-L37 HydrophobicContact CG1-CB 4.4Å; V7-L37 HydrophobicContact CG1-CD2 4.22Å; V7-L37 HydrophobicContact CG1-CG 4.49Å; V7-L37 HydrophobicContact CG2-CD2 3.99Å; V7-L37 HydrophobicContact CG2-CG 4.03Å; L10-L37 HydrophobicContact CD1-CD2 3.53Å; L15-L37 HydrophobicContact CD2-CD2 3.81Å; E18-L37 HydrophobicContact CB-CD1 4.45Å; E18-L37 HydrophobicContact CB-CD2 4.11Å; E18-L37 HydrophobicContact CG-CD1 3.68Å; E18-L37 HydrophobicContact CG-CD2 3.84Å; E18-L37 HydrophobicContact CG-CG 4.44Å; L19-L37 HydrophobicContact CD2-CB 4.04Å; L19-L37 HydrophobicContact CG-CB 4.48Å; L33-L37 WeakPolarHBondContact O-CB 3.16Å; L33-L37 PolarHBondContact O-N 2.87Å; M34-L37 PolarHBondContact O-N 2.83Å; D35-L37 VanDerWaalsContact C-N 3.28Å; D35-L37 PolarHBondContact O-N 2.68Å; L37-A40 PolarHBondContact O-N 2.84Å; L37-L41 HydrophobicContact CD1-CD1 4.46Å; L37-L41 HydrophobicContact CG-CD1 4.16Å; L37-L41 WeakPolarHBondContact O-CB 3.44Å; L37-L41 WeakPolarHBondContact O-CD1 3.34Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.49Å; L37-L41 PolarHBondContact O-N 3.34Å
38	N	92.1	Very high	80	Confident	60 Å²	60	74.1 Å²	74.1	32%	0.321	43%	0.425	S	S	.	.	H	α-helix	trans	-61.9	-45.9	172.5	-75.2	-33.2	0	0	0	111	V7 M34 D35 L41 K42	V7-N38 WeakPolarHBondContact CB-OD1 3.32Å; V7-N38 WeakPolarHBondContact CG1-OD1 3.08Å; V7-N38 WeakPolarHBondContact CG2-OD1 3.17Å; M34-N38 WeakPolarHBondContact O-CB 3.35Å; M34-N38 VanDerWaalsContact O-CG 3.24Å; M34-N38 PolarHBondContact O-N 2.88Å; M34-N38 PolarHBondContact O-ND2 3.4Å; D35-N38 PolarHBondContact O-N 2.87Å; N38-L41 PolarHBondContact O-N 3.47Å; N38-L41 VanDerWaalsContact O-N 3.17Å; N38-K42 WeakPolarHBondContact O-CG 3.46Å; N38-K42 PolarHBondContact O-N 3.11Å
39	D	90.7	Very high	77.4	Confident	84 Å²	84	79.8 Å²	79.8	45%	0.449	45%	0.449	S	S	.	.	H	α-helix	trans	-67.8	-38.6	179.7	-64.6	-25	0	0	0	111.6	D35 L41 K42 S43	D35-D39 PolarHBondContact O-N 3.05Å; D39-L41 VanDerWaalsContact C-N 3.27Å; D39-L41 PolarHBondContact O-N 2.87Å; D39-K42 PolarHBondContact O-N 3.34Å; D39-K42 IonicContact OD1-NZ 3.14Å; D39-K42 PolarHBondContact OD1-NZ 3.33Å; D39-S43 PolarHBondContact O-N 3.14Å; D39-S43 PolarHBondContact O-OG 3.41Å
40	A	89.1	Confident	74.6	Confident	17 Å²	17	85.5 Å²	85.5	14%	0.14	47%	0.466	C	S	.	.	H	α-helix	trans	-67.2	-22	171.8	0	0	0	0	0	114.5	L24 R36 L37 S43 A44	L24-A40 HydrophobicContact CD1-CB 3.42Å; L24-A40 VanDerWaalsContact CD1-CB 3.42Å; R36-A40 VanDerWaalsContact O-CB 3.22Å; R36-A40 WeakPolarHBondContact O-CB 3.42Å; R36-A40 PolarHBondContact O-N 3.31Å; L37-A40 PolarHBondContact O-N 2.84Å; A40-S43 WeakPolarHBondContact CA-OG 3.47Å; A40-S43 PolarHBondContact O-OG 3.46Å; A40-A44 VanDerWaalsContact O-CB 3.26Å; A40-A44 WeakPolarHBondContact O-CB 3.45Å
41	L	88.3	Confident	71.8	Confident	49 Å²	49	91.6 Å²	91.6	26%	0.257	49%	0.493	S	S	.	.	H	α-helix	trans	-81	-44.8	171.4	-79.3	161.9	0	0	0	110.8	V7 L37 N38 D39 S43 A44 S45	V7-L41 HydrophobicContact CG2-CD1 3.41Å; V7-L41 VanDerWaalsContact CG2-CD1 3.41Å; L37-L41 HydrophobicContact CD1-CD1 4.46Å; L37-L41 HydrophobicContact CG-CD1 4.16Å; L37-L41 WeakPolarHBondContact O-CB 3.44Å; L37-L41 WeakPolarHBondContact O-CD1 3.34Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.49Å; L37-L41 PolarHBondContact O-N 3.34Å; N38-L41 PolarHBondContact O-N 3.47Å; N38-L41 VanDerWaalsContact O-N 3.17Å; D39-L41 VanDerWaalsContact C-N 3.27Å; D39-L41 PolarHBondContact O-N 2.87Å; L41-S43 VanDerWaalsContact C-N 3.27Å; L41-S43 PolarHBondContact O-N 3.09Å; L41-A44 PolarHBondContact O-N 3Å; L41-S45 PolarHBondContact O-N 2.88Å
42	K	81.9	Confident	69.1	Low	150 Å²	150	93.6 Å²	93.6	65%	0.652	50%	0.502	S	S	*	.	H	α-helix	trans	-56.3	-41.1	173.6	-66.7	168	-160.3	162.5	0	111.8	N38 D39 A44	N38-K42 WeakPolarHBondContact O-CG 3.46Å; N38-K42 PolarHBondContact O-N 3.11Å; D39-K42 PolarHBondContact O-N 3.34Å; D39-K42 IonicContact OD1-NZ 3.14Å; D39-K42 PolarHBondContact OD1-NZ 3.33Å; K42-A44 PolarHBondContact O-N 3.14Å
43	S	75.3	Confident	66.3	Low	102 Å²	102	95.8 Å²	95.8	71%	0.713	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.6	177.3	66.7	0	0	0	0	114.5	D39 A40 L41	D39-S43 PolarHBondContact O-N 3.14Å; D39-S43 PolarHBondContact O-OG 3.41Å; A40-S43 WeakPolarHBondContact CA-OG 3.47Å; A40-S43 PolarHBondContact O-OG 3.46Å; L41-S43 VanDerWaalsContact C-N 3.27Å; L41-S43 PolarHBondContact O-N 3.09Å
44	A	68.7	Low	63.5	Low	59 Å²	59	100.3 Å²	100.3	49%	0.488	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.9	3.4	-174	0	0	0	0	0	114.2	A40 L41 K42 P46	A40-A44 VanDerWaalsContact O-CB 3.26Å; A40-A44 WeakPolarHBondContact O-CB 3.45Å; L41-A44 PolarHBondContact O-N 3Å; K42-A44 PolarHBondContact O-N 3.14Å; A44-P46 WeakPolarHBondContact O-CD 3.49Å
45	S	50.1	Low	60.7	Low	95 Å²	95	105.3 Å²	105.3	66%	0.664	59%	0.585	S	S	*	*			trans	-106.2	95.7	-179.8	-69.7	0	0	0	0	112.1	L41	L41-S45 PolarHBondContact O-N 2.88Å
46	P	42.1	Very low	58.1	Low	117 Å²	117	107.2 Å²	107.2	76%	0.76	60%	0.601	S	S	*	*			trans	-78.2	120.6	173.2	30.9	-33.6	0	0	0	112	A44	A44-P46 WeakPolarHBondContact O-CD 3.49Å
47	N	37.1	Very low	55.1	Low	172 Å²	172	111.5 Å²	111.5	92%	0.92	62%	0.624	S	S	*	*			trans	10.7	100.1	162.9	-66.8	-26.2	0	0	0	119.5
48	S	33.3	Very low	52.3	Low	103 Å²	103	116.7 Å²	116.7	72%	0.72	65%	0.648	S	S	*	*			trans	-148.2	133.2	151.4	56.6	0	0	0	0	107.7
49	D	35.7	Very low	49.5	Very low	150 Å²	150	117.2 Å²	117.2	80%	0.802	65%	0.649	S	S	*	*			cis	-133.8	156.3	10.5	-77.6	-53.1	0	0	0	112.7
50	K	32.5	Very low	46.9	Very low	210 Å²	210	114.4 Å²	114.4	91%	0.913	64%	0.635	S	S	*	*			trans	-119.8	129.7	150.7	-79.4	-173.9	176.1	-178.4	0	108.3
51	K	35.4	Very low	44.3	Very low	209 Å²	209	118.2 Å²	118.2	91%	0.909	65%	0.65	S	S	*	*			trans	-104.5	132.4	164	-87.5	-174.7	174.3	177.4	0	110.7
52	Q	33.9	Very low	41.8	Very low	156 Å²	156	122.7 Å²	122.7	73%	0.729	67%	0.673	S	S	*	*			trans	-79.5	172.8	177.8	-138.1	175.4	-7.6	0	0	109.6	D55	Q52-D55 PolarHBondContact NE2-OD2 2.92Å; Q52-D55 VanDerWaalsContact NE2-OD2 3.07Å
53	P	34.8	Very low	39.6	Very low	120 Å²	120	119.6 Å²	119.6	78%	0.779	68%	0.675	S	S	*	*				-148.7	172.4	73.3	39.7	-21	0	0	0	117.4
54	A	35.2	Very low	37.8	Very low	94 Å²	94	120 Å²	120	78%	0.777	68%	0.678	S	S	*	*			trans	83.2	86	153.5	0	0	0	0	0	120.4
55	D	37.1	Very low	36.4	Very low	127 Å²	127	121.7 Å²	121.7	68%	0.679	69%	0.692	S	S	*	*			trans	-61.2	-176	149.4	-67.1	-74.9	0	0	0	112.5	Q52	Q52-D55 PolarHBondContact NE2-OD2 2.92Å; Q52-D55 VanDerWaalsContact NE2-OD2 3.07Å
56	P	37.7	Very low	35.7	Very low	101 Å²	101	124 Å²	124	66%	0.656	70%	0.697	S	S	*	*			cis	-148.3	178.8	17.4	44.9	-24	0	0	0	121.3
57	E	32.8	Very low	35.5	Very low	165 Å²	165	125.5 Å²	125.5	77%	0.771	70%	0.698	S	S	*	*			trans	92.8	153.7	143	-88	157.4	-130	0	0	123.2
58	E	34.4	Very low	35.5	Very low	110 Å²	110	122.5 Å²	122.5	51%	0.514	69%	0.691	S	S	.	*			trans	-130.4	-152	-151.8	-41.2	179.4	135	0	0	115.4	Y935 N936	E58-Y935 HydrophobicContact CB-CD1 4.02Å; E58-N936 HydrophobicContact CB-CB 3.8Å; E58-N936 PolarHBondContact OE2-N 3.26Å
59	Q	33.6	Very low	35.4	Very low	72 Å²	72	129 Å²	129	34%	0.336	70%	0.699	S	S	.	*			trans	132.6	151.5	150	-55.8	-94.6	-8.8	0	0	114.8	Y935 N936	Q59-Y935 HydrophobicContact CB-CD1 4.16Å; Q59-Y935 HydrophobicContact CB-CE1 4.1Å; Q59-Y935 HydrophobicContact CG-CD1 2.82Å; Q59-Y935 HydrophobicContact CG-CD2 3.92Å; Q59-Y935 HydrophobicContact CG-CE1 2.52Å; Q59-Y935 HydrophobicContact CG-CE2 3.65Å; Q59-Y935 HydrophobicContact CG-CG 3.52Å; Q59-Y935 PolarHBondContact NE2-OH 2.9Å; Q59-Y935 VanDerWaalsContact OE1-CD1 3.31Å; Q59-N936 PolarHBondContact O-ND2 3.1Å
60	P	35.1	Very low	35.3	Very low	24 Å²	24	131 Å²	131	16%	0.156	70%	0.704	C	S	.	*			trans	-160.6	-159.7	-136.2	54.5	-37.9	0	0	0	123	G933 G934 Y935 N936	P60-G933 WeakPolarHBondContact O-CA 3.07Å; P60-G934 VanDerWaalsContact CG-N 3.33Å; P60-Y935 VanDerWaalsContact CG-C 3.47Å; P60-Y935 WeakPolarHBondContact CG-O 3.43Å; P60-N936 HydrophobicContact CB-CB 3.62Å; P60-N936 VanDerWaalsContact CB-OD1 3.3Å; P60-N936 WeakPolarHBondContact CB-OD1 3.16Å; P60-N936 HydrophobicContact CG-CB 4.49Å
61	H	35.6	Very low	35.3	Very low	97 Å²	97	127 Å²	127	45%	0.449	70%	0.699	S	S	.	*			trans	68.8	159.8	143.2	85.9	-163.2	0	0	0	120.4	G934	H61-G934 WeakPolarHBondContact CE1-CA 3.44Å; H61-G934 PolarHBondContact CE1-N 2.99Å; H61-G934 PolarHBondContact CE1-O 3.06Å; H61-G934 PolarHBondContact ND1-O 2.93Å; H61-G934 PolarHBondContact NE2-N 2.87Å; H61-G934 VanDerWaalsContact NE2-N 3.12Å
62	L	36.2	Very low	35.2	Very low	144 Å²	144	122.4 Å²	122.4	75%	0.754	69%	0.694	S	S	*	*			cis	-158.7	-178.1	32.8	-128.2	175.4	0	0	0	113.6
63	A	36	Very low	35	Very low	84 Å²	84	123.8 Å²	123.8	69%	0.694	70%	0.7	S	S	*	*			trans	76.3	152.9	157.4	0	0	0	0	0	121.5
64	S	36.9	Very low	34.8	Very low	110 Å²	110	125 Å²	125	77%	0.769	70%	0.7	S	S	*	*			cis	-172.7	163.4	-19.6	-94.9	0	0	0	0	114.4
65	A	39.1	Very low	34.4	Very low	95 Å²	95	125.6 Å²	125.6	79%	0.785	70%	0.699	S	S	*	*			trans	75	147.4	149.1	0	0	0	0	0	122.5
66	N	36	Very low	34.1	Very low	144 Å²	144	123.1 Å²	123.1	77%	0.77	70%	0.703	S	S	*	*			cis	-170.2	168.6	-26.3	-142.5	-15.7	0	0	0	114.7
67	L	38.1	Very low	33.8	Very low	149 Å²	149	128.9 Å²	128.9	78%	0.78	71%	0.712	S	S	*	*			trans	67.6	149.3	157.5	-61.8	160.1	0	0	0	120.3
68	S	35.7	Very low	33.7	Very low	109 Å²	109	127.4 Å²	127.4	76%	0.762	71%	0.709	S	S	*	*			cis	-164.3	170.9	-19.9	59.9	0	0	0	0	112.9
69	R	31.3	Very low	33.7	Very low	239 Å²	239	127.7 Å²	127.7	90%	0.902	72%	0.718	S	S	*	*			trans	-115.6	158	-179.9	-68.6	171.1	162.6	-178.6	-5.5	112.4
70	Q	33.7	Very low	33.7	Very low	193 Å²	193	131.3 Å²	131.3	90%	0.902	74%	0.739	S	S	*	*			trans	-154.4	148.7	141.3	-78.2	-148	6.8	0	0	113.6
71	P	33.6	Very low	33.6	Very low	124 Å²	124	136.6 Å²	136.6	81%	0.805	77%	0.766	S	S	*	*			trans	-133.8	146.2	170.8	39.9	-25.3	0	0	0	116.8
72	S	32.7	Very low	33.5	Very low	114 Å²	114	136.6 Å²	136.6	80%	0.797	78%	0.777	S	S	*	*			trans	-166	140.3	160.7	40.1	0	0	0	0	107.7
73	Q	29.1	Very low	33.2	Very low	185 Å²	185	135 Å²	135	86%	0.864	78%	0.778	S	S	*	*			cis	92.5	137.3	47.6	-79.5	-162.5	1.8	0	0	115.5
74	N	30.8	Very low	33.2	Very low	145 Å²	145	136.3 Å²	136.3	78%	0.775	78%	0.779	S	S	*	*			trans	78.2	95.8	165.4	-88.9	-3.7	0	0	0	122.8
75	S	27.1	Very low	32.7	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	79%	0.785	S	S	*	*				66.3	132.2	106.1	66.4	0	0	0	0	123.6
76	G	31	Very low	32.4	Very low	75 Å²	75	142.5 Å²	142.5	77%	0.773	79%	0.785	S	S	*	*			trans	101.2	147.6	163.5	0	0	0	0	0	115
77	R	30.5	Very low	32.2	Very low	221 Å²	221	140.7 Å²	140.7	83%	0.834	78%	0.784	S	S	*	*			cis	-168.7	154.3	-15.8	-136.1	-176.3	-173.9	160.7	3.3	108.7
78	D	32.1	Very low	31.9	Very low	134 Å²	134	138.3 Å²	138.3	72%	0.717	78%	0.777	S	S	*	*			trans	66.1	153.7	156.5	-50.4	-31.3	0	0	0	116.7
79	V	34.2	Very low	31.4	Very low	116 Å²	116	140.3 Å²	140.3	70%	0.703	78%	0.775	S	S	*	*			cis	-160.4	149	-4.1	99.4	0	0	0	0	112.2
80	L	34	Very low	31.1	Very low	149 Å²	149	140.1 Å²	140.1	78%	0.78	77%	0.774	S	S	*	*			trans	59.7	162.6	162.1	-61.3	171.7	0	0	0	118.6
81	D	32.2	Very low	30.7	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	77%	0.765	S	S	*	*			cis	-135.4	153.4	-0.9	-156.1	11.6	0	0	0	115.1
82	S	32.6	Very low	30.4	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	76%	0.764	S	S	*	*			trans	-29.4	154.4	174.7	-50.3	0	0	0	0	121.8
83	S	31.3	Very low	30.1	Very low	110 Å²	110	136.6 Å²	136.6	77%	0.769	76%	0.764	S	S	*	*			trans	-82	159.4	160.5	-33.8	0	0	0	0	112.1
84	P	35.2	Very low	30.1	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	76%	0.758	S	S	*	*			trans	-106.9	111.6	152.2	34	-26.5	0	0	0	111.4	V86	P84-V86 HydrophobicContact CB-CG2 4.16Å
85	K	26.9	Very low	29.9	Very low	206 Å²	206	130.8 Å²	130.8	90%	0.896	76%	0.755	S	S	*	*			trans	-73.9	123.5	155.1	-71.5	177.6	179.5	174.8	0	107.3
86	V	31.9	Very low	30	Very low	129 Å²	129	134 Å²	134	78%	0.782	76%	0.763	S	S	*	*			trans	-125.8	82.6	172.7	-169.1	0	0	0	0	111.3	P84	P84-V86 HydrophobicContact CB-CG2 4.16Å
87	S	32.7	Very low	30.1	Very low	106 Å²	106	134 Å²	134	74%	0.741	76%	0.755	S	S	*	*				-82	160.3	128.4	-53.6	0	0	0	0	107
88	P	30.6	Very low	30.1	Very low	99 Å²	99	129.8 Å²	129.8	64%	0.643	75%	0.75	S	S	*	*			cis	-146.5	-168.1	23.7	40.7	-18.5	0	0	0	115.9
89	Q	26.3	Very low	30	Very low	151 Å²	151	129.9 Å²	129.9	71%	0.706	75%	0.746	S	S	*	*			trans	55.4	122.7	140.7	-78.5	163.7	-19.6	0	0	123.1
90	R	25.4	Very low	29.9	Very low	234 Å²	234	131.1 Å²	131.1	88%	0.883	74%	0.742	S	S	*	*				44.9	128.4	118.3	-57.2	179.3	-178.5	-179	-0.9	120.1
91	G	25.7	Very low	29.8	Very low	69 Å²	69	130.2 Å²	130.2	71%	0.711	74%	0.738	S	S	*	*			trans	148.1	80.5	170.6	0	0	0	0	0	108.2
92	C	25.2	Very low	29.7	Very low	117 Å²	117	129.3 Å²	129.3	79%	0.791	74%	0.742	S	S	*	*				75.2	157.2	65.6	-59	0	0	0	0	113.2
93	E	28	Very low	29.6	Very low	172 Å²	172	129.9 Å²	129.9	80%	0.804	75%	0.746	S	S	*	*			trans	80.5	146	173.8	-47.5	-150.9	115.2	0	0	118.1
94	N	27.5	Very low	29.8	Very low	139 Å²	139	130.8 Å²	130.8	74%	0.743	75%	0.749	S	S	*	*			cis	-164.8	147	-31.9	-105.3	-27.8	0	0	0	111
95	G	27.8	Very low	29.5	Very low	69 Å²	69	128 Å²	128	71%	0.711	74%	0.741	S	S	*	*			trans	72.9	163.1	167.8	0	0	0	0	0	115.9
96	L	29.3	Very low	29.7	Very low	174 Å²	174	121.4 Å²	121.4	91%	0.911	72%	0.715	S	S	*	*			cis	-148.1	150.9	-1.6	-80.4	172.6	0	0	0	107.1
97	A	32.5	Very low	29.7	Very low	74 Å²	74	121.1 Å²	121.1	61%	0.612	71%	0.706	S	S	*	*			cis	-158	165.5	-4.6	0	0	0	0	0	111.1
98	N	30.3	Very low	29.9	Very low	133 Å²	133	120.1 Å²	120.1	71%	0.711	69%	0.689	S	S	*	*			trans	66.8	113.1	154.1	-72	21.5	0	0	0	119.3
99	E	30.8	Very low	30	Very low	137 Å²	137	124 Å²	124	64%	0.64	70%	0.698	S	S	*	*				81.1	135.8	81.3	-74.2	-164.7	162.2	0	0	112.2
100	K	32.1	Very low	30.7	Very low	141 Å²	141	126.1 Å²	126.1	61%	0.613	71%	0.705	S	S	*	*			cis	-157.4	148.4	7.4	-116.6	166.7	-177	139.5	0	112.3
101	D	30.9	Very low	31.2	Very low	130 Å²	130	120 Å²	120	70%	0.695	70%	0.696	S	S	*	*			trans	58.8	132.4	134.5	-60.6	-6	0	0	0	125.4
102	S	31.4	Very low	31.8	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	70%	0.703	S	S	*	*			trans	78.8	107.8	131	-64.5	0	0	0	0	123.7
103	S	29.4	Very low	32.3	Very low	111 Å²	111	128.5 Å²	128.5	78%	0.776	71%	0.705	S	S	*	*			trans	-68.8	-176.9	135.7	-18.2	0	0	0	0	111.2
104	P	35.4	Very low	32.8	Very low	128 Å²	128	128.6 Å²	128.6	83%	0.831	71%	0.706	S	S	*	*			cis	-130	-147.4	-12.5	41.8	-22.7	0	0	0	111.1
105	G	29.2	Very low	33.3	Very low	53 Å²	53	126.8 Å²	126.8	55%	0.546	70%	0.696	S	S	.	*			trans	132	94.4	164.5	0	0	0	0	0	114.1	N988	G105-N988 VanDerWaalsContact O-CB 3.25Å; G105-N988 WeakPolarHBondContact O-CB 3.42Å
106	D	31.7	Very low	33.9	Very low	69 Å²	69	129.9 Å²	129.9	37%	0.369	70%	0.696	S	S	.	*			cis	101.3	30.7	23.2	-138.3	41	0	0	0	121.4	Q986 Q987 N988	D106-Q986 HydrophobicContact CB-CB 4.4Å; D106-Q986 WeakPolarHBondContact O-CB 3.42Å; D106-Q986 PolarHBondContact O-OE1 3.15Å; D106-Q986 VanDerWaalsContact OD1-CA 3.23Å; D106-Q986 WeakPolarHBondContact OD1-CA 3.05Å; D106-Q986 PolarHBondContact OD1-N 3.37Å; D106-Q986 VanDerWaalsContact OD1-N 3.09Å; D106-Q986 WeakPolarHBondContact OD2-CB 3.47Å; D106-Q986 PolarHBondContact OD2-N 2.83Å; D106-Q986 VanDerWaalsContact OD2-N 3.09Å; D106-Q987 PolarHBondContact O-N 3.15Å; D106-Q987 PolarHBondContact OD1-N 3.35Å; D106-N988 VanDerWaalsContact C-N 3.28Å
107	Q	31.8	Very low	34.2	Very low	123 Å²	123	129.4 Å²	129.4	58%	0.575	69%	0.686	S	S	*	*			trans	-134.2	177.1	158.3	-70.9	-154	-17.1	0	0	118.5	Q987 N988	Q107-Q987 CarbonylContact O-C 3.59Å; Q107-Q987 WeakPolarHBondContact O-CA 3.49Å; Q107-Q987 WeakPolarHBondContact O-CG 3.46Å; Q107-N988 VanDerWaalsContact C-OD1 3.28Å; Q107-N988 WeakPolarHBondContact O-CA 3.28Å; Q107-N988 PolarHBondContact O-N 3Å; Q107-N988 PolarHBondContact O-OD1 2.91Å
108	H	37.1	Very low	34.4	Very low	85 Å²	85	136.7 Å²	136.7	39%	0.394	70%	0.698	S	S	.	*			trans	-131.8	157.9	-131.8	-118.7	-71.5	0	0	0	116.1	Q987	H108-Q987 VanDerWaalsContact ND1-CD 3.33Å; H108-Q987 PolarHBondContact ND1-OE1 2.87Å
109	Q	32.1	Very low	34.7	Very low	180 Å²	180	141.4 Å²	141.4	84%	0.841	71%	0.706	S	S	*	*				166	155.2	125.4	-93.5	158.1	102.7	0	0	119.4
110	K	40.9	Very low	35	Very low	196 Å²	196	145.9 Å²	145.9	85%	0.852	72%	0.717	S	S	*	*			trans	-167.5	133.8	166.3	-171.7	-175.7	-173.1	-177.3	0	111.8
111	P	37.2	Very low	35.2	Very low	104 Å²	104	144.1 Å²	144.1	68%	0.675	72%	0.722	S	S	*	*			trans	-122	-179.1	157.5	40.7	-28.6	0	0	0	111
112	E	38.3	Very low	35.7	Very low	185 Å²	185	143.5 Å²	143.5	86%	0.864	73%	0.725	S	S	*	*			cis	-146.3	-170.5	2.2	-151.6	131.6	-121.3	0	0	111.2
113	Q	33.8	Very low	36	Very low	181 Å²	181	143.5 Å²	143.5	85%	0.846	73%	0.725	S	S	*	*			trans	-129.6	160.8	177.6	-57.9	179.7	22.4	0	0	111.5
114	E	39.4	Very low	36.2	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.813	73%	0.725	S	S	*	*			trans	160	159.9	146.8	-93.6	-149	159.8	0	0	111.2
115	N	38.6	Very low	36.4	Very low	101 Å²	101	144.4 Å²	144.4	54%	0.54	72%	0.716	S	S	.	*			cis	-155.3	174.2	-12.1	-136.1	-25.5	0	0	0	113.3
116	L	40.1	Very low	36.9	Very low	133 Å²	133	147.5 Å²	147.5	70%	0.696	73%	0.726	S	S	*	*			trans	39.9	151.3	152.3	-57.3	172.2	0	0	0	122.4
117	K	35.9	Very low	37	Very low	165 Å²	165	155.9 Å²	155.9	72%	0.717	75%	0.753	S	S	*	*			cis	148.6	136.7	-26	-95.4	-178.9	-166.2	153.3	0	109.3
118	R	35.4	Very low	37.2	Very low	227 Å²	227	160.8 Å²	160.8	86%	0.857	77%	0.766	S	S	*	*			trans	71.7	156.2	168.3	-58.8	161.7	175.2	179.8	-2.5	113.9
119	R	37.3	Very low	37.1	Very low	231 Å²	231	166.6 Å²	166.6	87%	0.872	78%	0.784	S	S	*	*			cis	-159.7	171.5	4.5	-121.4	167.9	-177.6	174	-0.7	105.8
120	R	36.5	Very low	37	Very low	232 Å²	232	164.2 Å²	164.2	88%	0.875	79%	0.788	S	S	*	*			cis	-160	158.6	-6.6	-169.9	-170.6	-177.5	173.6	1.9	107.4
121	S	37.5	Very low	36.6	Very low	104 Å²	104	165.6 Å²	165.6	73%	0.727	79%	0.788	S	S	*	*			trans	-97.2	168.5	171.9	-43.3	0	0	0	0	113.1
122	P	40.1	Very low	36.7	Very low	116 Å²	116	165.5 Å²	165.5	75%	0.753	79%	0.79	S	S	*	*				-158.6	150.9	93.5	38.5	-18	0	0	0	120.3
123	S	37.4	Very low	36.5	Very low	115 Å²	115	167.6 Å²	167.6	80%	0.804	79%	0.789	S	S	*	*			trans	70.6	161.3	148.6	83.6	0	0	0	0	118.9
124	H	35	Very low	36.6	Very low	166 Å²	166	165.9 Å²	165.9	77%	0.769	79%	0.786	S	S	*	*			cis	-152.1	141.6	0.7	-168.9	72.2	0	0	0	113.5
125	S	39.7	Very low	36.5	Very low	92 Å²	92	167.1 Å²	167.1	64%	0.643	78%	0.784	S	S	*	*			trans	63.3	168.2	162.8	77.7	0	0	0	0	120.6
126	P	40.1	Very low	36.5	Very low	119 Å²	119	168 Å²	168	77%	0.773	79%	0.788	S	S	*	*			cis	-122.4	150	-30.7	18.6	2.5	0	0	0	113.9
127	R	32.5	Very low	36.3	Very low	244 Å²	244	166.7 Å²	166.7	92%	0.921	79%	0.79	S	S	*	*			trans	-63.5	137.7	178.8	-65.2	166.8	167.4	154.6	-7.8	113.6
128	R	36.9	Very low	36.4	Very low	226 Å²	226	169 Å²	169	85%	0.853	79%	0.794	S	S	*	*			trans	-160.8	123.7	142.2	-109.4	152	-157	-124.7	2.3	115.9
129	R	35	Very low	36.4	Very low	207 Å²	207	167.5 Å²	167.5	78%	0.781	79%	0.788	S	S	*	*			trans	65.3	68.7	153.9	-63.1	-179.2	176.2	168.6	-1.3	119.6	R131	R129-R131 PolarHBondContact O-N 3.49Å
130	S	30.1	Very low	36.5	Very low	130 Å²	130	161.1 Å²	161.1	91%	0.909	78%	0.78	S	S	*	*			trans	-63.6	93	151.4	-38.6	0	0	0	0	110.7
131	R	32.9	Very low	36.7	Very low	225 Å²	225	155.8 Å²	155.8	85%	0.849	78%	0.775	S	S	*	*			trans	-151.4	75.8	175.7	-73.8	-166.4	176.3	173.5	-2	113	R129	R129-R131 PolarHBondContact O-N 3.49Å
132	S	38.9	Very low	36.8	Very low	103 Å²	103	162.5 Å²	162.5	72%	0.72	78%	0.784	S	S	*	*	S	Bend	trans	-148.8	-22.9	167.4	63.4	0	0	0	0	114.9
133	R	34.6	Very low	36.8	Very low	228 Å²	228	168.2 Å²	168.2	86%	0.86	79%	0.791	S	S	*	*	S	Bend	trans	-69.2	157.9	158.7	-62	179.3	-177.9	171.7	0.2	108.9
134	D	35.5	Very low	37	Very low	145 Å²	145	174 Å²	174	78%	0.775	80%	0.795	S	S	*	*	S	Bend	trans	70.1	36.4	-172.6	-47.3	-33	0	0	0	116.8
135	R	36.6	Very low	37.4	Very low	201 Å²	201	171.1 Å²	171.1	76%	0.758	79%	0.793	S	S	*	*			trans	-118.9	-21.7	168.8	-115.2	-178.4	-176.8	-174.4	0.8	117.3	R138	R135-R138 PolarHBondContact O-N 2.91Å
136	D	39.2	Very low	37.4	Very low	120 Å²	120	176.9 Å²	176.9	64%	0.642	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-78.3	-21.1	178	-72.8	-66	0	0	0	114.1	R138 R139	D136-R138 PolarHBondContact O-N 2.74Å; D136-R139 PolarHBondContact O-N 3.38Å; D136-R139 IonicContact OD1-CZ 2.72Å; D136-R139 IonicContact OD1-NE 3.12Å; D136-R139 IonicContact OD1-NH1 3.92Å
137	S	35.9	Very low	37.6	Very low	104 Å²	104	176 Å²	176	73%	0.727	80%	0.798	S	S	*	*	G	3₁₀ helix	trans	-72.1	-5.1	168.1	58	0	0	0	0	114.1
138	R	36.9	Very low	38	Very low	213 Å²	213	169.9 Å²	169.9	80%	0.804	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-118.3	12.8	174.2	-65.4	-166.4	-175.9	-158.4	2.6	114	R135 D136 S140	R135-R138 PolarHBondContact O-N 2.91Å; D136-R138 PolarHBondContact O-N 2.74Å; R138-S140 PolarHBondContact O-N 3.26Å
139	R	36.8	Very low	38.3	Very low	196 Å²	196	166.4 Å²	166.4	74%	0.74	78%	0.783	S	S	*	*			trans	-71.5	80.4	148.6	-76.1	-179.2	171.1	-178.6	0.7	107.2	D136	D136-R139 PolarHBondContact O-N 3.38Å; D136-R139 IonicContact OD1-CZ 2.72Å; D136-R139 IonicContact OD1-NE 3.12Å; D136-R139 IonicContact OD1-NH1 3.92Å
140	S	37.8	Very low	38.8	Very low	98 Å²	98	162 Å²	162	69%	0.685	78%	0.778	S	S	*	*			trans	-44.6	131.2	160.3	45.1	0	0	0	0	107.2	R138 R142	R138-S140 PolarHBondContact O-N 3.26Å; S140-R142 PolarHBondContact O-N 3.43Å
141	P	40.4	Very low	39.5	Very low	120 Å²	120	164.9 Å²	164.9	78%	0.779	78%	0.775	S	S	*	*			trans	-50.9	115.8	-172.9	-28.7	34.4	0	0	0	108.1	R143	P141-R143 VanDerWaalsContact C-N 3.32Å; P141-R143 PolarHBondContact O-N 3.25Å
142	R	41.5	Very low	40.2	Very low	244 Å²	244	157.9 Å²	157.9	92%	0.921	76%	0.76	S	S	*	*			trans	-51	109.1	172.8	-93.7	-174.1	171.4	-179.1	-3.2	103.5	S140 R144	S140-R142 PolarHBondContact O-N 3.43Å; R142-R144 PolarHBondContact O-N 2.9Å
143	R	39.8	Very low	41	Very low	237 Å²	237	160 Å²	160	89%	0.894	75%	0.753	S	S	*	*			trans	-61.8	95.6	-177.3	-75.3	-173.7	174.8	-162.7	-0.9	104.9	P141 S145	P141-R143 VanDerWaalsContact C-N 3.32Å; P141-R143 PolarHBondContact O-N 3.25Å; R143-S145 VanDerWaalsContact C-N 3.29Å; R143-S145 PolarHBondContact O-N 3.05Å
144	R	40	Very low	42	Very low	237 Å²	237	150 Å²	150	89%	0.894	72%	0.716	S	S	*	*			trans	-51.8	107.4	162.9	-80.5	-178.3	170.8	170.3	-2.7	102.4	R142 R146	R142-R144 PolarHBondContact O-N 2.9Å; R144-R146 WeakPolarHBondContact O-CA 3.24Å; R144-R146 PolarHBondContact O-N 3.48Å
145	S	43.3	Very low	43.3	Very low	104 Å²	104	146.1 Å²	146.1	73%	0.727	70%	0.697	S	S	*	*			trans	-48.3	110.5	-175.5	-54.7	0	0	0	0	106.1	R143 S147	R143-S145 VanDerWaalsContact C-N 3.29Å; R143-S145 PolarHBondContact O-N 3.05Å; S145-S147 WeakPolarHBondContact O-CA 3.5Å; S145-S147 PolarHBondContact O-N 2.8Å
146	R	41.4	Very low	44.6	Very low	213 Å²	213	141.5 Å²	141.5	80%	0.804	69%	0.693	S	S	*	*			trans	-51.7	109.9	-163.1	-164.3	-175.2	-162.4	-171.4	5.4	106	R144 P148	R144-R146 WeakPolarHBondContact O-CA 3.24Å; R144-R146 PolarHBondContact O-N 3.48Å; R146-P148 WeakPolarHBondContact O-CA 3.46Å
147	S	44.2	Very low	46	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	67%	0.669	S	S	*	*			trans	-43.1	117.1	-157.3	-55.4	0	0	0	0	108.3	S145 Q149	S145-S147 WeakPolarHBondContact O-CA 3.5Å; S145-S147 PolarHBondContact O-N 2.8Å; S147-Q149 PolarHBondContact O-N 2.88Å
148	P	40.7	Very low	47.4	Very low	114 Å²	114	135.6 Å²	135.6	74%	0.74	66%	0.656	S	S	*	*			trans	-47.8	109.1	-158	-31.6	34.6	0	0	0	109.4	R146 V150	R146-P148 WeakPolarHBondContact O-CA 3.46Å; P148-V150 PolarHBondContact O-N 2.85Å
149	Q	42.7	Very low	49	Very low	154 Å²	154	132.5 Å²	132.5	72%	0.72	66%	0.656	S	S	*	*			trans	-61.1	113.3	-175.8	-76.7	-167.8	-89.2	0	0	105.1	S147 K151	S147-Q149 PolarHBondContact O-N 2.88Å; Q149-K151 PolarHBondContact O-N 2.93Å
150	V	45.5	Very low	50.9	Low	113 Å²	113	128 Å²	128	69%	0.685	65%	0.646	S	S	*	*			trans	-55.8	108.4	179	178	0	0	0	0	104.3	P148 S152	P148-V150 PolarHBondContact O-N 2.85Å; V150-S152 VanDerWaalsContact C-N 3.33Å; V150-S152 PolarHBondContact O-N 2.54Å
151	K	45.2	Very low	53	Low	192 Å²	192	124 Å²	124	84%	0.835	62%	0.616	S	S	*	*			trans	-60.6	106.7	172.6	-70.6	-176	178.1	-177.2	0	104.2	Q149 R153	Q149-K151 PolarHBondContact O-N 2.93Å; K151-R153 VanDerWaalsContact C-N 3.32Å; K151-R153 PolarHBondContact O-N 2.99Å
152	S	47.6	Very low	55	Low	78 Å²	78	120.4 Å²	120.4	55%	0.545	59%	0.589	S	S	.	*			trans	-62.7	98	-175.3	50.3	0	0	0	0	107.7	V150 M154	V150-S152 VanDerWaalsContact C-N 3.33Å; V150-S152 PolarHBondContact O-N 2.54Å; S152-M154 CarbonylContact C-O 3.19Å
153	R	55.2	Low	57	Low	148 Å²	148	116.2 Å²	116.2	56%	0.558	58%	0.58	S	S	*	*			trans	-67.3	-29.8	172.7	-80.5	-177	173.1	158.3	-8.1	110.6	K151 M179 E192	K151-R153 VanDerWaalsContact C-N 3.32Å; K151-R153 PolarHBondContact O-N 2.99Å; R153-M179 HydrophobicContact CB-CE 3.88Å; R153-M179 HydrophobicContact CB-SD 4.2Å; R153-M179 WeakPolarHBondContact O-CE 3.19Å; R153-E192 IonicContact CZ-OE1 2.71Å; R153-E192 VanDerWaalsContact CZ-OE1 3.28Å; R153-E192 IonicContact CZ-OE2 2.69Å; R153-E192 IonicContact NH1-OE1 2.78Å; R153-E192 PolarHBondContact NH1-OE1 3.29Å; R153-E192 IonicContact NH1-OE2 3.57Å; R153-E192 PolarHBondContact NH1-OE2 3.42Å; R153-E192 IonicContact NH2-OE1 2.83Å; R153-E192 PolarHBondContact NH2-OE1 2.89Å; R153-E192 IonicContact NH2-OE2 3.97Å
154	M	56	Low	59.2	Low	18 Å²	18	106.6 Å²	106.6	9%	0.089	55%	0.549	C	S	.	.	S	Bend	trans	-69.8	129.5	164.5	-71.6	-175.7	161.9	0	0	109.9	S152 L176 M458 M461 R462	S152-M154 CarbonylContact C-O 3.19Å; M154-L176 WeakPolarHBondContact CE-O 3.18Å; M154-M458 HydrophobicContact CE-CB 3.98Å; M154-M458 HydrophobicContact CE-CE 4.33Å; M154-M458 HydrophobicContact CE-CG 4.25Å; M154-M458 HydrophobicContact CE-SD 3.74Å; M154-M458 HydrophobicContact SD-CB 3.99Å; M154-M458 HydrophobicContact SD-CG 4.22Å; M154-M458 HydrophobicContact SD-SD 4.28Å; M154-M461 HydrophobicContact SD-CE 4.44Å; M154-R462 HydrophobicContact SD-CG 4.36Å; M154-R462 PolarHBondContact SD-NE 3.03Å; M154-R462 VanDerWaalsContact SD-NE 3.42Å
155	V	63.4	Low	61.5	Low	63 Å²	63	98 Å²	98	38%	0.382	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-59.6	142.7	158.7	-168.5	0	0	0	0	107.8	A182	V155-A182 HydrophobicContact CG1-CB 4.34Å; V155-A182 HydrophobicContact CG2-CB 4.33Å
156	P	64	Low	63.7	Low	103 Å²	103	94.9 Å²	94.9	67%	0.669	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-53.5	150.5	166	-24.2	34.8	0	0	0	111.1
157	E	67.6	Low	66.2	Low	30 Å²	30	84.7 Å²	84.7	14%	0.14	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-64.1	130.2	167	-71	172.1	159.9	0	0	107.8	R462 R463	E157-R462 WeakPolarHBondContact OE1-CD 3.33Å; E157-R462 IonicContact OE1-CZ 2.97Å; E157-R462 IonicContact OE1-NE 2.67Å; E157-R462 IonicContact OE1-NH1 3.81Å; E157-R462 PolarHBondContact OE1-NH1 3.13Å; E157-R463 PolarHBondContact OE2-N 3.36Å; E157-R463 VanDerWaalsContact OE2-N 3.14Å
158	P	66.3	Low	68.6	Low	70 Å²	70	80.6 Å²	80.6	46%	0.455	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-62.9	143.5	171.6	25.2	-31.7	0	0	0	109.5	W161	P158-W161 HydrophobicContact CG-CB 4.04Å; P158-W161 HydrophobicContact CG-CG 4.3Å
159	D	69	Low	71.2	Confident	149 Å²	149	75.3 Å²	75.3	80%	0.797	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	140.8	175.4	-59.1	-55.4	0	0	0	110	W161	D159-W161 PolarHBondContact O-N 3.17Å
160	N	76.7	Confident	73.6	Confident	101 Å²	101	68 Å²	68	54%	0.54	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	29.8	175.9	-67.6	38.5	0	0	0	116.9	E162 E163	N160-E162 VanDerWaalsContact C-OE2 3.26Å; N160-E162 VanDerWaalsContact CA-OE2 3.31Å; N160-E162 WeakPolarHBondContact CA-OE2 3.4Å; N160-E162 PolarHBondContact O-N 3.5Å; N160-E163 PolarHBondContact ND2-OE2 3.3Å; N160-E163 PolarHBondContact O-N 2.73Å
161	W	83.6	Confident	75.7	Confident	15 Å²	15	63 Å²	63	6%	0.057	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-65.8	-22.1	174.4	70	-97.5	0	0	0	113.6	P158 D159 E163 S164 F168 D170 N205 H374 P378	P158-W161 HydrophobicContact CG-CB 4.04Å; P158-W161 HydrophobicContact CG-CG 4.3Å; D159-W161 PolarHBondContact O-N 3.17Å; W161-E163 PolarHBondContact O-N 3.49Å; W161-S164 WeakPolarHBondContact O-CB 3.34Å; W161-S164 PolarHBondContact O-N 3.33Å; W161-F168 HydrophobicContact CB-CZ 4.22Å; W161-F168 HydrophobicContact CD2-CE2 4.28Å; W161-F168 HydrophobicContact CD2-CZ 4.26Å; W161-F168 AromaticContact CE3-CE2 3.79Å; W161-F168 HydrophobicContact CE3-CE2 3.79Å; W161-F168 AromaticContact CE3-CZ 3.63Å; W161-F168 HydrophobicContact CE3-CZ 3.63Å; W161-F168 HydrophobicContact CZ3-CE2 4.28Å; W161-F168 HydrophobicContact CZ3-CZ 4.36Å; W161-D170 VanDerWaalsContact CH2-OD1 3.23Å; W161-D170 WeakPolarHBondContact CH2-OD1 3.31Å; W161-N205 HydrophobicContact CZ3-CB 4.17Å; W161-H374 AromaticContact CZ3-CE1 3.9Å; W161-H374 AromaticContact CZ3-NE2 3.96Å; W161-P378 HydrophobicContact CZ2-CG 4.04Å
162	E	82	Confident	77.9	Confident	44 Å²	44	54 Å²	54	21%	0.206	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-63	-18.1	178.7	-52.3	96.1	129	0	0	113	N160 C377 P378 R463	N160-E162 VanDerWaalsContact C-OE2 3.26Å; N160-E162 VanDerWaalsContact CA-OE2 3.31Å; N160-E162 WeakPolarHBondContact CA-OE2 3.4Å; N160-E162 PolarHBondContact O-N 3.5Å; E162-C377 HydrophobicContact CB-CB 4.5Å; E162-C377 HydrophobicContact CG-CB 4.18Å; E162-P378 HydrophobicContact CG-CG 3.99Å; E162-R463 IonicContact OE1-CZ 2.78Å; E162-R463 IonicContact OE1-NH1 3.14Å; E162-R463 PolarHBondContact OE1-NH1 3.48Å; E162-R463 IonicContact OE1-NH2 3.14Å; E162-R463 PolarHBondContact OE1-NH2 2.91Å; E162-R463 IonicContact OE2-NH1 3.96Å
163	E	82	Confident	80	Confident	155 Å²	155	50.3 Å²	50.3	72%	0.724	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-90.7	-2.4	176.3	-59.9	178.2	154.7	0	0	112.3	N160 W161	N160-E163 PolarHBondContact ND2-OE2 3.3Å; N160-E163 PolarHBondContact O-N 2.73Å; W161-E163 PolarHBondContact O-N 3.49Å
164	S	86.1	Confident	81.9	Confident	36 Å²	36	43.6 Å²	43.6	25%	0.252	25%	0.249	S	C	.	.			trans	-75.9	133.1	-174.1	-171.8	0	0	0	0	113.4	W161 S166 Y206	W161-S164 WeakPolarHBondContact O-CB 3.34Å; W161-S164 PolarHBondContact O-N 3.33Å; S164-S166 VanDerWaalsContact C-N 3.28Å; S164-S166 PolarHBondContact O-N 2.78Å; S164-S166 PolarHBondContact OG-N 2.87Å; S164-S166 VanDerWaalsContact OG-N 3.15Å; S164-S166 PolarHBondContact OG-OG 2.96Å; S164-Y206 VanDerWaalsContact O-CE2 3.31Å; S164-Y206 WeakPolarHBondContact O-CE2 3.42Å; S164-Y206 PolarHBondContact O-OH 3.13Å
165	A	88.3	Confident	83.7	Confident	55 Å²	55	43.5 Å²	43.5	46%	0.455	25%	0.249	S	C	.	.			trans	-78.8	-4.9	170	0	0	0	0	0	114	L369 R372	A165-L369 HydrophobicContact CB-CD1 4.38Å; A165-L369 HydrophobicContact CB-CD2 4.25Å; A165-R372 PolarHBondContact O-NH1 3.23Å
166	S	91.1	Very high	85	Confident	39 Å²	39	40.8 Å²	40.8	27%	0.273	23%	0.232	S	C	.	.	S	Bend	trans	-86	149.3	-178.9	64.4	0	0	0	0	113.2	S164 F168 N205 Y206 N365	S164-S166 VanDerWaalsContact C-N 3.28Å; S164-S166 PolarHBondContact O-N 2.78Å; S164-S166 PolarHBondContact OG-N 2.87Å; S164-S166 VanDerWaalsContact OG-N 3.15Å; S164-S166 PolarHBondContact OG-OG 2.96Å; S166-F168 WeakPolarHBondContact O-CD1 3.49Å; S166-F168 WeakPolarHBondContact O-CE1 3.35Å; S166-F168 WeakPolarHBondContact OG-CD1 3.4Å; S166-N205 PolarHBondContact O-ND2 2.81Å; S166-N205 PolarHBondContact O-OD1 2.87Å; S166-Y206 WeakPolarHBondContact O-CE2 3.4Å; S166-N365 VanDerWaalsContact CA-OD1 3.27Å; S166-N365 WeakPolarHBondContact CA-OD1 3.46Å
167	V	94	Very high	86.4	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.201	C	C	.	.			trans	-95.6	121.8	176.2	-171.4	0	0	0	0	110.6	F185 A204 N205 Y206 F340 M364 N365 R372	V167-F185 WeakPolarHBondContact O-CE1 3.47Å; V167-A204 HydrophobicContact CG1-CB 3.9Å; V167-N205 WeakPolarHBondContact CA-OD1 3.33Å; V167-Y206 HydrophobicContact CG2-CD2 3.95Å; V167-Y206 HydrophobicContact CG2-CG 4.28Å; V167-F340 HydrophobicContact CB-CB 4.1Å; V167-F340 HydrophobicContact CB-CG 4.31Å; V167-F340 HydrophobicContact CG1-CB 4.19Å; V167-F340 HydrophobicContact CG1-CD1 3.95Å; V167-F340 HydrophobicContact CG1-CD2 4.35Å; V167-F340 HydrophobicContact CG1-CE1 4.45Å; V167-F340 HydrophobicContact CG1-CG 3.91Å; V167-F340 WeakPolarHBondContact O-CD2 3.23Å; V167-M364 HydrophobicContact CB-CB 4.48Å; V167-M364 HydrophobicContact CG1-CB 4.18Å; V167-M364 HydrophobicContact CG2-CB 4.35Å; V167-N365 HydrophobicContact CB-CB 4.29Å; V167-N365 HydrophobicContact CG2-CB 4.31Å; V167-N365 PolarHBondContact N-OD1 3.31Å; V167-R372 VanDerWaalsContact CG2-NH1 3.34Å
168	F	94.3	Very high	87.7	Confident	16 Å²	16	34.8 Å²	34.8	7%	0.07	20%	0.196	C	C	.	.			trans	-148.2	173.3	-179.9	51.9	-91.7	0	0	0	111.7	W161 S166 D170 F185 A204 N205	W161-F168 HydrophobicContact CB-CZ 4.22Å; W161-F168 HydrophobicContact CD2-CE2 4.28Å; W161-F168 HydrophobicContact CD2-CZ 4.26Å; W161-F168 AromaticContact CE3-CE2 3.79Å; W161-F168 HydrophobicContact CE3-CE2 3.79Å; W161-F168 AromaticContact CE3-CZ 3.63Å; W161-F168 HydrophobicContact CE3-CZ 3.63Å; W161-F168 HydrophobicContact CZ3-CE2 4.28Å; W161-F168 HydrophobicContact CZ3-CZ 4.36Å; S166-F168 WeakPolarHBondContact O-CD1 3.49Å; S166-F168 WeakPolarHBondContact O-CE1 3.35Å; S166-F168 WeakPolarHBondContact OG-CD1 3.4Å; F168-D170 PolarHBondContact O-N 3.36Å; F168-F185 HydrophobicContact CB-CD1 4.15Å; F168-F185 HydrophobicContact CB-CE1 3.6Å; F168-F185 HydrophobicContact CB-CZ 4.24Å; F168-A204 WeakPolarHBondContact O-CA 3.44Å; F168-A204 WeakPolarHBondContact O-CB 3.36Å; F168-N205 WeakPolarHBondContact CE1-ND2 3.47Å; F168-N205 PolarHBondContact N-OD1 2.91Å; F168-N205 PolarHBondContact O-N 2.83Å; F168-N205 VanDerWaalsContact O-N 3.08Å; F168-N205 PolarHBondContact O-OD1 2.79Å
169	L	95	Very high	88.9	Confident	2 Å²	2	33 Å²	33	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	119.5	177	-62.9	173.6	0	0	0	110.4	T171 T180 S184 A187 V202 F336 F340	L169-T171 PolarHBondContact O-N 2.89Å; L169-T180 HydrophobicContact CB-CG2 4.29Å; L169-S184 VanDerWaalsContact CB-O 3.25Å; L169-S184 WeakPolarHBondContact CB-O 3.19Å; L169-S184 WeakPolarHBondContact CG-O 3.46Å; L169-S184 PolarHBondContact N-O 2.71Å; L169-A187 HydrophobicContact CD1-CB 3.92Å; L169-V202 HydrophobicContact CB-CG2 4.01Å; L169-V202 HydrophobicContact CD2-CG1 4.12Å; L169-V202 HydrophobicContact CD2-CG2 4.07Å; L169-F336 HydrophobicContact CD1-CE2 3.85Å; L169-F336 HydrophobicContact CD1-CZ 4.31Å; L169-F336 HydrophobicContact CD2-CE2 4.34Å; L169-F340 HydrophobicContact CD2-CE2 4.24Å; L169-F340 HydrophobicContact CD2-CZ 3.99Å; L169-F340 HydrophobicContact CG-CE2 4.3Å
170	D	92.8	Very high	90	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	123.6	-171.4	-170.6	-31.7	0	0	0	111.2	W161 F168 Y172 N173 C174 R203 N205	W161-D170 VanDerWaalsContact CH2-OD1 3.23Å; W161-D170 WeakPolarHBondContact CH2-OD1 3.31Å; F168-D170 PolarHBondContact O-N 3.36Å; D170-Y172 VanDerWaalsContact C-N 3.31Å; D170-Y172 VanDerWaalsContact OD1-CA 3.3Å; D170-Y172 WeakPolarHBondContact OD1-CA 3.27Å; D170-Y172 VanDerWaalsContact OD1-CB 3.31Å; D170-Y172 WeakPolarHBondContact OD1-CB 3.49Å; D170-Y172 PolarHBondContact OD1-N 3.14Å; D170-N173 HydrophobicContact CB-CB 3.91Å; D170-N173 VanDerWaalsContact CG-N 3.3Å; D170-N173 PolarHBondContact OD1-N 3.35Å; D170-N173 WeakPolarHBondContact OD2-CB 3.24Å; D170-N173 PolarHBondContact OD2-ND2 2.76Å; D170-C174 WeakPolarHBondContact O-CB 3.32Å; D170-C174 PolarHBondContact O-SG 2.69Å; D170-R203 VanDerWaalsContact CB-O 3.25Å; D170-R203 WeakPolarHBondContact CB-O 3.46Å; D170-R203 PolarHBondContact N-O 2.8Å; D170-N205 HydrophobicContact CB-CB 4.23Å
171	T	89.7	Confident	90.5	Very high	8 Å²	8	25.1 Å²	25.1	5%	0.049	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-5.5	-179.7	75.2	0	0	0	0	114	L169 T180 R462 R464	L169-T171 PolarHBondContact O-N 2.89Å; T171-T180 HydrophobicContact CG2-CG2 4.22Å; T171-R462 PolarHBondContact OG1-NH1 2.76Å; T171-R464 PolarHBondContact O-NH2 2.83Å
172	Y	90.9	Very high	90.5	Very high	3 Å²	3	27.9 Å²	27.9	1%	0.012	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-53.2	168.3	-179	-97.6	0	0	0	111.4	D170 C174 R376 P378 R463 R464	D170-Y172 VanDerWaalsContact C-N 3.31Å; D170-Y172 VanDerWaalsContact OD1-CA 3.3Å; D170-Y172 WeakPolarHBondContact OD1-CA 3.27Å; D170-Y172 VanDerWaalsContact OD1-CB 3.31Å; D170-Y172 WeakPolarHBondContact OD1-CB 3.49Å; D170-Y172 PolarHBondContact OD1-N 3.14Å; Y172-C174 PolarHBondContact O-N 2.88Å; Y172-R376 WeakPolarHBondContact CD1-O 3.44Å; Y172-R376 HydrophobicContact CE1-CB 4.28Å; Y172-R376 WeakPolarHBondContact CE1-O 3.33Å; Y172-P378 HydrophobicContact CD2-CB 3.62Å; Y172-P378 HydrophobicContact CD2-CG 4.38Å; Y172-P378 HydrophobicContact CE2-CB 3.97Å; Y172-P378 HydrophobicContact CG-CB 4.3Å; Y172-R463 WeakPolarHBondContact CD2-O 3.17Å; Y172-R463 WeakPolarHBondContact CE2-O 3.45Å; Y172-R464 HydrophobicContact CD2-CB 4.34Å; Y172-R464 HydrophobicContact CD2-CG 3.7Å; Y172-R464 HydrophobicContact CE2-CB 3.93Å; Y172-R464 HydrophobicContact CE2-CG 3.82Å; Y172-R464 PolarHBondContact O-NE 3.35Å; Y172-R464 PolarHBondContact O-NH1 2.66Å; Y172-R464 PolarHBondContact O-NH2 2.8Å
173	N	92.7	Very high	90.6	Very high	2 Å²	2	29 Å²	29	1%	0.011	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	51	175.9	-71.8	-85.4	0	0	0	113.3	D170 R203 F250 R376 Q413	D170-N173 HydrophobicContact CB-CB 3.91Å; D170-N173 VanDerWaalsContact CG-N 3.3Å; D170-N173 PolarHBondContact OD1-N 3.35Å; D170-N173 WeakPolarHBondContact OD2-CB 3.24Å; D170-N173 PolarHBondContact OD2-ND2 2.76Å; N173-R203 HydrophobicContact CB-CB 4.29Å; N173-R203 PolarHBondContact O-N 3.23Å; N173-R203 PolarHBondContact OD1-NH2 3.49Å; N173-F250 VanDerWaalsContact C-CE1 3.47Å; N173-F250 HydrophobicContact CB-CE1 4.17Å; N173-F250 WeakPolarHBondContact O-CE1 3.4Å; N173-R376 PolarHBondContact ND2-O 2.88Å; N173-Q413 PolarHBondContact OD1-NE2 3.13Å; N173-Q413 PolarHBondContact OD1-OE1 3.35Å
174	C	93.6	Very high	91	Very high	7 Å²	7	22.5 Å²	22.5	5%	0.047	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	159.8	174.6	62.3	0	0	0	0	114	D170 Y172 L178 G201 V202 R464	D170-C174 WeakPolarHBondContact O-CB 3.32Å; D170-C174 PolarHBondContact O-SG 2.69Å; Y172-C174 PolarHBondContact O-N 2.88Å; C174-L178 HydrophobicContact CB-CD2 4.45Å; C174-G201 CarbonylContact C-O 3.53Å; C174-G201 WeakPolarHBondContact CA-O 3.41Å; C174-V202 HydrophobicContact CB-CB 3.6Å; C174-V202 HydrophobicContact CB-CG2 3.67Å; C174-R464 VanDerWaalsContact O-CZ 3.26Å; C174-R464 PolarHBondContact O-NH1 2.82Å; C174-R464 PolarHBondContact O-NH2 3.26Å; C174-R464 PolarHBondContact SG-NH2 3.19Å
175	D	93.9	Very high	91.3	Very high	15 Å²	15	22.2 Å²	22.2	8%	0.08	14%	0.142	C	C	.	.			trans	-64.4	136.4	172.9	-100.1	-41.8	0	0	0	113	N177 L178 A200 G201 K425	D175-N177 PolarHBondContact O-N 2.92Å; D175-N177 VanDerWaalsContact O-N 3.09Å; D175-L178 WeakPolarHBondContact O-CB 3.2Å; D175-L178 PolarHBondContact O-N 3.46Å; D175-A200 HydrophobicContact CB-CB 4.07Å; D175-G201 PolarHBondContact N-O 2.85Å; D175-G201 PolarHBondContact OD2-N 2.77Å; D175-K425 IonicContact OD1-NZ 2.92Å; D175-K425 PolarHBondContact OD1-NZ 2.81Å; D175-K425 IonicContact OD2-NZ 3.52Å; D175-K425 PolarHBondContact OD2-NZ 2.86Å
176	L	92.4	Very high	91.6	Very high	6 Å²	6	23.5 Å²	23.5	3%	0.031	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.5	-179.7	-71.6	-176.6	0	0	0	114.7	M154 L178 L417 L455 M458 A459 Y466	M154-L176 WeakPolarHBondContact CE-O 3.18Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L417 HydrophobicContact CD1-CD1 4.15Å; L176-L417 HydrophobicContact CD1-CD2 4.01Å; L176-L455 HydrophobicContact CB-CD2 3.77Å; L176-M458 WeakPolarHBondContact O-CE 3.14Å; L176-A459 HydrophobicContact CD1-CB 3.93Å; L176-Y466 HydrophobicContact CD1-CE1 3.91Å; L176-Y466 HydrophobicContact CD2-CE1 4.45Å
177	N	93.1	Very high	91.9	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.016	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1.6	174.8	56.3	-61	0	0	0	113.8	D175 P189 L190 F195 M198 W199 L455	D175-N177 PolarHBondContact O-N 2.92Å; D175-N177 VanDerWaalsContact O-N 3.09Å; N177-P189 CarbonylContact O-C 3.57Å; N177-P189 WeakPolarHBondContact O-CA 3.33Å; N177-L190 HydrophobicContact CB-CD1 4.38Å; N177-L190 PolarHBondContact O-N 2.69Å; N177-F195 HydrophobicContact CB-CD1 3.73Å; N177-F195 HydrophobicContact CB-CE1 3.82Å; N177-M198 HydrophobicContact CB-SD 4.45Å; N177-W199 PolarHBondContact ND2-O 2.78Å; N177-L455 HydrophobicContact CB-CD2 4.19Å
178	L	94.1	Very high	91.9	Very high	5 Å²	5	25 Å²	25	3%	0.026	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	137.9	164.9	-162.1	72.8	0	0	0	110.4	C174 D175 L176 A187 A200 V202 V331 F336	C174-L178 HydrophobicContact CB-CD2 4.45Å; D175-L178 WeakPolarHBondContact O-CB 3.2Å; D175-L178 PolarHBondContact O-N 3.46Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L178-A187 HydrophobicContact CD1-CB 4.16Å; L178-A187 HydrophobicContact CD2-CB 3.9Å; L178-A187 HydrophobicContact CG-CB 4.02Å; L178-A200 HydrophobicContact CB-CB 4.09Å; L178-A200 HydrophobicContact CD1-CB 4.06Å; L178-V202 HydrophobicContact CD2-CB 3.56Å; L178-V202 HydrophobicContact CD2-CG1 3.45Å; L178-V202 VanDerWaalsContact CD2-CG1 3.45Å; L178-V202 HydrophobicContact CD2-CG2 4.3Å; L178-V331 HydrophobicContact CD1-CG1 3.81Å; L178-F336 HydrophobicContact CD1-CE1 4.27Å
179	M	91.5	Very high	91.9	Very high	32 Å²	32	24.4 Å²	24.4	16%	0.158	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	112.9	169.2	-69.9	-178.9	49.4	0	0	109.3	R153 A187 K188 L190	R153-M179 HydrophobicContact CB-CE 3.88Å; R153-M179 HydrophobicContact CB-SD 4.2Å; R153-M179 WeakPolarHBondContact O-CE 3.19Å; M179-A187 VanDerWaalsContact O-CA 3.29Å; M179-A187 WeakPolarHBondContact O-CA 3.37Å; M179-K188 HydrophobicContact CB-CG 4.42Å; M179-K188 PolarHBondContact N-O 3.45Å; M179-K188 PolarHBondContact O-N 2.82Å; M179-L190 HydrophobicContact CG-CD2 4.26Å; M179-L190 HydrophobicContact SD-CD2 3.61Å
180	T	91.2	Very high	91.8	Very high	20 Å²	20	25 Å²	25	12%	0.123	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	152	163.4	52.1	0	0	0	0	110.7	L169 T171 Q186 A187	L169-T180 HydrophobicContact CB-CG2 4.29Å; T171-T180 HydrophobicContact CG2-CG2 4.22Å; T180-Q186 CarbonylContact C-O 3.59Å; T180-Q186 WeakPolarHBondContact CA-O 3.47Å; T180-A187 HydrophobicContact CG2-CB 4.28Å
181	D	87.4	Confident	91.7	Very high	64 Å²	64	26.6 Å²	26.6	34%	0.342	15%	0.151	S	C	.	.			trans	-76.2	165.3	164	178.9	54.9	0	0	0	111.3	T183 S184 Q186	D181-T183 PolarHBondContact O-N 2.89Å; D181-T183 VanDerWaalsContact O-N 3.15Å; D181-T183 WeakPolarHBondContact OD2-CB 3.09Å; D181-T183 WeakPolarHBondContact OD2-CG2 3.38Å; D181-T183 PolarHBondContact OD2-N 2.98Å; D181-T183 VanDerWaalsContact OD2-N 3.12Å; D181-T183 PolarHBondContact OD2-OG1 2.9Å; D181-S184 PolarHBondContact O-N 2.76Å; D181-Q186 HydrophobicContact CB-CB 4.13Å; D181-Q186 PolarHBondContact N-O 2.83Å
182	A	84.4	Confident	91.5	Very high	73 Å²	73	31.2 Å²	31.2	60%	0.603	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.2	176.4	0	0	0	0	0	113.7	V155 S184	V155-A182 HydrophobicContact CG1-CB 4.34Å; V155-A182 HydrophobicContact CG2-CB 4.33Å; A182-S184 VanDerWaalsContact C-N 3.34Å
183	T	84.6	Confident	91.2	Very high	68 Å²	68	33.1 Å²	33.1	42%	0.417	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-15.2	173.1	54.6	0	0	0	0	114.5	D181 F185	D181-T183 PolarHBondContact O-N 2.89Å; D181-T183 VanDerWaalsContact O-N 3.15Å; D181-T183 WeakPolarHBondContact OD2-CB 3.09Å; D181-T183 WeakPolarHBondContact OD2-CG2 3.38Å; D181-T183 PolarHBondContact OD2-N 2.98Å; D181-T183 VanDerWaalsContact OD2-N 3.12Å; D181-T183 PolarHBondContact OD2-OG1 2.9Å; T183-F185 WeakPolarHBondContact O-CD2 3.46Å; T183-F185 VanDerWaalsContact O-CE2 3.24Å; T183-F185 WeakPolarHBondContact O-CE2 3.45Å; T183-F185 PolarHBondContact O-N 3.49Å
184	S	89.6	Confident	90.8	Very high	18 Å²	18	33.3 Å²	33.3	13%	0.126	20%	0.195	C	C	.	.	S	Bend	trans	56.3	13	-172.3	-55.5	0	0	0	0	115.7	L169 D181 A182	L169-S184 VanDerWaalsContact CB-O 3.25Å; L169-S184 WeakPolarHBondContact CB-O 3.19Å; L169-S184 WeakPolarHBondContact CG-O 3.46Å; L169-S184 PolarHBondContact N-O 2.71Å; D181-S184 PolarHBondContact O-N 2.76Å; A182-S184 VanDerWaalsContact C-N 3.34Å
185	F	93.5	Very high	90.7	Very high	31 Å²	31	33.4 Å²	33.4	14%	0.136	19%	0.194	C	C	.	.	S	Bend	trans	-107.2	-13.9	173.9	-56.9	-58.7	0	0	0	113.6	V167 F168 T183 A337 C338 F340 Q342	V167-F185 WeakPolarHBondContact O-CE1 3.47Å; F168-F185 HydrophobicContact CB-CD1 4.15Å; F168-F185 HydrophobicContact CB-CE1 3.6Å; F168-F185 HydrophobicContact CB-CZ 4.24Å; T183-F185 WeakPolarHBondContact O-CD2 3.46Å; T183-F185 VanDerWaalsContact O-CE2 3.24Å; T183-F185 WeakPolarHBondContact O-CE2 3.45Å; T183-F185 PolarHBondContact O-N 3.49Å; F185-A337 CarbonylContact O-C 3.53Å; F185-A337 WeakPolarHBondContact O-CA 3.31Å; F185-C338 PolarHBondContact O-N 3.43Å; F185-F340 HydrophobicContact CD1-CD2 4.14Å; F185-F340 HydrophobicContact CE1-CD2 4.38Å; F185-Q342 HydrophobicContact CD1-CB 4.19Å; F185-Q342 HydrophobicContact CD1-CG 3.98Å; F185-Q342 HydrophobicContact CD2-CB 4.34Å; F185-Q342 HydrophobicContact CD2-CG 3.84Å; F185-Q342 HydrophobicContact CE1-CB 3.51Å; F185-Q342 HydrophobicContact CE1-CG 3.81Å; F185-Q342 HydrophobicContact CE2-CB 3.69Å; F185-Q342 HydrophobicContact CE2-CG 3.68Å; F185-Q342 HydrophobicContact CG-CG 4.01Å; F185-Q342 HydrophobicContact CZ-CB 3.24Å; F185-Q342 HydrophobicContact CZ-CG 3.69Å
186	Q	94.6	Very high	90.4	Very high	82 Å²	82	32.7 Å²	32.7	38%	0.383	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.1	176.3	-51.9	-167.4	14.5	0	0	110.9	T180 D181 F336 A337	T180-Q186 CarbonylContact C-O 3.59Å; T180-Q186 WeakPolarHBondContact CA-O 3.47Å; D181-Q186 HydrophobicContact CB-CB 4.13Å; D181-Q186 PolarHBondContact N-O 2.83Å; Q186-F336 WeakPolarHBondContact CA-O 3.45Å; Q186-A337 HydrophobicContact CG-CB 3.83Å
187	A	95.7	Very high	90	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	154.5	178.6	0	0	0	0	0	113.5	L169 L178 M179 T180 E335 F336	L169-A187 HydrophobicContact CD1-CB 3.92Å; L178-A187 HydrophobicContact CD1-CB 4.16Å; L178-A187 HydrophobicContact CD2-CB 3.9Å; L178-A187 HydrophobicContact CG-CB 4.02Å; M179-A187 VanDerWaalsContact O-CA 3.29Å; M179-A187 WeakPolarHBondContact O-CA 3.37Å; T180-A187 HydrophobicContact CG2-CB 4.28Å; A187-E335 WeakPolarHBondContact O-CA 3.25Å; A187-F336 HydrophobicContact CB-CE1 3.9Å; A187-F336 HydrophobicContact CB-CE2 4.32Å; A187-F336 HydrophobicContact CB-CZ 3.77Å; A187-F336 PolarHBondContact N-O 3.38Å; A187-F336 WeakPolarHBondContact O-CD1 3.5Å; A187-F336 PolarHBondContact O-N 3.05Å
188	K	94.9	Very high	89.8	Confident	68 Å²	68	32.4 Å²	32.4	30%	0.296	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	138.7	177.2	40.7	170.1	162.3	-66.5	0	111.1	M179 L223 E335	M179-K188 HydrophobicContact CB-CG 4.42Å; M179-K188 PolarHBondContact N-O 3.45Å; M179-K188 PolarHBondContact O-N 2.82Å; K188-L223 HydrophobicContact CB-CD1 3.8Å; K188-E335 HydrophobicContact CB-CB 4.08Å; K188-E335 HydrophobicContact CB-CG 4.05Å; K188-E335 VanDerWaalsContact CD-OE1 3.26Å; K188-E335 WeakPolarHBondContact CD-OE1 3.34Å; K188-E335 WeakPolarHBondContact CE-OE1 3.21Å; K188-E335 IonicContact NZ-OE1 3Å; K188-E335 PolarHBondContact NZ-OE1 2.84Å
189	P	94.4	Very high	89.7	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.032	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	153.7	169.4	31	-33.1	0	0	0	110.8	N177 A200 L223 V331 V334	N177-P189 CarbonylContact O-C 3.57Å; N177-P189 WeakPolarHBondContact O-CA 3.33Å; P189-A200 HydrophobicContact CB-CB 4.21Å; P189-L223 HydrophobicContact CG-CD1 4.16Å; P189-V331 HydrophobicContact CB-CG1 4.48Å; P189-V331 HydrophobicContact CG-CG1 4.16Å; P189-V334 WeakPolarHBondContact CD-O 3.27Å
190	L	92.7	Very high	89.8	Confident	15 Å²	15	31.2 Å²	31.2	8%	0.079	18%	0.183	C	C	.	.			trans	-61.3	136.8	163	-68	174.4	0	0	0	109.8	N177 M179 F195 M458	N177-L190 HydrophobicContact CB-CD1 4.38Å; N177-L190 PolarHBondContact O-N 2.69Å; M179-L190 HydrophobicContact CG-CD2 4.26Å; M179-L190 HydrophobicContact SD-CD2 3.61Å; L190-F195 HydrophobicContact CB-CB 3.72Å; L190-F195 HydrophobicContact CB-CD1 4.21Å; L190-F195 HydrophobicContact CB-CD2 4.1Å; L190-F195 HydrophobicContact CB-CG 3.77Å; L190-F195 HydrophobicContact CD1-CD1 4.28Å; L190-F195 HydrophobicContact CD1-CD2 4.13Å; L190-F195 HydrophobicContact CD1-CE1 4.18Å; L190-F195 HydrophobicContact CD1-CE2 4.02Å; L190-F195 HydrophobicContact CD1-CG 4.26Å; L190-F195 HydrophobicContact CD1-CZ 4.04Å; L190-F195 CarbonylContact O-C 3.53Å; L190-F195 WeakPolarHBondContact O-CB 3.16Å; L190-M458 HydrophobicContact CD1-CE 3.77Å; L190-M458 HydrophobicContact CD1-SD 4.17Å
191	T	90.4	Very high	90	Very high	32 Å²	32	30.3 Å²	30.3	20%	0.196	18%	0.177	C	C	.	.			trans	-113.8	-3.2	175.6	63	0	0	0	0	113.8	G193 S196 L223 P224 N333	T191-G193 PolarHBondContact O-N 2.86Å; T191-S196 VanDerWaalsContact O-CB 3.27Å; T191-S196 WeakPolarHBondContact O-CB 3.32Å; T191-S196 PolarHBondContact O-N 2.8Å; T191-S196 PolarHBondContact O-OG 3.26Å; T191-L223 HydrophobicContact CG2-CB 3.73Å; T191-L223 HydrophobicContact CG2-CD1 3.96Å; T191-P224 PolarHBondContact OG1-O 2.81Å; T191-N333 HydrophobicContact CG2-CB 4.48Å; T191-N333 WeakPolarHBondContact CG2-OD1 3.19Å
192	E	86	Confident	90.4	Very high	106 Å²	106	27.3 Å²	27.3	50%	0.495	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	123.2	-171.5	-68.5	-177.5	159.6	0	0	113.5	R153 G194 F195	R153-E192 IonicContact CZ-OE1 2.71Å; R153-E192 VanDerWaalsContact CZ-OE1 3.28Å; R153-E192 IonicContact CZ-OE2 2.69Å; R153-E192 IonicContact NH1-OE1 2.78Å; R153-E192 PolarHBondContact NH1-OE1 3.29Å; R153-E192 IonicContact NH1-OE2 3.57Å; R153-E192 PolarHBondContact NH1-OE2 3.42Å; R153-E192 IonicContact NH2-OE1 2.83Å; R153-E192 PolarHBondContact NH2-OE1 2.89Å; R153-E192 IonicContact NH2-OE2 3.97Å; E192-G194 PolarHBondContact O-N 2.88Å; E192-F195 WeakPolarHBondContact O-CD2 3.15Å; E192-F195 PolarHBondContact O-N 3.37Å; E192-F195 VanDerWaalsContact O-N 3.09Å
193	G	84.4	Confident	91	Very high	43 Å²	43	24 Å²	24	44%	0.443	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	-79.5	165.9	0	0	0	0	0	115.4	T191 K447	T191-G193 PolarHBondContact O-N 2.86Å; G193-K447 VanDerWaalsContact O-CE 3.25Å; G193-K447 WeakPolarHBondContact O-CE 3.14Å; G193-K447 PolarHBondContact O-NZ 2.95Å
194	G	85.1	Confident	91.5	Very high	5 Å²	5	20.8 Å²	20.8	5%	0.052	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-28.4	174.8	0	0	0	0	0	113.3	E192 S196 L197 M426 C451	E192-G194 PolarHBondContact O-N 2.88Å; G194-S196 PolarHBondContact O-N 3.5Å; G194-L197 PolarHBondContact O-N 3.43Å; G194-M426 WeakPolarHBondContact O-CE 3.29Å; G194-C451 VanDerWaalsContact C-SG 3.51Å; G194-C451 VanDerWaalsContact CA-SG 3.59Å
195	F	90.3	Very high	91.8	Very high	9 Å²	9	20 Å²	20	4%	0.039	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-64.7	-25.7	-172.5	-71.9	-75.1	0	0	0	113.2	N177 L190 E192 L197 M198 C451 T454 L455	N177-F195 HydrophobicContact CB-CD1 3.73Å; N177-F195 HydrophobicContact CB-CE1 3.82Å; L190-F195 HydrophobicContact CB-CB 3.72Å; L190-F195 HydrophobicContact CB-CD1 4.21Å; L190-F195 HydrophobicContact CB-CD2 4.1Å; L190-F195 HydrophobicContact CB-CG 3.77Å; L190-F195 HydrophobicContact CD1-CD1 4.28Å; L190-F195 HydrophobicContact CD1-CD2 4.13Å; L190-F195 HydrophobicContact CD1-CE1 4.18Å; L190-F195 HydrophobicContact CD1-CE2 4.02Å; L190-F195 HydrophobicContact CD1-CG 4.26Å; L190-F195 HydrophobicContact CD1-CZ 4.04Å; L190-F195 CarbonylContact O-C 3.53Å; L190-F195 WeakPolarHBondContact O-CB 3.16Å; E192-F195 WeakPolarHBondContact O-CD2 3.15Å; E192-F195 PolarHBondContact O-N 3.37Å; E192-F195 VanDerWaalsContact O-N 3.09Å; F195-L197 PolarHBondContact O-N 3.36Å; F195-M198 HydrophobicContact CD1-CE 3.55Å; F195-M198 HydrophobicContact CD1-SD 4.17Å; F195-M198 HydrophobicContact CE1-CE 3.86Å; F195-M198 HydrophobicContact CE1-SD 4.47Å; F195-M198 HydrophobicContact CG-CE 4.47Å; F195-M198 WeakPolarHBondContact O-CA 3.45Å; F195-M198 WeakPolarHBondContact O-CB 3.17Å; F195-M198 PolarHBondContact O-N 3.04Å; F195-C451 HydrophobicContact CD1-CB 4.32Å; F195-C451 HydrophobicContact CE1-CB 3.85Å; F195-C451 HydrophobicContact CE2-CB 4.09Å; F195-C451 HydrophobicContact CZ-CB 3.73Å; F195-C451 WeakPolarHBondContact CZ-O 3.49Å; F195-C451 PolarHBondContact N-SG 2.87Å; F195-C451 VanDerWaalsContact N-SG 3.42Å; F195-T454 HydrophobicContact CE2-CG2 3.84Å; F195-T454 HydrophobicContact CZ-CG2 3.98Å; F195-L455 HydrophobicContact CE1-CD1 4.44Å; F195-L455 HydrophobicContact CE1-CD2 3.85Å; F195-L455 HydrophobicContact CE1-CG 3.93Å; F195-L455 HydrophobicContact CZ-CD2 4.21Å; F195-L455 HydrophobicContact CZ-CG 4.08Å
196	S	87.8	Confident	91.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-62.8	-21.1	173.5	53	0	0	0	0	115.3	T191 G194 M198 Y228 K332 N333	T191-S196 VanDerWaalsContact O-CB 3.27Å; T191-S196 WeakPolarHBondContact O-CB 3.32Å; T191-S196 PolarHBondContact O-N 2.8Å; T191-S196 PolarHBondContact O-OG 3.26Å; G194-S196 PolarHBondContact O-N 3.5Å; S196-M198 VanDerWaalsContact C-N 3.28Å; S196-Y228 WeakPolarHBondContact O-CE2 3.46Å; S196-K332 WeakPolarHBondContact O-CE 3.45Å; S196-N333 VanDerWaalsContact CA-OD1 3.25Å; S196-N333 WeakPolarHBondContact CA-OD1 3.47Å; S196-N333 PolarHBondContact O-ND2 3.41Å; S196-N333 PolarHBondContact O-OD1 3.04Å
197	L	84.8	Confident	91.9	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-79.3	-17.3	172.6	-59.1	-175.8	0	0	0	111.8	G194 F195 Y228 L231 V232 K332 M426 L444 K447	G194-L197 PolarHBondContact O-N 3.43Å; F195-L197 PolarHBondContact O-N 3.36Å; L197-Y228 HydrophobicContact CD2-CD2 3.75Å; L197-Y228 HydrophobicContact CD2-CE2 3.8Å; L197-L231 HydrophobicContact CD1-CD1 4.44Å; L197-V232 HydrophobicContact CD1-CG2 3.97Å; L197-V232 HydrophobicContact CD2-CB 4.41Å; L197-V232 HydrophobicContact CD2-CG2 3.7Å; L197-V232 HydrophobicContact CG-CG2 4.37Å; L197-K332 VanDerWaalsContact C-CE 3.44Å; L197-K332 WeakPolarHBondContact O-CE 3.47Å; L197-K332 PolarHBondContact O-NZ 3.2Å; L197-M426 HydrophobicContact CB-CB 4.01Å; L197-M426 HydrophobicContact CB-CG 3.79Å; L197-M426 HydrophobicContact CB-SD 4.26Å; L197-M426 HydrophobicContact CD1-SD 4.38Å; L197-M426 WeakPolarHBondContact O-CA 3.45Å; L197-L444 HydrophobicContact CD1-CD2 3.75Å; L197-K447 HydrophobicContact CD1-CD 4.25Å
198	M	88.4	Confident	91.8	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.015	9%	0.087	C	C	.	.			trans	-93.3	147.3	-169.7	-151.5	-178.7	-52.9	0	0	112.3	N177 F195 S196 I422 K425 M426 C451	N177-M198 HydrophobicContact CB-SD 4.45Å; F195-M198 HydrophobicContact CD1-CE 3.55Å; F195-M198 HydrophobicContact CD1-SD 4.17Å; F195-M198 HydrophobicContact CE1-CE 3.86Å; F195-M198 HydrophobicContact CE1-SD 4.47Å; F195-M198 HydrophobicContact CG-CE 4.47Å; F195-M198 WeakPolarHBondContact O-CA 3.45Å; F195-M198 WeakPolarHBondContact O-CB 3.17Å; F195-M198 PolarHBondContact O-N 3.04Å; S196-M198 VanDerWaalsContact C-N 3.28Å; M198-I422 HydrophobicContact CE-CG2 3.77Å; M198-K425 WeakPolarHBondContact CA-O 3.42Å; M198-K425 HydrophobicContact CG-CB 3.6Å; M198-K425 HydrophobicContact SD-CB 4.42Å; M198-M426 HydrophobicContact CB-CG 4.42Å; M198-M426 HydrophobicContact CE-CE 3.8Å; M198-C451 HydrophobicContact CE-CB 3.97Å
199	W	91.6	Very high	91.7	Very high	12 Å²	12	15.1 Å²	15.1	5%	0.045	9%	0.086	C	C	.	.			trans	-88.3	165.3	164.7	-64.3	79.8	0	0	0	111.4	N177 V238 Y330 V331 K332 K425 M429	N177-W199 PolarHBondContact ND2-O 2.78Å; W199-V238 HydrophobicContact CH2-CB 3.58Å; W199-V238 HydrophobicContact CH2-CG1 3.65Å; W199-V238 HydrophobicContact CH2-CG2 4.17Å; W199-V238 HydrophobicContact CZ2-CB 4.43Å; W199-V238 HydrophobicContact CZ3-CB 4Å; W199-V238 HydrophobicContact CZ3-CG1 4.13Å; W199-Y330 HydrophobicContact CB-CD2 4.22Å; W199-Y330 HydrophobicContact CB-CE1 4.21Å; W199-Y330 HydrophobicContact CB-CE2 3.41Å; W199-Y330 VanDerWaalsContact CB-CE2 3.41Å; W199-Y330 VanDerWaalsContact CB-CZ 3.43Å; W199-Y330 WeakPolarHBondContact CB-OH 3.36Å; W199-Y330 HydrophobicContact CD2-CD1 4.32Å; W199-Y330 AromaticContact CD2-CE1 3.82Å; W199-Y330 HydrophobicContact CD2-CE1 3.82Å; W199-Y330 AromaticContact CD2-CZ 3.96Å; W199-Y330 AromaticContact CE3-CD1 3.66Å; W199-Y330 HydrophobicContact CE3-CD1 3.66Å; W199-Y330 HydrophobicContact CE3-CD2 4.48Å; W199-Y330 AromaticContact CE3-CE1 3.64Å; W199-Y330 HydrophobicContact CE3-CE1 3.64Å; W199-Y330 HydrophobicContact CE3-CE2 4.45Å; W199-Y330 HydrophobicContact CE3-CG 4.12Å; W199-Y330 HydrophobicContact CG-CE1 4.11Å; W199-Y330 HydrophobicContact CG-CE2 4.19Å; W199-Y330 AromaticContact CG-CZ 3.73Å; W199-Y330 HydrophobicContact CZ3-CD1 4.02Å; W199-Y330 HydrophobicContact CZ3-CE1 4.23Å; W199-V331 CarbonylContact C-O 3.57Å; W199-V331 WeakPolarHBondContact CA-O 3.43Å; W199-K332 HydrophobicContact CD2-CB 3.83Å; W199-K332 HydrophobicContact CD2-CD 4.23Å; W199-K332 HydrophobicContact CE3-CB 3.8Å; W199-K332 HydrophobicContact CG-CB 4.33Å; W199-K332 HydrophobicContact CG-CD 4.42Å; W199-K332 HydrophobicContact CZ2-CD 4.34Å; W199-K332 HydrophobicContact CZ3-CB 4.15Å; W199-K425 PolarHBondContact N-O 2.67Å; W199-M429 HydrophobicContact CD2-SD 4.16Å; W199-M429 HydrophobicContact CH2-SD 4.36Å; W199-M429 HydrophobicContact CZ2-CG 3.77Å; W199-M429 HydrophobicContact CZ2-SD 3.61Å
200	A	94.1	Very high	91.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	133.6	170.9	0	0	0	0	0	110.7	D175 L178 P189 V331	D175-A200 HydrophobicContact CB-CB 4.07Å; L178-A200 HydrophobicContact CB-CB 4.09Å; L178-A200 HydrophobicContact CD1-CB 4.06Å; P189-A200 HydrophobicContact CB-CB 4.21Å; A200-V331 HydrophobicContact CB-CG1 4.42Å; A200-V331 PolarHBondContact N-O 3.44Å; A200-V331 WeakPolarHBondContact O-CG1 3.43Å; A200-V331 PolarHBondContact O-N 2.83Å
201	G	95.3	Very high	91.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	158.9	173.7	0	0	0	0	0	114.7	C174 D175 F250 V329	C174-G201 CarbonylContact C-O 3.53Å; C174-G201 WeakPolarHBondContact CA-O 3.41Å; D175-G201 PolarHBondContact N-O 2.85Å; D175-G201 PolarHBondContact OD2-N 2.77Å; G201-F250 WeakPolarHBondContact CA-O 3.21Å; G201-V329 CarbonylContact C-O 3.51Å; G201-V329 WeakPolarHBondContact CA-O 3.26Å
202	V	96.6	Very high	91.2	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	141.3	172	52.5	0	0	0	0	110.8	L169 C174 L178 H328 V329 F336	L169-V202 HydrophobicContact CB-CG2 4.01Å; L169-V202 HydrophobicContact CD2-CG1 4.12Å; L169-V202 HydrophobicContact CD2-CG2 4.07Å; C174-V202 HydrophobicContact CB-CB 3.6Å; C174-V202 HydrophobicContact CB-CG2 3.67Å; L178-V202 HydrophobicContact CD2-CB 3.56Å; L178-V202 HydrophobicContact CD2-CG1 3.45Å; L178-V202 VanDerWaalsContact CD2-CG1 3.45Å; L178-V202 HydrophobicContact CD2-CG2 4.3Å; V202-H328 WeakPolarHBondContact O-CA 3.49Å; V202-H328 PolarHBondContact O-CD2 3.2Å; V202-H328 VanDerWaalsContact O-CD2 3.27Å; V202-V329 HydrophobicContact CG1-CB 4.29Å; V202-V329 PolarHBondContact N-O 2.92Å; V202-V329 PolarHBondContact O-N 3.21Å; V202-F336 HydrophobicContact CG1-CZ 3.77Å
203	R	96.5	Very high	91.6	Very high	4 Å²	4	13.2 Å²	13.2	2%	0.015	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	158.6	165.4	-65.4	-172.1	-69.7	-131.1	0.6	111.2	D170 N173 T245 E246 T248 F326 P327 H328	D170-R203 VanDerWaalsContact CB-O 3.25Å; D170-R203 WeakPolarHBondContact CB-O 3.46Å; D170-R203 PolarHBondContact N-O 2.8Å; N173-R203 HydrophobicContact CB-CB 4.29Å; N173-R203 PolarHBondContact O-N 3.23Å; N173-R203 PolarHBondContact OD1-NH2 3.49Å; R203-T245 PolarHBondContact NH1-O 3.01Å; R203-E246 VanDerWaalsContact NH1-C 3.28Å; R203-E246 PolarHBondContact NH1-O 3.04Å; R203-E246 PolarHBondContact NH2-O 3.33Å; R203-T248 PolarHBondContact NH1-O 2.84Å; R203-F326 HydrophobicContact CB-CB 4.36Å; R203-F326 HydrophobicContact CG-CB 4.42Å; R203-P327 CarbonylContact C-O 3.54Å; R203-P327 WeakPolarHBondContact CA-O 3.35Å; R203-H328 HydrophobicContact CG-CB 4.28Å
204	A	96.1	Very high	92.1	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.008	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	157.5	161.4	0	0	0	0	0	110.7	V167 F168 Y206 P327 F340	V167-A204 HydrophobicContact CG1-CB 3.9Å; F168-A204 WeakPolarHBondContact O-CA 3.44Å; F168-A204 WeakPolarHBondContact O-CB 3.36Å; A204-Y206 PolarHBondContact O-N 2.78Å; A204-P327 HydrophobicContact CB-CB 3.85Å; A204-P327 HydrophobicContact CB-CG 3.94Å; A204-P327 PolarHBondContact N-O 2.9Å; A204-F340 HydrophobicContact CB-CE1 4.08Å; A204-F340 HydrophobicContact CB-CZ 3.96Å
205	N	94.7	Very high	92.7	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.065	C	C	.	.	S	Bend	trans	-67.7	-21.7	179.4	64.7	-36.1	0	0	0	113.7	W161 S166 V167 F168 D170 H374 G375	W161-N205 HydrophobicContact CZ3-CB 4.17Å; S166-N205 PolarHBondContact O-ND2 2.81Å; S166-N205 PolarHBondContact O-OD1 2.87Å; V167-N205 WeakPolarHBondContact CA-OD1 3.33Å; F168-N205 WeakPolarHBondContact CE1-ND2 3.47Å; F168-N205 PolarHBondContact N-OD1 2.91Å; F168-N205 PolarHBondContact O-N 2.83Å; F168-N205 VanDerWaalsContact O-N 3.08Å; F168-N205 PolarHBondContact O-OD1 2.79Å; D170-N205 HydrophobicContact CB-CB 4.23Å; N205-H374 CarbonylContact O-C 3.19Å; N205-H374 WeakPolarHBondContact O-CA 3.37Å; N205-G375 PolarHBondContact O-N 2.82Å
206	Y	95.1	Very high	93	Very high	26 Å²	26	10.9 Å²	10.9	10%	0.102	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.7	175	-74	-84.9	0	0	0	112.8	S164 S166 V167 A204 P327 L369 R372 V373 H374	S164-Y206 VanDerWaalsContact O-CE2 3.31Å; S164-Y206 WeakPolarHBondContact O-CE2 3.42Å; S164-Y206 PolarHBondContact O-OH 3.13Å; S166-Y206 WeakPolarHBondContact O-CE2 3.4Å; V167-Y206 HydrophobicContact CG2-CD2 3.95Å; V167-Y206 HydrophobicContact CG2-CG 4.28Å; A204-Y206 PolarHBondContact O-N 2.78Å; Y206-P327 VanDerWaalsContact O-CD 3.27Å; Y206-P327 WeakPolarHBondContact O-CD 3.25Å; Y206-L369 HydrophobicContact CE1-CD2 4.48Å; Y206-R372 HydrophobicContact CD1-CB 3.7Å; Y206-R372 HydrophobicContact CE1-CB 4.4Å; Y206-R372 HydrophobicContact CG-CB 4.35Å; Y206-V373 CarbonylContact C-O 3.55Å; Y206-V373 WeakPolarHBondContact CA-O 3.28Å; Y206-H374 HydrophobicContact CD1-CB 4.08Å; Y206-H374 HydrophobicContact CE1-CB 3.79Å; Y206-H374 AromaticContact CE1-CD2 3.94Å; Y206-H374 AromaticContact CE2-CD2 3.76Å; Y206-H374 AromaticContact CZ-CD2 3.57Å
207	G	94.6	Very high	93.5	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	160.9	165.8	0	0	0	0	0	112.3	L325 R372 V373	G207-L325 CarbonylContact C-O 3.57Å; G207-L325 VanDerWaalsContact CA-O 3.28Å; G207-L325 WeakPolarHBondContact CA-O 3.34Å; G207-R372 CarbonylContact O-C 3.53Å; G207-R372 WeakPolarHBondContact O-CA 3.2Å; G207-V373 PolarHBondContact N-O 2.89Å; G207-V373 PolarHBondContact O-N 2.9Å
208	S	93.9	Very high	94.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	144.9	177.1	178.3	0	0	0	0	110.5	S213 W292 A324 L325	S208-S213 PolarHBondContact OG-OG 3.09Å; S208-W292 WeakPolarHBondContact O-CZ2 3.46Å; S208-W292 PolarHBondContact OG-NE1 3.33Å; S208-A324 WeakPolarHBondContact O-CA 3.31Å; S208-L325 PolarHBondContact N-O 3.4Å; S208-L325 PolarHBondContact O-N 2.89Å
209	I	92.1	Very high	94.5	Very high	55 Å²	55	15.5 Å²	15.5	28%	0.282	8%	0.082	S	C	.	.			trans	-124.4	-17.7	174.5	52.5	165	0	0	0	114.2	A324 C371 V373	I209-A324 HydrophobicContact CG2-CB 3.58Å; I209-C371 WeakPolarHBondContact CG1-O 3.44Å; I209-C371 PolarHBondContact N-O 3.18Å; I209-V373 HydrophobicContact CD1-CG2 4.13Å; I209-V373 HydrophobicContact CG1-CG2 4.38Å; I209-V373 HydrophobicContact CG2-CG2 3.65Å
210	S	89.3	Confident	94.8	Very high	42 Å²	42	17.3 Å²	17.3	29%	0.294	9%	0.094	S	C	.	.	S	Bend	trans	-159.1	154.6	-174.8	54.5	0	0	0	0	112.9	W292 C371	S210-W292 VanDerWaalsContact N-CD1 3.28Å; S210-C371 PolarHBondContact OG-SG 2.91Å; S210-C371 VanDerWaalsContact OG-SG 3.34Å
211	G	87.8	Confident	94.8	Very high	35 Å²	35	21.4 Å²	21.4	36%	0.361	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	88.3	-168.7	-178	0	0	0	0	0	113.4	W292	G211-W292 WeakPolarHBondContact O-CB 3.48Å; G211-W292 PolarHBondContact O-N 3.38Å
212	K	91.7	Very high	94.7	Very high	41 Å²	41	24 Å²	24	18%	0.178	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.3	173.5	-44.2	-162.4	-159.3	-161.5	0	109.4	I290 E291 S360 W361 Q362	K212-I290 WeakPolarHBondContact CA-O 3.18Å; K212-E291 HydrophobicContact CD-CB 4.42Å; K212-E291 HydrophobicContact CD-CG 4.11Å; K212-E291 WeakPolarHBondContact CD-OE1 3.42Å; K212-E291 WeakPolarHBondContact CE-OE1 3.49Å; K212-E291 HydrophobicContact CG-CB 4.36Å; K212-E291 HydrophobicContact CG-CG 4.18Å; K212-E291 IonicContact NZ-OE1 3.72Å; K212-E291 PolarHBondContact NZ-OE1 3.06Å; K212-S360 WeakPolarHBondContact CD-OG 3.35Å; K212-S360 WeakPolarHBondContact CE-OG 3.25Å; K212-W361 HydrophobicContact CB-CD2 4.09Å; K212-W361 HydrophobicContact CB-CE3 3.7Å; K212-W361 HydrophobicContact CB-CH2 4.29Å; K212-W361 HydrophobicContact CB-CZ3 3.82Å; K212-W361 HydrophobicContact CD-CH2 4.48Å; K212-W361 HydrophobicContact CD-CZ2 4.2Å; K212-Q362 PolarHBondContact O-N 2.8Å
213	S	93.7	Very high	94.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	155.5	-174.6	50.9	0	0	0	0	113.8	S208 I290 Q362	S208-S213 PolarHBondContact OG-OG 3.09Å; S213-I290 PolarHBondContact N-O 2.65Å; S213-I290 WeakPolarHBondContact O-CG2 2.9Å; S213-I290 PolarHBondContact O-N 2.82Å; S213-I290 WeakPolarHBondContact OG-CG2 3.49Å; S213-Q362 CarbonylContact C-O 3.57Å; S213-Q362 WeakPolarHBondContact CA-O 3.12Å
214	F	95.5	Very high	94.1	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	166.1	177.8	75.3	-79.4	0	0	0	113.6	E216 A288 F289 P347 P351 W361 Q362 Q363 M364	F214-E216 HydrophobicContact CD2-CG 4.44Å; F214-E216 HydrophobicContact CE2-CG 4.31Å; F214-A288 WeakPolarHBondContact CA-O 3.2Å; F214-A288 WeakPolarHBondContact CB-O 3.38Å; F214-F289 HydrophobicContact CB-CB 4.39Å; F214-F289 HydrophobicContact CB-CD1 3.27Å; F214-F289 HydrophobicContact CB-CE1 3.47Å; F214-F289 VanDerWaalsContact CB-CE1 3.47Å; F214-F289 HydrophobicContact CB-CG 3.83Å; F214-F289 HydrophobicContact CB-CZ 4.22Å; F214-F289 HydrophobicContact CD1-CD1 4.33Å; F214-F289 HydrophobicContact CD1-CE1 4.01Å; F214-F289 HydrophobicContact CD2-CD1 4.39Å; F214-F289 AromaticContact CD2-CE1 3.69Å; F214-F289 HydrophobicContact CD2-CE1 3.69Å; F214-F289 AromaticContact CD2-CZ 3.95Å; F214-F289 HydrophobicContact CD2-CZ 3.95Å; F214-F289 HydrophobicContact CE2-CE1 4.38Å; F214-F289 AromaticContact CG-CD1 3.8Å; F214-F289 HydrophobicContact CG-CD1 3.8Å; F214-F289 AromaticContact CG-CE1 3.47Å; F214-F289 HydrophobicContact CG-CE1 3.47Å; F214-F289 VanDerWaalsContact CG-CE1 3.47Å; F214-F289 HydrophobicContact CG-CZ 4.19Å; F214-P347 HydrophobicContact CE2-CB 3.91Å; F214-P347 HydrophobicContact CZ-CB 3.93Å; F214-P347 HydrophobicContact CZ-CG 4.24Å; F214-P351 HydrophobicContact CE1-CG 4.41Å; F214-P351 HydrophobicContact CZ-CG 4.43Å; F214-W361 HydrophobicContact CD1-CB 4.14Å; F214-W361 HydrophobicContact CE1-CB 4.14Å; F214-Q362 WeakPolarHBondContact CD1-O 3.44Å; F214-Q362 PolarHBondContact N-O 3.26Å; F214-Q363 HydrophobicContact CE1-CG 3.9Å; F214-Q363 HydrophobicContact CE2-CG 3.99Å; F214-Q363 HydrophobicContact CZ-CG 3.57Å; F214-Q363 CarbonylContact O-C 3.55Å; F214-Q363 WeakPolarHBondContact O-CA 3.38Å; F214-M364 PolarHBondContact O-N 3.49Å
215	F	96.9	Very high	93.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	159.1	166.7	69.6	-77.9	0	0	0	109.2	V217 V241 G242 W243 A288 P327 V329 N339 F340 M364	F215-V217 HydrophobicContact CD2-CG2 3.85Å; F215-V217 HydrophobicContact CE2-CG2 3.54Å; F215-V241 HydrophobicContact CE2-CG1 3.66Å; F215-V241 HydrophobicContact CZ-CG1 3.65Å; F215-G242 WeakPolarHBondContact CZ-O 3.46Å; F215-W243 AromaticContact CD1-CH2 3.7Å; F215-W243 HydrophobicContact CD1-CH2 3.7Å; F215-W243 AromaticContact CD1-CZ2 3.69Å; F215-W243 HydrophobicContact CD1-CZ2 3.69Å; F215-W243 HydrophobicContact CD1-CZ3 4.38Å; F215-W243 HydrophobicContact CE1-CD2 4.22Å; F215-W243 AromaticContact CE1-CE2 3.82Å; F215-W243 HydrophobicContact CE1-CE3 4.41Å; F215-W243 AromaticContact CE1-CH2 3.84Å; F215-W243 HydrophobicContact CE1-CH2 3.84Å; F215-W243 AromaticContact CE1-CZ2 3.62Å; F215-W243 HydrophobicContact CE1-CZ2 3.62Å; F215-W243 HydrophobicContact CE1-CZ3 4.25Å; F215-A288 HydrophobicContact CD1-CB 4.07Å; F215-A288 HydrophobicContact CE1-CB 3.56Å; F215-A288 HydrophobicContact CE2-CB 4.39Å; F215-A288 HydrophobicContact CZ-CB 3.74Å; F215-A288 PolarHBondContact N-O 3.21Å; F215-A288 PolarHBondContact O-N 3.12Å; F215-P327 HydrophobicContact CD1-CB 3.76Å; F215-P327 HydrophobicContact CD1-CG 3.97Å; F215-P327 HydrophobicContact CD2-CB 4.25Å; F215-P327 HydrophobicContact CE1-CB 3.51Å; F215-P327 HydrophobicContact CE1-CG 4.06Å; F215-P327 HydrophobicContact CE2-CB 4.01Å; F215-P327 HydrophobicContact CG-CB 4.14Å; F215-P327 HydrophobicContact CG-CG 4.49Å; F215-P327 HydrophobicContact CZ-CB 3.64Å; F215-V329 HydrophobicContact CE2-CG2 4.48Å; F215-N339 WeakPolarHBondContact CA-O 3.37Å; F215-F340 HydrophobicContact CB-CD1 3.57Å; F215-F340 HydrophobicContact CB-CE1 3.87Å; F215-F340 HydrophobicContact CD2-CD1 4.39Å; F215-F340 AromaticContact CD2-CE1 3.81Å; F215-F340 HydrophobicContact CD2-CE1 3.81Å; F215-F340 HydrophobicContact CG-CD1 4.16Å; F215-F340 AromaticContact CG-CE1 3.94Å; F215-F340 HydrophobicContact CG-CE1 3.94Å; F215-M364 HydrophobicContact CB-CG 4.25Å
216	E	97.2	Very high	92.4	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.019	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	151.1	175.2	-52.1	168.4	112.4	0	0	111	F214 V285 V286 C338 N339 P347 W348 F349	F214-E216 HydrophobicContact CD2-CG 4.44Å; F214-E216 HydrophobicContact CE2-CG 4.31Å; E216-V285 HydrophobicContact CB-CG1 3.89Å; E216-V285 HydrophobicContact CG-CG1 4.33Å; E216-V286 CarbonylContact C-O 3.51Å; E216-V286 WeakPolarHBondContact CA-O 3.47Å; E216-C338 CarbonylContact O-C 3.59Å; E216-C338 VanDerWaalsContact O-CA 3.31Å; E216-C338 WeakPolarHBondContact O-CA 3.36Å; E216-N339 HydrophobicContact CB-CB 4.14Å; E216-N339 PolarHBondContact N-O 3Å; E216-N339 PolarHBondContact O-N 3.39Å; E216-N339 PolarHBondContact OE2-ND2 3.48Å; E216-P347 VanDerWaalsContact OE2-CA 3.31Å; E216-P347 WeakPolarHBondContact OE2-CA 3.32Å; E216-W348 HydrophobicContact CB-CE3 3.73Å; E216-W348 HydrophobicContact CB-CZ3 3.93Å; E216-W348 VanDerWaalsContact CD-N 3.27Å; E216-W348 WeakPolarHBondContact OE1-CA 3.37Å; E216-W348 WeakPolarHBondContact OE1-CB 3.39Å; E216-W348 PolarHBondContact OE1-N 2.73Å; E216-W348 PolarHBondContact OE2-N 3.02Å; E216-F349 PolarHBondContact OE1-N 2.97Å
217	V	97.8	Very high	90.8	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	119	172.7	-172.9	0	0	0	0	108.9	F215 L239 V241 V285 V286 V329 F336 A337	F215-V217 HydrophobicContact CD2-CG2 3.85Å; F215-V217 HydrophobicContact CE2-CG2 3.54Å; V217-L239 HydrophobicContact CG1-CD1 4.36Å; V217-L239 HydrophobicContact CG1-CD2 4.25Å; V217-V241 HydrophobicContact CB-CG1 4.38Å; V217-V241 HydrophobicContact CB-CG2 3.82Å; V217-V241 HydrophobicContact CG1-CG2 4.2Å; V217-V241 HydrophobicContact CG2-CB 4.39Å; V217-V241 HydrophobicContact CG2-CG1 3.58Å; V217-V241 HydrophobicContact CG2-CG2 3.84Å; V217-V285 WeakPolarHBondContact O-CA 3.38Å; V217-V286 PolarHBondContact N-O 3.22Å; V217-V286 PolarHBondContact O-N 3.21Å; V217-V329 HydrophobicContact CG1-CG2 4.41Å; V217-V329 HydrophobicContact CG2-CG2 3.86Å; V217-F336 HydrophobicContact CG1-CB 4.09Å; V217-F336 HydrophobicContact CG1-CD2 3.86Å; V217-F336 HydrophobicContact CG1-CG 4.3Å; V217-A337 CarbonylContact C-O 3.54Å; V217-A337 WeakPolarHBondContact CA-O 3.43Å
218	R	97.5	Very high	89.3	Confident	96 Å²	96	43.5 Å²	43.5	36%	0.362	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.6	171.9	-172.1	-179.2	-58.1	-164.9	-1.4	109.7	V220 D284 V285 F336 A337 W348	R218-V220 PolarHBondContact O-N 3Å; R218-D284 WeakPolarHBondContact CA-O 3.5Å; R218-V285 HydrophobicContact CB-CG2 4.02Å; R218-V285 HydrophobicContact CG-CG2 3.93Å; R218-F336 VanDerWaalsContact O-CA 3.25Å; R218-F336 WeakPolarHBondContact O-CA 3.35Å; R218-F336 WeakPolarHBondContact O-CB 3.37Å; R218-A337 PolarHBondContact N-O 3.19Å; R218-A337 PolarHBondContact O-N 3.33Å; R218-W348 HydrophobicContact CB-CE3 4.2Å; R218-W348 HydrophobicContact CB-CH2 3.83Å; R218-W348 HydrophobicContact CB-CZ3 3.56Å; R218-W348 VanDerWaalsContact NH2-CD1 3.26Å; R218-W348 VanDerWaalsContact NH2-CD2 3.32Å; R218-W348 VanDerWaalsContact NH2-CE2 3.3Å
219	V	97.4	Very high	87.3	Confident	4 Å²	4	50 Å²	50	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	102.3	168.7	-172.2	0	0	0	0	107.7	F280 G281 G283 D284 V334	V219-F280 HydrophobicContact CG2-CD2 4.19Å; V219-G281 WeakPolarHBondContact CB-O 3.19Å; V219-G281 WeakPolarHBondContact CG1-O 3.47Å; V219-G281 WeakPolarHBondContact CG2-O 3.38Å; V219-G283 PolarHBondContact O-N 3.13Å; V219-D284 PolarHBondContact N-O 3.39Å; V219-V334 HydrophobicContact CG1-CG1 3.67Å
220	V	96.6	Very high	85.5	Confident	51 Å²	51	50.4 Å²	50.4	31%	0.309	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-47.8	-169.4	174.9	0	0	0	0	111.8	R218 E335 A337	R218-V220 PolarHBondContact O-N 3Å; V220-E335 WeakPolarHBondContact CA-O 3.39Å; V220-E335 HydrophobicContact CB-CB 4.46Å; V220-E335 HydrophobicContact CB-CG 4.32Å; V220-E335 WeakPolarHBondContact CB-O 3.43Å; V220-E335 HydrophobicContact CG1-CG 4.45Å; V220-E335 PolarHBondContact N-O 3.27Å; V220-A337 HydrophobicContact CG2-CB 3.67Å
221	K	95	Very high	83.9	Confident	85 Å²	85	49.6 Å²	49.6	37%	0.37	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	157.1	168.4	60	166.4	169.2	-66.9	0	114	E282 V334 E335	K221-E282 WeakPolarHBondContact CA-OE1 3.34Å; K221-E282 WeakPolarHBondContact CB-OE1 3.12Å; K221-V334 WeakPolarHBondContact O-CA 3.37Å; K221-E335 WeakPolarHBondContact CE-OE2 3.49Å; K221-E335 HydrophobicContact CG-CB 4.14Å; K221-E335 PolarHBondContact N-O 2.84Å; K221-E335 IonicContact NZ-OE2 2.63Å; K221-E335 PolarHBondContact NZ-OE2 3.33Å; K221-E335 PolarHBondContact O-N 3.3Å
222	N	93.6	Very high	82.5	Confident	54 Å²	54	48.7 Å²	48.7	29%	0.289	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	133.5	161.7	-64.4	-50.1	0	0	0	110	H237 E282	N222-H237 HydrophobicContact CB-CB 4.44Å; N222-H237 WeakPolarHBondContact OD1-CB 3.27Å; N222-H237 VanDerWaalsContact OD1-CG 3.3Å; N222-E282 VanDerWaalsContact CB-OE2 3.28Å; N222-E282 WeakPolarHBondContact CB-OE2 3.23Å; N222-E282 VanDerWaalsContact CG-OE2 3.22Å; N222-E282 PolarHBondContact N-OE2 2.71Å; N222-E282 WeakPolarHBondContact ND2-CB 3.38Å; N222-E282 PolarHBondContact ND2-OE2 2.91Å
223	L	92.3	Very high	80.6	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.084	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-90.5	136.3	179.8	-65.8	170.4	0	0	0	110.1	K188 P189 T191 V225 H237 N333 E335	K188-L223 HydrophobicContact CB-CD1 3.8Å; P189-L223 HydrophobicContact CG-CD1 4.16Å; T191-L223 HydrophobicContact CG2-CB 3.73Å; T191-L223 HydrophobicContact CG2-CD1 3.96Å; L223-V225 PolarHBondContact O-N 3.11Å; L223-H237 PolarHBondContact O-CE1 3.26Å; L223-N333 WeakPolarHBondContact CB-O 3.23Å; L223-N333 PolarHBondContact N-O 3.46Å; L223-E335 HydrophobicContact CD2-CB 4.08Å; L223-E335 HydrophobicContact CG-CB 4.33Å
224	P	88	Confident	79.2	Confident	109 Å²	109	51.7 Å²	51.7	71%	0.708	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-63	137.9	-179.7	26.4	-34.5	0	0	0	111.6	T191	T191-P224 PolarHBondContact OG1-O 2.81Å
225	V	82.3	Confident	77.7	Confident	37 Å²	37	54.1 Å²	54.1	22%	0.224	32%	0.319	C	S	.	.			trans	-128.2	131.3	-179.5	177.7	0	0	0	0	110.4	L223 Y228 N333	L223-V225 PolarHBondContact O-N 3.11Å; V225-Y228 HydrophobicContact CG1-CD2 4.07Å; V225-Y228 HydrophobicContact CG1-CG 4.36Å; V225-N333 HydrophobicContact CG2-CB 3.82Å; V225-N333 VanDerWaalsContact CG2-CG 3.43Å
226	E	73.1	Confident	77	Confident	153 Å²	153	56.2 Å²	56.2	72%	0.715	33%	0.332	S	S	*	.	S	Bend	trans	-87.3	132.3	171.5	-62.5	179.6	173.8	0	0	111.3	Y228	E226-Y228 PolarHBondContact O-N 3.3Å
227	N	60.7	Low	76.6	Confident	118 Å²	118	58.8 Å²	58.8	63%	0.631	34%	0.344	S	S	*	.	S	Bend	trans	56.6	44.4	166.2	-54.5	-66	0	0	0	115.2	S230	N227-S230 PolarHBondContact O-OG 2.85Å
228	Y	62.3	Low	76.3	Confident	10 Å²	10	59.6 Å²	59.6	4%	0.039	35%	0.349	C	S	.	.			trans	-77.9	-52.8	177.8	-166.8	-96.6	0	0	0	112.7	S196 L197 V225 E226 S230 L231 G234 A235 T236 K332	S196-Y228 WeakPolarHBondContact O-CE2 3.46Å; L197-Y228 HydrophobicContact CD2-CD2 3.75Å; L197-Y228 HydrophobicContact CD2-CE2 3.8Å; V225-Y228 HydrophobicContact CG1-CD2 4.07Å; V225-Y228 HydrophobicContact CG1-CG 4.36Å; E226-Y228 PolarHBondContact O-N 3.3Å; Y228-S230 PolarHBondContact O-N 3.43Å; Y228-S230 VanDerWaalsContact O-N 3.1Å; Y228-L231 PolarHBondContact O-N 3.11Å; Y228-G234 WeakPolarHBondContact CE1-O 3.45Å; Y228-A235 PolarHBondContact OH-O 2.87Å; Y228-T236 HydrophobicContact CD1-CG2 3.34Å; Y228-T236 HydrophobicContact CE1-CG2 3.69Å; Y228-T236 HydrophobicContact CG-CG2 3.94Å; Y228-K332 WeakPolarHBondContact OH-CE 3.49Å; Y228-K332 PolarHBondContact OH-NZ 2.72Å
229	D	53.3	Low	76.2	Confident	137 Å²	137	55.3 Å²	55.3	73%	0.733	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.4	-168.7	-46.5	-34.6	0	0	0	112.8	L231	D229-L231 VanDerWaalsContact C-N 3.25Å; D229-L231 PolarHBondContact O-N 2.68Å
230	S	54.5	Low	76.1	Confident	63 Å²	63	55.9 Å²	55.9	44%	0.441	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-9	-179.1	60.6	0	0	0	0	114.4	N227 Y228 R440	N227-S230 PolarHBondContact O-OG 2.85Å; Y228-S230 PolarHBondContact O-N 3.43Å; Y228-S230 VanDerWaalsContact O-N 3.1Å; S230-R440 PolarHBondContact O-NH1 3.48Å; S230-R440 PolarHBondContact O-NH2 3.36Å; S230-R440 VanDerWaalsContact O-NH2 3.14Å
231	L	54.6	Low	76.2	Confident	24 Å²	24	53.4 Å²	53.4	13%	0.126	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-43.3	-166.4	-72.3	173.6	0	0	0	117.4	L197 Y228 D229 K447	L197-L231 HydrophobicContact CD1-CD1 4.44Å; Y228-L231 PolarHBondContact O-N 3.11Å; D229-L231 VanDerWaalsContact C-N 3.25Å; D229-L231 PolarHBondContact O-N 2.68Å; L231-K447 HydrophobicContact CD1-CD 4.29Å; L231-K447 VanDerWaalsContact CD1-NZ 3.25Å
232	V	59.2	Low	76.3	Confident	16 Å²	16	49.4 Å²	49.4	10%	0.097	30%	0.302	C	S	.	.	S	Bend	trans	-128.6	-27.1	-161.2	-179.5	0	0	0	0	116.4	L197 V428 Y437	L197-V232 HydrophobicContact CD1-CG2 3.97Å; L197-V232 HydrophobicContact CD2-CB 4.41Å; L197-V232 HydrophobicContact CD2-CG2 3.7Å; L197-V232 HydrophobicContact CG-CG2 4.37Å; V232-V428 HydrophobicContact CG1-CG2 3.59Å; V232-Y437 HydrophobicContact CG2-CE1 4.41Å
233	G	52	Low	76.5	Confident	59 Å²	59	46.8 Å²	46.8	61%	0.608	29%	0.288	S	S	*	.			trans	67.5	85	175.5	0	0	0	0	0	114.3
234	G	62.6	Low	76.6	Confident	45 Å²	45	46 Å²	46	46%	0.464	29%	0.285	S	S	.	.	S	Bend	trans	175.1	-179.4	176.7	0	0	0	0	0	110.6	Y228 T236	Y228-G234 WeakPolarHBondContact CE1-O 3.45Å; G234-T236 PolarHBondContact O-N 2.77Å
235	A	65.7	Low	76.9	Confident	55 Å²	55	41.1 Å²	41.1	46%	0.455	25%	0.252	S	S	.	.			trans	-58.9	133.2	178.2	0	0	0	0	0	111.2	Y228 V238	Y228-A235 PolarHBondContact OH-O 2.87Å; A235-V238 HydrophobicContact CB-CG2 3.4Å; A235-V238 VanDerWaalsContact CB-CG2 3.4Å
236	T	80.9	Confident	77.3	Confident	45 Å²	45	41 Å²	41	28%	0.276	25%	0.25	S	C	.	.	S	Bend	trans	-72.8	-47	180	39.4	0	0	0	0	111.8	Y228 G234 N333	Y228-T236 HydrophobicContact CD1-CG2 3.34Å; Y228-T236 HydrophobicContact CE1-CG2 3.69Å; Y228-T236 HydrophobicContact CG-CG2 3.94Å; G234-T236 PolarHBondContact O-N 2.77Å; T236-N333 WeakPolarHBondContact O-CB 3.36Å; T236-N333 PolarHBondContact O-ND2 2.91Å
237	H	89.9	Confident	78	Confident	58 Å²	58	37.1 Å²	37.1	27%	0.269	23%	0.234	S	C	.	.	S	Bend	trans	-120.8	122.4	-175.5	-50.4	-69.4	0	0	0	108.7	N222 L223 K332 N333 V334	N222-H237 HydrophobicContact CB-CB 4.44Å; N222-H237 WeakPolarHBondContact OD1-CB 3.27Å; N222-H237 VanDerWaalsContact OD1-CG 3.3Å; L223-H237 PolarHBondContact O-CE1 3.26Å; H237-K332 WeakPolarHBondContact CA-O 3.46Å; H237-N333 WeakPolarHBondContact ND1-CB 3.35Å; H237-N333 PolarHBondContact ND1-O 3.21Å; H237-V334 HydrophobicContact CB-CG2 3.73Å
238	V	91.6	Very high	79.3	Confident	16 Å²	16	31.7 Å²	31.7	10%	0.097	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	144.8	179	-167.1	0	0	0	0	109.5	W199 A235 T264 K332	W199-V238 HydrophobicContact CH2-CB 3.58Å; W199-V238 HydrophobicContact CH2-CG1 3.65Å; W199-V238 HydrophobicContact CH2-CG2 4.17Å; W199-V238 HydrophobicContact CZ2-CB 4.43Å; W199-V238 HydrophobicContact CZ3-CB 4Å; W199-V238 HydrophobicContact CZ3-CG1 4.13Å; A235-V238 HydrophobicContact CB-CG2 3.4Å; A235-V238 VanDerWaalsContact CB-CG2 3.4Å; V238-T264 HydrophobicContact CG1-CG2 4.45Å; V238-K332 PolarHBondContact N-O 3.3Å; V238-K332 VanDerWaalsContact N-O 3.09Å; V238-K332 PolarHBondContact O-N 2.78Å
239	L	95	Very high	80.5	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.037	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	141	171.6	-172.4	149.5	0	0	0	109.1	V217 V241 G262 G263 F280 V329 V331 V334 F336	V217-L239 HydrophobicContact CG1-CD1 4.36Å; V217-L239 HydrophobicContact CG1-CD2 4.25Å; L239-V241 HydrophobicContact CD2-CG2 3.36Å; L239-G262 WeakPolarHBondContact O-CA 3.31Å; L239-G263 PolarHBondContact O-N 2.94Å; L239-F280 HydrophobicContact CD2-CE2 4.11Å; L239-V329 HydrophobicContact CD1-CG1 4.08Å; L239-V329 HydrophobicContact CD2-CG1 4.08Å; L239-V329 HydrophobicContact CG-CG1 3.97Å; L239-V331 HydrophobicContact CB-CG2 4.31Å; L239-V331 HydrophobicContact CD1-CB 4.49Å; L239-V331 HydrophobicContact CD1-CG2 3.94Å; L239-V331 HydrophobicContact CG-CB 4.49Å; L239-V331 HydrophobicContact CG-CG2 4.22Å; L239-V334 HydrophobicContact CB-CG1 4.44Å; L239-V334 HydrophobicContact CD1-CG1 3.85Å; L239-F336 HydrophobicContact CD1-CB 3.57Å; L239-F336 HydrophobicContact CD1-CD1 3.96Å; L239-F336 HydrophobicContact CD1-CG 3.86Å
240	R	95.9	Very high	82.4	Confident	15 Å²	15	28.8 Å²	28.8	6%	0.057	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.1	167.3	-54.5	-173.2	-172.9	143.2	6.4	109.6	L252 Y261 V329 Y330 M429	R240-L252 HydrophobicContact CB-CD2 4.02Å; R240-L252 WeakPolarHBondContact CD-O 3.34Å; R240-L252 PolarHBondContact NH1-O 3.12Å; R240-Y261 CarbonylContact C-O 3.54Å; R240-Y261 VanDerWaalsContact CA-O 3.24Å; R240-Y261 WeakPolarHBondContact CA-O 3.23Å; R240-V329 WeakPolarHBondContact O-CA 3.36Å; R240-Y330 PolarHBondContact N-O 3.42Å; R240-Y330 PolarHBondContact O-N 3.47Å; R240-M429 PolarHBondContact NH2-SD 3.21Å
241	V	97.6	Very high	84.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145.8	174.3	-171.4	0	0	0	0	108.7	F215 V217 L239 G260 Y261 V286 A288 F301	F215-V241 HydrophobicContact CE2-CG1 3.66Å; F215-V241 HydrophobicContact CZ-CG1 3.65Å; V217-V241 HydrophobicContact CB-CG1 4.38Å; V217-V241 HydrophobicContact CB-CG2 3.82Å; V217-V241 HydrophobicContact CG1-CG2 4.2Å; V217-V241 HydrophobicContact CG2-CB 4.39Å; V217-V241 HydrophobicContact CG2-CG1 3.58Å; V217-V241 HydrophobicContact CG2-CG2 3.84Å; L239-V241 HydrophobicContact CD2-CG2 3.36Å; V241-G260 WeakPolarHBondContact O-CA 3.42Å; V241-Y261 PolarHBondContact N-O 3.19Å; V241-Y261 PolarHBondContact O-N 2.91Å; V241-V286 HydrophobicContact CB-CG1 4.25Å; V241-V286 HydrophobicContact CG2-CB 4.13Å; V241-V286 HydrophobicContact CG2-CG1 4.13Å; V241-A288 HydrophobicContact CG1-CB 3.7Å; V241-F301 HydrophobicContact CB-CE1 4.48Å; V241-F301 VanDerWaalsContact O-CE1 3.3Å; V241-F301 WeakPolarHBondContact O-CE1 3.2Å
242	G	97.3	Very high	86.1	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.7	-141.6	169.2	0	0	0	0	0	113.5	F215 F259 H328	F215-G242 WeakPolarHBondContact CZ-O 3.46Å; G242-F259 WeakPolarHBondContact CA-O 3.46Å; G242-H328 PolarHBondContact N-O 3.4Å; G242-H328 PolarHBondContact O-N 2.91Å
243	W	97.3	Very high	87.6	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.9	-168.6	-56.4	93.8	0	0	0	110.7	F215 F259 F289 I290 L299 L325 F326 P327 M364	F215-W243 AromaticContact CD1-CH2 3.7Å; F215-W243 HydrophobicContact CD1-CH2 3.7Å; F215-W243 AromaticContact CD1-CZ2 3.69Å; F215-W243 HydrophobicContact CD1-CZ2 3.69Å; F215-W243 HydrophobicContact CD1-CZ3 4.38Å; F215-W243 HydrophobicContact CE1-CD2 4.22Å; F215-W243 AromaticContact CE1-CE2 3.82Å; F215-W243 HydrophobicContact CE1-CE3 4.41Å; F215-W243 AromaticContact CE1-CH2 3.84Å; F215-W243 HydrophobicContact CE1-CH2 3.84Å; F215-W243 AromaticContact CE1-CZ2 3.62Å; F215-W243 HydrophobicContact CE1-CZ2 3.62Å; F215-W243 HydrophobicContact CE1-CZ3 4.25Å; W243-F259 PolarHBondContact N-O 2.81Å; W243-F259 PolarHBondContact O-N 3.09Å; W243-F289 PolarHBondContact NE1-O 3.47Å; W243-I290 HydrophobicContact CD2-CB 4.36Å; W243-I290 HydrophobicContact CD2-CG2 4.43Å; W243-I290 HydrophobicContact CE3-CG2 4.36Å; W243-I290 HydrophobicContact CH2-CB 4.23Å; W243-I290 HydrophobicContact CH2-CG2 3.38Å; W243-I290 HydrophobicContact CZ2-CB 3.81Å; W243-I290 HydrophobicContact CZ2-CG2 3.43Å; W243-I290 VanDerWaalsContact CZ2-CG2 3.43Å; W243-I290 HydrophobicContact CZ3-CG2 3.87Å; W243-L299 HydrophobicContact CB-CD1 4.29Å; W243-L299 HydrophobicContact CG-CD1 4.47Å; W243-L299 HydrophobicContact CG-CD2 4.21Å; W243-L325 HydrophobicContact CB-CB 4.32Å; W243-L325 HydrophobicContact CE3-CB 4.34Å; W243-F326 WeakPolarHBondContact CA-O 3.4Å; W243-P327 HydrophobicContact CE3-CG 4.31Å; W243-P327 HydrophobicContact CH2-CG 4.21Å; W243-P327 HydrophobicContact CZ3-CB 4.47Å; W243-P327 HydrophobicContact CZ3-CG 3.68Å; W243-M364 HydrophobicContact CH2-CG 4.33Å; W243-M364 HydrophobicContact CH2-SD 3.8Å; W243-M364 HydrophobicContact CZ3-SD 3.99Å
244	S	95.7	Very high	89.4	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	166.3	167.2	77.9	0	0	0	0	111.8	T248 Q257 F326 H328	S244-T248 WeakPolarHBondContact CB-OG1 3.34Å; S244-T248 PolarHBondContact OG-OG1 3.44Å; S244-T248 VanDerWaalsContact OG-OG1 3.12Å; S244-Q257 VanDerWaalsContact CA-O 3.29Å; S244-Q257 WeakPolarHBondContact CA-O 3.48Å; S244-F326 PolarHBondContact N-O 3.33Å; S244-F326 VanDerWaalsContact N-O 3.15Å; S244-F326 PolarHBondContact O-N 2.83Å; S244-H328 PolarHBondContact OG-ND1 3.27Å
245	T	93.4	Very high	90.7	Very high	5 Å²	5	24.3 Å²	24.3	3%	0.031	13%	0.133	C	C	.	.			trans	-73	177.1	166.5	57.5	0	0	0	0	111	R203 T248 Q257 L319 L325	R203-T245 PolarHBondContact NH1-O 3.01Å; T245-T248 PolarHBondContact O-OG1 3.44Å; T245-Q257 HydrophobicContact CG2-CB 3.98Å; T245-Q257 HydrophobicContact CG2-CG 4.41Å; T245-Q257 PolarHBondContact N-O 3.37Å; T245-Q257 WeakPolarHBondContact OG1-CB 3.48Å; T245-Q257 PolarHBondContact OG1-OE1 3.21Å; T245-L319 HydrophobicContact CG2-CD2 3.82Å; T245-L325 HydrophobicContact CG2-CD2 3.96Å
246	E	90.7	Very high	91.8	Very high	36 Å²	36	25.3 Å²	25.3	17%	0.168	13%	0.134	C	C	.	.	S	Bend	trans	-74.7	-31.4	177.9	-175.8	176.6	-117.4	0	0	113.6	R203 F326 G375 R376	R203-E246 VanDerWaalsContact NH1-C 3.28Å; R203-E246 PolarHBondContact NH1-O 3.04Å; R203-E246 PolarHBondContact NH2-O 3.33Å; E246-F326 HydrophobicContact CB-CE2 3.97Å; E246-F326 HydrophobicContact CB-CZ 4.49Å; E246-G375 VanDerWaalsContact OE1-C 3.32Å; E246-G375 WeakPolarHBondContact OE1-CA 3.39Å; E246-R376 WeakPolarHBondContact OE1-CG 3.29Å; E246-R376 PolarHBondContact OE1-N 2.82Å; E246-R376 IonicContact OE1-NE 2.8Å; E246-R376 IonicContact OE2-CZ 2.76Å; E246-R376 IonicContact OE2-NE 2.66Å; E246-R376 PolarHBondContact OE2-NE 3.33Å; E246-R376 IonicContact OE2-NH2 3.14Å; E246-R376 PolarHBondContact OE2-NH2 3.46Å
247	D	87.6	Confident	92.4	Very high	71 Å²	71	25.7 Å²	25.7	38%	0.38	13%	0.133	S	C	.	.	S	Bend	trans	-81	-15.4	-174	-95.4	-11.1	0	0	0	114.3	R376 R410	D247-R376 IonicContact OD1-CZ 2.86Å; D247-R376 IonicContact OD1-NH1 3.2Å; D247-R376 PolarHBondContact OD1-NH1 2.89Å; D247-R376 VanDerWaalsContact OD1-NH1 3.08Å; D247-R376 IonicContact OD1-NH2 2.67Å; D247-R376 PolarHBondContact OD1-NH2 3.24Å; D247-R410 VanDerWaalsContact CG-NH1 3.34Å; D247-R410 IonicContact OD2-CZ 2.8Å; D247-R410 IonicContact OD2-NH1 2.69Å; D247-R410 PolarHBondContact OD2-NH1 3.08Å
248	T	88.4	Confident	92.6	Very high	4 Å²	4	23 Å²	23	3%	0.025	12%	0.12	C	C	.	.	S	Bend	trans	-71.9	147.9	173.9	62.9	0	0	0	0	111.7	R203 S244 T245 E255 Q257	R203-T248 PolarHBondContact NH1-O 2.84Å; S244-T248 WeakPolarHBondContact CB-OG1 3.34Å; S244-T248 PolarHBondContact OG-OG1 3.44Å; S244-T248 VanDerWaalsContact OG-OG1 3.12Å; T245-T248 PolarHBondContact O-OG1 3.44Å; T248-E255 WeakPolarHBondContact CA-OE2 3.21Å; T248-E255 HydrophobicContact CG2-CB 4.02Å; T248-E255 WeakPolarHBondContact CG2-OE2 3.39Å; T248-Q257 HydrophobicContact CG2-CB 3.82Å
249	D	88.3	Confident	92.8	Very high	68 Å²	68	22.9 Å²	22.9	36%	0.364	12%	0.119	S	C	.	.			trans	-63.8	162.9	167.4	-86.8	-16.3	0	0	0	112.9	T251 E255 K406	D249-T251 PolarHBondContact O-N 3.33Å; D249-E255 WeakPolarHBondContact CB-OE1 3.44Å; D249-E255 PolarHBondContact N-OE1 3.13Å; D249-K406 WeakPolarHBondContact OD1-CE 3.42Å; D249-K406 IonicContact OD1-NZ 2.83Å; D249-K406 PolarHBondContact OD1-NZ 3.15Å; D249-K406 IonicContact OD2-NZ 3.19Å; D249-K406 PolarHBondContact OD2-NZ 2.83Å
250	F	92.3	Very high	92.9	Very high	17 Å²	17	22.6 Å²	22.6	8%	0.075	12%	0.117	C	C	.	.	S	Bend	trans	-69.7	18.9	-179	-51.2	-51.4	0	0	0	114.7	N173 G201 Y330	N173-F250 VanDerWaalsContact C-CE1 3.47Å; N173-F250 HydrophobicContact CB-CE1 4.17Å; N173-F250 WeakPolarHBondContact O-CE1 3.4Å; G201-F250 WeakPolarHBondContact CA-O 3.21Å; F250-Y330 WeakPolarHBondContact O-CD2 3.31Å; F250-Y330 WeakPolarHBondContact O-CE2 3.47Å
251	T	91.6	Very high	92.9	Very high	16 Å²	16	21.9 Å²	21.9	10%	0.098	11%	0.114	C	C	.	.	S	Bend	trans	-105.6	74.9	-179.6	64	0	0	0	0	111.4	D249 G253 E254 Y330	D249-T251 PolarHBondContact O-N 3.33Å; T251-G253 PolarHBondContact O-N 3.42Å; T251-E254 VanDerWaalsContact CB-CD 3.48Å; T251-E254 WeakPolarHBondContact CB-OE2 3.37Å; T251-E254 WeakPolarHBondContact O-CB 3.47Å; T251-E254 PolarHBondContact O-N 3Å; T251-E254 PolarHBondContact OG1-OE2 3.49Å; T251-Y330 HydrophobicContact CG2-CE2 3.88Å; T251-Y330 WeakPolarHBondContact CG2-OH 3.33Å
252	L	94.3	Very high	92.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	121.9	-171.7	-177.2	62.2	0	0	0	113.5	R240 S258 H328 Y330	R240-L252 HydrophobicContact CB-CD2 4.02Å; R240-L252 WeakPolarHBondContact CD-O 3.34Å; R240-L252 PolarHBondContact NH1-O 3.12Å; L252-S258 WeakPolarHBondContact CA-OG 3.39Å; L252-H328 HydrophobicContact CD1-CB 4.03Å; L252-H328 HydrophobicContact CD2-CB 4.34Å; L252-H328 WeakPolarHBondContact CD2-O 3.39Å; L252-Y330 HydrophobicContact CB-CD1 4.42Å; L252-Y330 HydrophobicContact CB-CG 4.22Å
253	G	91.5	Very high	92.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.6	-3.2	179.7	0	0	0	0	0	115.4	T251 S258 S268 T269 N270 N271	T251-G253 PolarHBondContact O-N 3.42Å; G253-S258 PolarHBondContact N-OG 3.42Å; G253-S268 WeakPolarHBondContact CA-O 3.39Å; G253-T269 CarbonylContact O-C 3.54Å; G253-T269 VanDerWaalsContact O-CA 3.23Å; G253-T269 WeakPolarHBondContact O-CA 3.18Å; G253-T269 PolarHBondContact O-N 3.3Å; G253-N270 PolarHBondContact O-N 2.83Å; G253-N271 PolarHBondContact O-N 3.34Å; G253-N271 VanDerWaalsContact O-N 3.15Å
254	E	89.8	Confident	92.3	Very high	37 Å²	37	25.9 Å²	25.9	17%	0.173	14%	0.142	C	C	.	.	S	Bend	trans	-86.6	-24.4	176.6	-61.4	178.4	-171.5	0	0	112.2	T251 N270 N271 Y330 M429	T251-E254 VanDerWaalsContact CB-CD 3.48Å; T251-E254 WeakPolarHBondContact CB-OE2 3.37Å; T251-E254 WeakPolarHBondContact O-CB 3.47Å; T251-E254 PolarHBondContact O-N 3Å; T251-E254 PolarHBondContact OG1-OE2 3.49Å; E254-N270 CarbonylContact O-C 3.52Å; E254-N270 WeakPolarHBondContact O-CA 3.37Å; E254-N271 PolarHBondContact O-N 2.76Å; E254-N271 VanDerWaalsContact O-N 3.15Å; E254-N271 PolarHBondContact O-ND2 3.16Å; E254-Y330 PolarHBondContact OE1-OH 2.72Å; E254-M429 WeakPolarHBondContact OE1-CE 3.47Å
255	E	89.4	Confident	92.2	Very high	61 Å²	61	26.3 Å²	26.3	29%	0.285	15%	0.146	S	C	.	.	S	Bend	trans	-103.4	161.8	179.4	-82.9	-167.3	-129.7	0	0	114.8	T248 D249 Q257 S258 N270	T248-E255 WeakPolarHBondContact CA-OE2 3.21Å; T248-E255 HydrophobicContact CG2-CB 4.02Å; T248-E255 WeakPolarHBondContact CG2-OE2 3.39Å; D249-E255 WeakPolarHBondContact CB-OE1 3.44Å; D249-E255 PolarHBondContact N-OE1 3.13Å; E255-Q257 PolarHBondContact O-N 3.11Å; E255-S258 WeakPolarHBondContact O-CB 3.26Å; E255-S258 PolarHBondContact O-N 3Å; E255-N270 PolarHBondContact O-N 3.4Å
256	P	90.2	Very high	92.2	Very high	75 Å²	75	29.4 Å²	29.4	49%	0.487	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-37.3	-179.3	-22.6	33.3	0	0	0	115.8	S258 F259 T269 N270	P256-S258 VanDerWaalsContact C-N 3.26Å; P256-S258 PolarHBondContact O-N 2.79Å; P256-F259 WeakPolarHBondContact O-CZ 3.48Å; P256-T269 PolarHBondContact O-OG1 3.22Å; P256-N270 HydrophobicContact CG-CB 4.42Å
257	Q	91.7	Very high	92.5	Very high	54 Å²	54	30 Å²	30	25%	0.252	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	25.6	178.3	-67	-177.4	-17.4	0	0	112.2	S244 T245 T248 E255 Q318 L319	S244-Q257 VanDerWaalsContact CA-O 3.29Å; S244-Q257 WeakPolarHBondContact CA-O 3.48Å; T245-Q257 HydrophobicContact CG2-CB 3.98Å; T245-Q257 HydrophobicContact CG2-CG 4.41Å; T245-Q257 PolarHBondContact N-O 3.37Å; T245-Q257 WeakPolarHBondContact OG1-CB 3.48Å; T245-Q257 PolarHBondContact OG1-OE1 3.21Å; T248-Q257 HydrophobicContact CG2-CB 3.82Å; E255-Q257 PolarHBondContact O-N 3.11Å; Q257-Q318 PolarHBondContact NE2-O 3.35Å; Q257-L319 HydrophobicContact CG-CD2 4.49Å
258	S	94.6	Very high	92.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	119.3	-173	-160.9	0	0	0	0	109.3	L252 G253 E255 P256 T269	L252-S258 WeakPolarHBondContact CA-OG 3.39Å; G253-S258 PolarHBondContact N-OG 3.42Å; E255-S258 WeakPolarHBondContact O-CB 3.26Å; E255-S258 PolarHBondContact O-N 3Å; P256-S258 VanDerWaalsContact C-N 3.26Å; P256-S258 PolarHBondContact O-N 2.79Å; S258-T269 VanDerWaalsContact O-CA 3.31Å; S258-T269 WeakPolarHBondContact O-CA 3.44Å; S258-T269 VanDerWaalsContact O-CB 3.23Å; S258-T269 WeakPolarHBondContact O-CB 3.26Å; S258-T269 PolarHBondContact O-OG1 3.31Å
259	F	96.4	Very high	93	Very high	15 Å²	15	27.9 Å²	27.9	7%	0.066	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	97.3	-165.6	-53.6	-73.1	0	0	0	110.4	G242 W243 P256 L299 F312 V314 L325	G242-F259 WeakPolarHBondContact CA-O 3.46Å; W243-F259 PolarHBondContact N-O 2.81Å; W243-F259 PolarHBondContact O-N 3.09Å; P256-F259 WeakPolarHBondContact O-CZ 3.48Å; F259-L299 HydrophobicContact CB-CD1 3.62Å; F259-L299 HydrophobicContact CD2-CD1 3.97Å; F259-L299 HydrophobicContact CG-CD1 3.83Å; F259-F312 HydrophobicContact CB-CD2 3.79Å; F259-F312 HydrophobicContact CB-CE2 3.9Å; F259-F312 HydrophobicContact CB-CG 4.39Å; F259-F312 HydrophobicContact CD1-CB 4.35Å; F259-F312 HydrophobicContact CD1-CD1 4.05Å; F259-F312 HydrophobicContact CD1-CD2 4.17Å; F259-F312 HydrophobicContact CD1-CE1 4.36Å; F259-F312 HydrophobicContact CD1-CE2 4.46Å; F259-F312 AromaticContact CD1-CG 3.95Å; F259-F312 HydrophobicContact CD1-CG 3.95Å; F259-F312 HydrophobicContact CG-CD2 4.37Å; F259-V314 HydrophobicContact CD1-CG2 4.23Å; F259-V314 HydrophobicContact CD2-CG2 4.37Å; F259-V314 HydrophobicContact CE1-CG2 3.76Å; F259-V314 HydrophobicContact CE2-CG1 4.07Å; F259-V314 HydrophobicContact CE2-CG2 3.91Å; F259-V314 HydrophobicContact CZ-CB 4.34Å; F259-V314 HydrophobicContact CZ-CG1 3.74Å; F259-V314 HydrophobicContact CZ-CG2 3.58Å; F259-L325 HydrophobicContact CD2-CD2 4.47Å; F259-L325 HydrophobicContact CE2-CD2 4.41Å
260	G	96.7	Very high	93.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.6	-174.4	0	0	0	0	0	114.5	V241 K267 S268	V241-G260 WeakPolarHBondContact O-CA 3.42Å; G260-K267 CarbonylContact O-C 3.53Å; G260-K267 WeakPolarHBondContact O-CA 3.35Å; G260-S268 PolarHBondContact N-O 3.34Å; G260-S268 PolarHBondContact O-N 3.05Å; G260-S268 PolarHBondContact O-OG 2.88Å
261	Y	97.1	Very high	93	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125	167.1	169.9	-139.8	0	0	0	109.3	R240 V241 Y276 C278 F280 V286 F301 V303 Q308	R240-Y261 CarbonylContact C-O 3.54Å; R240-Y261 VanDerWaalsContact CA-O 3.24Å; R240-Y261 WeakPolarHBondContact CA-O 3.23Å; V241-Y261 PolarHBondContact N-O 3.19Å; V241-Y261 PolarHBondContact O-N 2.91Å; Y261-Y276 HydrophobicContact CD1-CE1 4.3Å; Y261-Y276 AromaticContact CD2-CD1 3.61Å; Y261-Y276 HydrophobicContact CD2-CD1 3.61Å; Y261-Y276 AromaticContact CD2-CE1 3.93Å; Y261-Y276 HydrophobicContact CD2-CE1 3.93Å; Y261-Y276 HydrophobicContact CE1-CE1 4.43Å; Y261-Y276 AromaticContact CE2-CD1 3.8Å; Y261-Y276 HydrophobicContact CE2-CD1 3.8Å; Y261-Y276 HydrophobicContact CE2-CE1 4.12Å; Y261-Y276 WeakPolarHBondContact CE2-O 3.39Å; Y261-Y276 HydrophobicContact CG-CD1 4.14Å; Y261-Y276 HydrophobicContact CG-CE1 4.03Å; Y261-C278 PolarHBondContact OH-N 3.31Å; Y261-C278 PolarHBondContact OH-O 2.94Å; Y261-F280 AromaticContact CD1-CE1 3.83Å; Y261-F280 HydrophobicContact CD1-CE1 3.83Å; Y261-F280 HydrophobicContact CD2-CE1 4.31Å; Y261-F280 AromaticContact CE1-CD1 3.9Å; Y261-F280 HydrophobicContact CE1-CD1 3.9Å; Y261-F280 AromaticContact CE1-CE1 3.64Å; Y261-F280 HydrophobicContact CE1-CE1 3.64Å; Y261-F280 HydrophobicContact CE2-CD1 4.43Å; Y261-F280 HydrophobicContact CE2-CE1 4.1Å; Y261-F280 HydrophobicContact CG-CE1 4.18Å; Y261-F280 AromaticContact CZ-CD1 3.84Å; Y261-F280 AromaticContact CZ-CE1 3.78Å; Y261-V286 HydrophobicContact CD1-CG1 4.04Å; Y261-V286 HydrophobicContact CE1-CG1 4.2Å; Y261-F301 HydrophobicContact CD1-CB 3.51Å; Y261-F301 AromaticContact CD1-CD1 3.75Å; Y261-F301 HydrophobicContact CD1-CD1 3.75Å; Y261-F301 HydrophobicContact CD1-CD2 4.14Å; Y261-F301 AromaticContact CD1-CG 3.53Å; Y261-F301 HydrophobicContact CD1-CG 3.53Å; Y261-F301 HydrophobicContact CE1-CB 3.9Å; Y261-F301 HydrophobicContact CE1-CG 4.41Å; Y261-F301 HydrophobicContact CG-CB 4.37Å; Y261-F301 HydrophobicContact CG-CD1 4.33Å; Y261-F301 HydrophobicContact CG-CD2 4.22Å; Y261-F301 HydrophobicContact CG-CG 4.05Å; Y261-V303 HydrophobicContact CE1-CG2 3.79Å; Y261-V303 WeakPolarHBondContact OH-CG2 3.36Å; Y261-Q308 HydrophobicContact CE1-CG 4.41Å
262	G	94.4	Very high	93	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	149.4	-175	0	0	0	0	0	114.1	L239 T264 G265 K266	L239-G262 WeakPolarHBondContact O-CA 3.31Å; G262-T264 PolarHBondContact O-N 2.92Å; G262-G265 PolarHBondContact O-N 2.74Å; G262-K266 PolarHBondContact N-O 3.13Å; G262-K266 PolarHBondContact O-N 2.79Å
263	G	92.6	Very high	92.8	Very high	11 Å²	11	40.9 Å²	40.9	11%	0.113	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-9.9	-176.6	0	0	0	0	0	116.2	L239 G265 T279 F280	L239-G263 PolarHBondContact O-N 2.94Å; G263-G265 PolarHBondContact O-N 2.98Å; G263-T279 CarbonylContact O-C 3.56Å; G263-T279 WeakPolarHBondContact O-CA 3.42Å; G263-T279 VanDerWaalsContact O-CB 3.31Å; G263-T279 WeakPolarHBondContact O-CB 3.47Å; G263-F280 VanDerWaalsContact CA-CZ 3.49Å; G263-F280 WeakPolarHBondContact CA-O 3.44Å; G263-F280 PolarHBondContact O-N 3.05Å
264	T	91.3	Very high	93	Very high	70 Å²	70	44.2 Å²	44.2	43%	0.429	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	15.9	170.5	65.1	0	0	0	0	113.9	V238 G262	V238-T264 HydrophobicContact CG1-CG2 4.45Å; G262-T264 PolarHBondContact O-N 2.92Å
265	G	93.2	Very high	93.2	Very high	9 Å²	9	48.1 Å²	48.1	9%	0.093	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	68.2	35.5	-179.5	0	0	0	0	0	114.2	G262 G263 D275 Y276 C278	G262-G265 PolarHBondContact O-N 2.74Å; G263-G265 PolarHBondContact O-N 2.98Å; G265-D275 WeakPolarHBondContact O-CA 3.42Å; G265-Y276 CarbonylContact C-O 3.57Å; G265-Y276 PolarHBondContact O-N 2.59Å; G265-Y276 VanDerWaalsContact O-O 3.08Å; G265-C278 VanDerWaalsContact CA-O 3.31Å; G265-C278 WeakPolarHBondContact CA-O 3.31Å
266	K	94.6	Very high	93.5	Very high	70 Å²	70	46.3 Å²	46.3	30%	0.304	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.7	-176.6	-67.8	178.4	-172.1	-72.1	0	111.6	G262 F273 T274 D275	G262-K266 PolarHBondContact N-O 3.13Å; G262-K266 PolarHBondContact O-N 2.79Å; K266-F273 HydrophobicContact CD-CB 4.42Å; K266-T274 CarbonylContact C-O 3.54Å; K266-T274 WeakPolarHBondContact CA-O 3.44Å; K266-D275 WeakPolarHBondContact CE-OD1 3.31Å; K266-D275 WeakPolarHBondContact CG-OD1 3.48Å; K266-D275 IonicContact NZ-OD1 2.68Å; K266-D275 PolarHBondContact NZ-OD1 3.01Å; K266-D275 IonicContact NZ-OD2 3.78Å
267	K	95.6	Very high	93.8	Very high	49 Å²	49	44.7 Å²	44.7	21%	0.213	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	150.4	164	69.7	-178.3	175.7	-176.5	0	110.6	G260 T274 Y276 C311 F312	G260-K267 CarbonylContact O-C 3.53Å; G260-K267 WeakPolarHBondContact O-CA 3.35Å; K267-T274 WeakPolarHBondContact CG-OG1 3.49Å; K267-T274 PolarHBondContact N-O 3.22Å; K267-T274 PolarHBondContact O-N 3.2Å; K267-Y276 HydrophobicContact CB-CD1 4.1Å; K267-Y276 HydrophobicContact CB-CG 4.01Å; K267-Y276 HydrophobicContact CD-CD2 3.98Å; K267-Y276 HydrophobicContact CD-CG 3.88Å; K267-Y276 HydrophobicContact CG-CG 4.14Å; K267-C311 VanDerWaalsContact CB-SG 3.51Å; K267-C311 WeakPolarHBondContact CD-O 3.4Å; K267-C311 VanDerWaalsContact CD-SG 3.52Å; K267-C311 PolarHBondContact NZ-O 2.71Å; K267-F312 HydrophobicContact CB-CE2 4.03Å; K267-F312 HydrophobicContact CB-CZ 3.77Å; K267-F312 HydrophobicContact CD-CE1 4.16Å; K267-F312 HydrophobicContact CD-CE2 4.47Å; K267-F312 HydrophobicContact CD-CZ 4.07Å; K267-F312 HydrophobicContact CG-CE1 4.39Å; K267-F312 HydrophobicContact CG-CZ 4.01Å
268	S	93.9	Very high	93.9	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.007	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	130.6	-167.2	55.7	0	0	0	0	112.6	G253 G260 K272 F273	G253-S268 WeakPolarHBondContact CA-O 3.39Å; G260-S268 PolarHBondContact N-O 3.34Å; G260-S268 PolarHBondContact O-N 3.05Å; G260-S268 PolarHBondContact O-OG 2.88Å; S268-K272 WeakPolarHBondContact CA-O 3.44Å; S268-F273 VanDerWaalsContact CB-CD1 3.47Å
269	T	94.2	Very high	94	Very high	30 Å²	30	49.4 Å²	49.4	18%	0.184	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	144.4	171.7	-174.6	0	0	0	0	109.6	G253 P256 S258 N271 K272 F312	G253-T269 CarbonylContact O-C 3.54Å; G253-T269 VanDerWaalsContact O-CA 3.23Å; G253-T269 WeakPolarHBondContact O-CA 3.18Å; G253-T269 PolarHBondContact O-N 3.3Å; P256-T269 PolarHBondContact O-OG1 3.22Å; S258-T269 VanDerWaalsContact O-CA 3.31Å; S258-T269 WeakPolarHBondContact O-CA 3.44Å; S258-T269 VanDerWaalsContact O-CB 3.23Å; S258-T269 WeakPolarHBondContact O-CB 3.26Å; S258-T269 PolarHBondContact O-OG1 3.31Å; T269-N271 VanDerWaalsContact C-N 3.27Å; T269-N271 PolarHBondContact O-N 3.15Å; T269-K272 PolarHBondContact N-O 3.1Å; T269-K272 WeakPolarHBondContact O-CB 3.24Å; T269-K272 PolarHBondContact O-N 3.22Å; T269-F312 HydrophobicContact CG2-CD1 4.38Å; T269-F312 HydrophobicContact CG2-CE1 3.58Å; T269-F312 HydrophobicContact CG2-CZ 4.18Å
270	N	91.5	Very high	93.9	Very high	81 Å²	81	49.5 Å²	49.5	43%	0.433	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	44	179.6	-159.9	7	0	0	0	114.5	G253 E254 E255 P256 K272	G253-N270 PolarHBondContact O-N 2.83Å; E254-N270 CarbonylContact O-C 3.52Å; E254-N270 WeakPolarHBondContact O-CA 3.37Å; E255-N270 PolarHBondContact O-N 3.4Å; P256-N270 HydrophobicContact CG-CB 4.42Å; N270-K272 PolarHBondContact O-N 3.42Å
271	N	89.3	Confident	93.8	Very high	84 Å²	84	51 Å²	51	45%	0.449	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	7.5	-174.4	-70.5	-69.6	0	0	0	116	G253 E254 T269 F273	G253-N271 PolarHBondContact O-N 3.34Å; G253-N271 VanDerWaalsContact O-N 3.15Å; E254-N271 PolarHBondContact O-N 2.76Å; E254-N271 VanDerWaalsContact O-N 3.15Å; E254-N271 PolarHBondContact O-ND2 3.16Å; T269-N271 VanDerWaalsContact C-N 3.27Å; T269-N271 PolarHBondContact O-N 3.15Å; N271-F273 VanDerWaalsContact O-CD2 3.27Å; N271-F273 WeakPolarHBondContact O-CD2 3.48Å; N271-F273 VanDerWaalsContact O-CE2 3.29Å; N271-F273 WeakPolarHBondContact O-CE2 3.28Å
272	K	90.8	Very high	93.7	Very high	139 Å²	139	56 Å²	56	60%	0.604	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.1	173	-61.4	-177.8	179.7	-176.8	0	109.3	S268 T269 N270	S268-K272 WeakPolarHBondContact CA-O 3.44Å; T269-K272 PolarHBondContact N-O 3.1Å; T269-K272 WeakPolarHBondContact O-CB 3.24Å; T269-K272 PolarHBondContact O-N 3.22Å; N270-K272 PolarHBondContact O-N 3.42Å
273	F	90.7	Very high	93.8	Very high	69 Å²	69	58.4 Å²	58.4	30%	0.303	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	108.9	-179.2	-62.2	-83.2	0	0	0	109.6	K266 S268 N271	K266-F273 HydrophobicContact CD-CB 4.42Å; S268-F273 VanDerWaalsContact CB-CD1 3.47Å; N271-F273 VanDerWaalsContact O-CD2 3.27Å; N271-F273 WeakPolarHBondContact O-CD2 3.48Å; N271-F273 VanDerWaalsContact O-CE2 3.29Å; N271-F273 WeakPolarHBondContact O-CE2 3.28Å
274	T	94.4	Very high	94	Very high	71 Å²	71	59.7 Å²	59.7	44%	0.436	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	142.3	-178.1	58.2	0	0	0	0	110.4	K266 K267	K266-T274 CarbonylContact C-O 3.54Å; K266-T274 WeakPolarHBondContact CA-O 3.44Å; K267-T274 WeakPolarHBondContact CG-OG1 3.49Å; K267-T274 PolarHBondContact N-O 3.22Å; K267-T274 PolarHBondContact O-N 3.2Å
275	D	95.6	Very high	94.3	Very high	119 Å²	119	56.7 Å²	56.7	64%	0.636	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.3	136.9	179	-59.8	-51.6	0	0	0	111.8	G265 K266	G265-D275 WeakPolarHBondContact O-CA 3.42Å; K266-D275 WeakPolarHBondContact CE-OD1 3.31Å; K266-D275 WeakPolarHBondContact CG-OD1 3.48Å; K266-D275 IonicContact NZ-OD1 2.68Å; K266-D275 PolarHBondContact NZ-OD1 3.01Å; K266-D275 IonicContact NZ-OD2 3.78Å
276	Y	95.8	Very high	94.5	Very high	22 Å²	22	56.2 Å²	56.2	9%	0.086	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	135.4	-176.3	166	-89.9	0	0	0	110.5	Y261 G265 K267 F301 Q308 G309 C311	Y261-Y276 HydrophobicContact CD1-CE1 4.3Å; Y261-Y276 AromaticContact CD2-CD1 3.61Å; Y261-Y276 HydrophobicContact CD2-CD1 3.61Å; Y261-Y276 AromaticContact CD2-CE1 3.93Å; Y261-Y276 HydrophobicContact CD2-CE1 3.93Å; Y261-Y276 HydrophobicContact CE1-CE1 4.43Å; Y261-Y276 AromaticContact CE2-CD1 3.8Å; Y261-Y276 HydrophobicContact CE2-CD1 3.8Å; Y261-Y276 HydrophobicContact CE2-CE1 4.12Å; Y261-Y276 WeakPolarHBondContact CE2-O 3.39Å; Y261-Y276 HydrophobicContact CG-CD1 4.14Å; Y261-Y276 HydrophobicContact CG-CE1 4.03Å; G265-Y276 CarbonylContact C-O 3.57Å; G265-Y276 PolarHBondContact O-N 2.59Å; G265-Y276 VanDerWaalsContact O-O 3.08Å; K267-Y276 HydrophobicContact CB-CD1 4.1Å; K267-Y276 HydrophobicContact CB-CG 4.01Å; K267-Y276 HydrophobicContact CD-CD2 3.98Å; K267-Y276 HydrophobicContact CD-CG 3.88Å; K267-Y276 HydrophobicContact CG-CG 4.14Å; Y276-F301 HydrophobicContact CE1-CB 4.27Å; Y276-F301 AromaticContact CE1-CD2 4Å; Y276-F301 HydrophobicContact CE1-CD2 4Å; Y276-F301 PolarHBondContact OH-N 2.72Å; Y276-Q308 HydrophobicContact CE1-CB 3.99Å; Y276-Q308 WeakPolarHBondContact OH-CB 3.32Å; Y276-G309 PolarHBondContact OH-O 2.91Å; Y276-G309 VanDerWaalsContact OH-O 3.11Å; Y276-C311 HydrophobicContact CD2-CB 4.42Å; Y276-C311 HydrophobicContact CE1-CB 4.07Å; Y276-C311 VanDerWaalsContact CE1-SG 3.52Å; Y276-C311 HydrophobicContact CE2-CB 3.71Å; Y276-C311 VanDerWaalsContact CZ-SG 3.58Å
277	G	94.8	Very high	94.6	Very high	42 Å²	42	53 Å²	53	43%	0.433	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.3	-157.5	-179.5	0	0	0	0	0	113.2
278	C	94.7	Very high	94.7	Very high	50 Å²	50	50.6 Å²	50.6	34%	0.338	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	173	175	65.3	0	0	0	0	112.8	Y261 G265 Q308	Y261-C278 PolarHBondContact OH-N 3.31Å; Y261-C278 PolarHBondContact OH-O 2.94Å; G265-C278 VanDerWaalsContact CA-O 3.31Å; G265-C278 WeakPolarHBondContact CA-O 3.31Å; C278-Q308 PolarHBondContact SG-OE1 3.03Å
279	T	95.9	Very high	94.8	Very high	103 Å²	103	50.8 Å²	50.8	63%	0.632	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	146.5	165.6	51.1	0	0	0	0	111.2	G263	G263-T279 CarbonylContact O-C 3.56Å; G263-T279 WeakPolarHBondContact O-CA 3.42Å; G263-T279 VanDerWaalsContact O-CB 3.31Å; G263-T279 WeakPolarHBondContact O-CB 3.47Å
280	F	95.9	Very high	94.8	Very high	17 Å²	17	49.3 Å²	49.3	8%	0.075	29%	0.289	C	S	.	.			trans	-136.3	148.8	173.3	62.8	-102.2	0	0	0	111.4	V219 L239 Y261 G263 D284 V286 V303	V219-F280 HydrophobicContact CG2-CD2 4.19Å; L239-F280 HydrophobicContact CD2-CE2 4.11Å; Y261-F280 AromaticContact CD1-CE1 3.83Å; Y261-F280 HydrophobicContact CD1-CE1 3.83Å; Y261-F280 HydrophobicContact CD2-CE1 4.31Å; Y261-F280 AromaticContact CE1-CD1 3.9Å; Y261-F280 HydrophobicContact CE1-CD1 3.9Å; Y261-F280 AromaticContact CE1-CE1 3.64Å; Y261-F280 HydrophobicContact CE1-CE1 3.64Å; Y261-F280 HydrophobicContact CE2-CD1 4.43Å; Y261-F280 HydrophobicContact CE2-CE1 4.1Å; Y261-F280 HydrophobicContact CG-CE1 4.18Å; Y261-F280 AromaticContact CZ-CD1 3.84Å; Y261-F280 AromaticContact CZ-CE1 3.78Å; G263-F280 VanDerWaalsContact CA-CZ 3.49Å; G263-F280 WeakPolarHBondContact CA-O 3.44Å; G263-F280 PolarHBondContact O-N 3.05Å; F280-D284 WeakPolarHBondContact CA-OD2 3.31Å; F280-D284 HydrophobicContact CB-CB 4.06Å; F280-V286 HydrophobicContact CB-CG2 4.26Å; F280-V286 HydrophobicContact CD1-CG2 3.65Å; F280-V286 HydrophobicContact CD2-CG2 3.57Å; F280-V286 HydrophobicContact CE1-CG1 4.47Å; F280-V286 HydrophobicContact CE1-CG2 3.75Å; F280-V286 HydrophobicContact CE2-CG2 3.69Å; F280-V286 HydrophobicContact CG-CG2 3.56Å; F280-V286 HydrophobicContact CZ-CG2 3.77Å; F280-V303 HydrophobicContact CB-CG1 4.03Å; F280-V303 HydrophobicContact CD1-CG2 4.19Å
281	G	94.1	Very high	94.8	Very high	32 Å²	32	47.1 Å²	47.1	33%	0.33	28%	0.276	S	S	.	.			trans	-149	-156.7	-172.4	0	0	0	0	0	113.5	V219 G283 D284	V219-G281 WeakPolarHBondContact CB-O 3.19Å; V219-G281 WeakPolarHBondContact CG1-O 3.47Å; V219-G281 WeakPolarHBondContact CG2-O 3.38Å; G281-G283 PolarHBondContact O-N 2.97Å; G281-D284 PolarHBondContact N-OD2 3.5Å; G281-D284 WeakPolarHBondContact O-CB 3.27Å; G281-D284 PolarHBondContact O-N 3.06Å; G281-D284 VanDerWaalsContact O-N 3.15Å
282	E	95	Very high	94.9	Very high	104 Å²	104	44.1 Å²	44.1	49%	0.486	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	124	-175.4	171.3	164.2	-170.7	0	0	112.6	K221 N222	K221-E282 WeakPolarHBondContact CA-OE1 3.34Å; K221-E282 WeakPolarHBondContact CB-OE1 3.12Å; N222-E282 VanDerWaalsContact CB-OE2 3.28Å; N222-E282 WeakPolarHBondContact CB-OE2 3.23Å; N222-E282 VanDerWaalsContact CG-OE2 3.22Å; N222-E282 PolarHBondContact N-OE2 2.71Å; N222-E282 WeakPolarHBondContact ND2-CB 3.38Å; N222-E282 PolarHBondContact ND2-OE2 2.91Å
283	G	95.2	Very high	94.7	Very high	53 Å²	53	39.8 Å²	39.8	55%	0.546	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.3	-26	-174.6	0	0	0	0	0	114.2	V219 G281	V219-G283 PolarHBondContact O-N 3.13Å; G281-G283 PolarHBondContact O-N 2.97Å
284	D	97.6	Very high	94.4	Very high	39 Å²	39	44.1 Å²	44.1	21%	0.209	27%	0.27	C	S	.	.			trans	-72	153.3	-175.2	-68.1	-43.5	0	0	0	113.3	R218 V219 F280 G281 N304	R218-D284 WeakPolarHBondContact CA-O 3.5Å; V219-D284 PolarHBondContact N-O 3.39Å; F280-D284 WeakPolarHBondContact CA-OD2 3.31Å; F280-D284 HydrophobicContact CB-CB 4.06Å; G281-D284 PolarHBondContact N-OD2 3.5Å; G281-D284 WeakPolarHBondContact O-CB 3.27Å; G281-D284 PolarHBondContact O-N 3.06Å; G281-D284 VanDerWaalsContact O-N 3.15Å; D284-N304 PolarHBondContact OD1-ND2 2.82Å
285	V	97.4	Very high	94.1	Very high	6 Å²	6	45.4 Å²	45.4	4%	0.036	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.1	170	176.1	0	0	0	0	109.9	E216 V217 R218 V303 N304 W348 F349	E216-V285 HydrophobicContact CB-CG1 3.89Å; E216-V285 HydrophobicContact CG-CG1 4.33Å; V217-V285 WeakPolarHBondContact O-CA 3.38Å; R218-V285 HydrophobicContact CB-CG2 4.02Å; R218-V285 HydrophobicContact CG-CG2 3.93Å; V285-V303 WeakPolarHBondContact O-CA 3.3Å; V285-N304 PolarHBondContact N-OD1 2.84Å; V285-N304 PolarHBondContact O-N 2.91Å; V285-W348 HydrophobicContact CG1-CE3 3.72Å; V285-W348 HydrophobicContact CG1-CZ3 4.42Å; V285-W348 HydrophobicContact CG2-CE3 3.94Å; V285-F349 HydrophobicContact CB-CD2 3.87Å; V285-F349 HydrophobicContact CB-CE2 3.67Å; V285-F349 HydrophobicContact CG1-CD2 3.92Å; V285-F349 HydrophobicContact CG1-CE2 4.24Å; V285-F349 HydrophobicContact CG2-CD2 4.3Å; V285-F349 HydrophobicContact CG2-CE2 3.83Å
286	V	97.5	Very high	93.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.9	173.1	-176.6	0	0	0	0	109	E216 V217 V241 Y261 F280 F301 S302 V303	E216-V286 CarbonylContact C-O 3.51Å; E216-V286 WeakPolarHBondContact CA-O 3.47Å; V217-V286 PolarHBondContact N-O 3.22Å; V217-V286 PolarHBondContact O-N 3.21Å; V241-V286 HydrophobicContact CB-CG1 4.25Å; V241-V286 HydrophobicContact CG2-CB 4.13Å; V241-V286 HydrophobicContact CG2-CG1 4.13Å; Y261-V286 HydrophobicContact CD1-CG1 4.04Å; Y261-V286 HydrophobicContact CE1-CG1 4.2Å; F280-V286 HydrophobicContact CB-CG2 4.26Å; F280-V286 HydrophobicContact CD1-CG2 3.65Å; F280-V286 HydrophobicContact CD2-CG2 3.57Å; F280-V286 HydrophobicContact CE1-CG1 4.47Å; F280-V286 HydrophobicContact CE1-CG2 3.75Å; F280-V286 HydrophobicContact CE2-CG2 3.69Å; F280-V286 HydrophobicContact CG-CG2 3.56Å; F280-V286 HydrophobicContact CZ-CG2 3.77Å; V286-F301 HydrophobicContact CG1-CD1 4.29Å; V286-S302 CarbonylContact C-O 3.46Å; V286-S302 WeakPolarHBondContact CA-O 3.49Å; V286-V303 HydrophobicContact CG2-CG2 4.45Å
287	G	96.9	Very high	93.8	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.8	167.8	0	0	0	0	0	109.8	F289 F301 S302	G287-F289 VanDerWaalsContact C-CE2 3.48Å; G287-F301 CarbonylContact O-C 3.52Å; G287-F301 VanDerWaalsContact O-CA 3.23Å; G287-F301 WeakPolarHBondContact O-CA 3.36Å; G287-S302 PolarHBondContact N-O 3.11Å; G287-S302 PolarHBondContact O-N 2.71Å
288	A	97.1	Very high	93.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.2	176.9	0	0	0	0	0	109.8	F214 F215 V241 F301	F214-A288 WeakPolarHBondContact CA-O 3.2Å; F214-A288 WeakPolarHBondContact CB-O 3.38Å; F215-A288 HydrophobicContact CD1-CB 4.07Å; F215-A288 HydrophobicContact CE1-CB 3.56Å; F215-A288 HydrophobicContact CE2-CB 4.39Å; F215-A288 HydrophobicContact CZ-CB 3.74Å; F215-A288 PolarHBondContact N-O 3.21Å; F215-A288 PolarHBondContact O-N 3.12Å; V241-A288 HydrophobicContact CG1-CB 3.7Å; A288-F301 HydrophobicContact CB-CD1 3.75Å; A288-F301 HydrophobicContact CB-CE1 3.6Å
289	F	95.7	Very high	93.7	Very high	4 Å²	4	37 Å²	37	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.2	-165.6	-62.6	-98.2	0	0	0	110.8	F214 W243 G287 L299 R300 S302 P351 I353 W361	F214-F289 HydrophobicContact CB-CB 4.39Å; F214-F289 HydrophobicContact CB-CD1 3.27Å; F214-F289 HydrophobicContact CB-CE1 3.47Å; F214-F289 VanDerWaalsContact CB-CE1 3.47Å; F214-F289 HydrophobicContact CB-CG 3.83Å; F214-F289 HydrophobicContact CB-CZ 4.22Å; F214-F289 HydrophobicContact CD1-CD1 4.33Å; F214-F289 HydrophobicContact CD1-CE1 4.01Å; F214-F289 HydrophobicContact CD2-CD1 4.39Å; F214-F289 AromaticContact CD2-CE1 3.69Å; F214-F289 HydrophobicContact CD2-CE1 3.69Å; F214-F289 AromaticContact CD2-CZ 3.95Å; F214-F289 HydrophobicContact CD2-CZ 3.95Å; F214-F289 HydrophobicContact CE2-CE1 4.38Å; F214-F289 AromaticContact CG-CD1 3.8Å; F214-F289 HydrophobicContact CG-CD1 3.8Å; F214-F289 AromaticContact CG-CE1 3.47Å; F214-F289 HydrophobicContact CG-CE1 3.47Å; F214-F289 VanDerWaalsContact CG-CE1 3.47Å; F214-F289 HydrophobicContact CG-CZ 4.19Å; W243-F289 PolarHBondContact NE1-O 3.47Å; G287-F289 VanDerWaalsContact C-CE2 3.48Å; F289-L299 WeakPolarHBondContact O-CA 3.49Å; F289-R300 HydrophobicContact CB-CB 4.22Å; F289-R300 PolarHBondContact N-O 3.5Å; F289-R300 PolarHBondContact O-N 3.47Å; F289-R300 VanDerWaalsContact O-N 3.12Å; F289-S302 WeakPolarHBondContact CE2-OG 3.47Å; F289-P351 HydrophobicContact CE1-CB 3.87Å; F289-P351 HydrophobicContact CZ-CB 4.39Å; F289-I353 HydrophobicContact CB-CD1 4.09Å; F289-I353 HydrophobicContact CD1-CD1 3.43Å; F289-I353 VanDerWaalsContact CD1-CD1 3.43Å; F289-I353 HydrophobicContact CD2-CD1 3.56Å; F289-I353 HydrophobicContact CE1-CD1 3.68Å; F289-I353 HydrophobicContact CE1-CG1 4.49Å; F289-I353 HydrophobicContact CE2-CD1 3.77Å; F289-I353 HydrophobicContact CG-CD1 3.4Å; F289-I353 VanDerWaalsContact CG-CD1 3.4Å; F289-I353 HydrophobicContact CZ-CD1 3.84Å; F289-W361 HydrophobicContact CB-CH2 4.12Å; F289-W361 HydrophobicContact CB-CZ3 3.86Å; F289-W361 HydrophobicContact CD1-CD2 4.2Å; F289-W361 AromaticContact CD1-CE3 3.76Å; F289-W361 HydrophobicContact CD1-CE3 3.76Å; F289-W361 HydrophobicContact CD1-CH2 4.44Å; F289-W361 AromaticContact CD1-CZ3 3.89Å; F289-W361 HydrophobicContact CD1-CZ3 3.89Å; F289-W361 HydrophobicContact CG-CZ3 4.38Å
290	I	94.5	Very high	93.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.2	172.5	-177.2	165.5	0	0	0	110.1	K212 S213 W243 W292 A297 L298 L299 L325	K212-I290 WeakPolarHBondContact CA-O 3.18Å; S213-I290 PolarHBondContact N-O 2.65Å; S213-I290 WeakPolarHBondContact O-CG2 2.9Å; S213-I290 PolarHBondContact O-N 2.82Å; S213-I290 WeakPolarHBondContact OG-CG2 3.49Å; W243-I290 HydrophobicContact CD2-CB 4.36Å; W243-I290 HydrophobicContact CD2-CG2 4.43Å; W243-I290 HydrophobicContact CE3-CG2 4.36Å; W243-I290 HydrophobicContact CH2-CB 4.23Å; W243-I290 HydrophobicContact CH2-CG2 3.38Å; W243-I290 HydrophobicContact CZ2-CB 3.81Å; W243-I290 HydrophobicContact CZ2-CG2 3.43Å; W243-I290 VanDerWaalsContact CZ2-CG2 3.43Å; W243-I290 HydrophobicContact CZ3-CG2 3.87Å; I290-W292 HydrophobicContact CD1-CD2 4.17Å; I290-W292 VanDerWaalsContact CD1-CE2 3.45Å; I290-W292 HydrophobicContact CD1-CH2 4.36Å; I290-W292 HydrophobicContact CD1-CZ2 3.58Å; I290-W292 HydrophobicContact CG1-CD2 4.44Å; I290-A297 HydrophobicContact CD1-CB 4.18Å; I290-A297 HydrophobicContact CG1-CB 4.29Å; I290-L298 WeakPolarHBondContact CA-O 3.47Å; I290-L299 HydrophobicContact CB-CD2 3.8Å; I290-L299 HydrophobicContact CD1-CD2 3.76Å; I290-L299 HydrophobicContact CG1-CD2 3.6Å; I290-L325 HydrophobicContact CD1-CB 3.82Å; I290-L325 HydrophobicContact CD1-CD1 3.65Å; I290-L325 HydrophobicContact CD1-CG 4.33Å
291	E	92.4	Very high	93.7	Very high	34 Å²	34	33.5 Å²	33.5	16%	0.159	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.8	170.8	164.4	167	-138.4	0	0	109.2	K212 A297 L298 W361	K212-E291 HydrophobicContact CD-CB 4.42Å; K212-E291 HydrophobicContact CD-CG 4.11Å; K212-E291 WeakPolarHBondContact CD-OE1 3.42Å; K212-E291 WeakPolarHBondContact CE-OE1 3.49Å; K212-E291 HydrophobicContact CG-CB 4.36Å; K212-E291 HydrophobicContact CG-CG 4.18Å; K212-E291 IonicContact NZ-OE1 3.72Å; K212-E291 PolarHBondContact NZ-OE1 3.06Å; E291-A297 WeakPolarHBondContact O-CA 3.33Å; E291-L298 HydrophobicContact CB-CB 4.3Å; E291-L298 PolarHBondContact N-O 3.14Å; E291-L298 PolarHBondContact O-N 2.99Å; E291-W361 HydrophobicContact CB-CH2 3.83Å; E291-W361 HydrophobicContact CB-CZ3 4.49Å
292	W	91	Very high	93.8	Very high	21 Å²	21	32.5 Å²	32.5	8%	0.08	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	111.5	176	-70.1	107.7	0	0	0	111.3	S208 S210 G211 I290 A297 K316 L319 S323 L325	S208-W292 WeakPolarHBondContact O-CZ2 3.46Å; S208-W292 PolarHBondContact OG-NE1 3.33Å; S210-W292 VanDerWaalsContact N-CD1 3.28Å; G211-W292 WeakPolarHBondContact O-CB 3.48Å; G211-W292 PolarHBondContact O-N 3.38Å; I290-W292 HydrophobicContact CD1-CD2 4.17Å; I290-W292 VanDerWaalsContact CD1-CE2 3.45Å; I290-W292 HydrophobicContact CD1-CH2 4.36Å; I290-W292 HydrophobicContact CD1-CZ2 3.58Å; I290-W292 HydrophobicContact CG1-CD2 4.44Å; W292-A297 HydrophobicContact CD2-CB 4.28Å; W292-A297 HydrophobicContact CE3-CB 3.64Å; W292-A297 HydrophobicContact CH2-CB 4.18Å; W292-A297 HydrophobicContact CZ3-CB 3.62Å; W292-K316 HydrophobicContact CE3-CD 4.37Å; W292-K316 HydrophobicContact CE3-CG 4.23Å; W292-K316 HydrophobicContact CZ3-CD 4.39Å; W292-K316 HydrophobicContact CZ3-CG 3.84Å; W292-L319 HydrophobicContact CH2-CD1 3.6Å; W292-L319 HydrophobicContact CZ3-CD1 3.9Å; W292-S323 WeakPolarHBondContact CH2-O 3.41Å; W292-L325 HydrophobicContact CH2-CB 4.46Å; W292-L325 HydrophobicContact CH2-CD1 3.91Å; W292-L325 HydrophobicContact CH2-CG 4.02Å; W292-L325 HydrophobicContact CZ2-CB 4.01Å; W292-L325 HydrophobicContact CZ2-CD1 4.1Å; W292-L325 HydrophobicContact CZ2-CG 4.08Å
293	T	87.6	Confident	93.9	Very high	48 Å²	48	28 Å²	28	29%	0.294	16%	0.161	S	C	.	.			trans	-82.6	-176.9	164.2	74.8	0	0	0	0	110.5	V295 E296 L298 K316	T293-V295 VanDerWaalsContact C-N 3.25Å; T293-V295 PolarHBondContact O-N 2.72Å; T293-V295 PolarHBondContact OG1-N 3.29Å; T293-E296 WeakPolarHBondContact CB-O 3.44Å; T293-E296 HydrophobicContact CG2-CG 4.35Å; T293-E296 PolarHBondContact N-O 3.19Å; T293-E296 VanDerWaalsContact OG1-CG 3.31Å; T293-E296 WeakPolarHBondContact OG1-CG 3.36Å; T293-E296 PolarHBondContact OG1-N 3.26Å; T293-E296 PolarHBondContact OG1-O 2.67Å; T293-L298 HydrophobicContact CG2-CD1 4.38Å; T293-K316 WeakPolarHBondContact O-CE 3.49Å; T293-K316 PolarHBondContact O-NZ 2.71Å
294	N	83.4	Confident	93.9	Very high	161 Å²	161	28.3 Å²	28.3	86%	0.861	15%	0.15	S	C	*	.	S	Bend	trans	-65.6	-26	173.6	-68.1	-16.3	0	0	0	113.3
295	V	88.4	Confident	93.6	Very high	98 Å²	98	26.9 Å²	26.9	59%	0.594	15%	0.145	S	C	*	.	S	Bend	trans	-120.7	-28.9	-169.8	-175.8	0	0	0	0	113.1	T293 K316	T293-V295 VanDerWaalsContact C-N 3.25Å; T293-V295 PolarHBondContact O-N 2.72Å; T293-V295 PolarHBondContact OG1-N 3.29Å; V295-K316 WeakPolarHBondContact O-CB 3.41Å; V295-K316 PolarHBondContact O-N 2.64Å
296	E	91.5	Very high	93.5	Very high	38 Å²	38	31 Å²	31	18%	0.178	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	154.9	-172.4	57.5	-177.8	-155.6	0	0	113.7	T293 R313 V314	T293-E296 WeakPolarHBondContact CB-O 3.44Å; T293-E296 HydrophobicContact CG2-CG 4.35Å; T293-E296 PolarHBondContact N-O 3.19Å; T293-E296 VanDerWaalsContact OG1-CG 3.31Å; T293-E296 WeakPolarHBondContact OG1-CG 3.36Å; T293-E296 PolarHBondContact OG1-N 3.26Å; T293-E296 PolarHBondContact OG1-O 2.67Å; E296-R313 VanDerWaalsContact CD-CG 3.5Å; E296-R313 HydrophobicContact CG-CG 4.46Å; E296-R313 WeakPolarHBondContact OE1-CD 3.34Å; E296-R313 IonicContact OE1-CZ 3.26Å; E296-R313 IonicContact OE1-NE 2.87Å; E296-R313 IonicContact OE1-NH1 3.98Å; E296-R313 PolarHBondContact OE1-NH1 3.17Å; E296-R313 VanDerWaalsContact OE2-CD 3.3Å; E296-R313 WeakPolarHBondContact OE2-CD 3.46Å; E296-R313 WeakPolarHBondContact OE2-CG 3.35Å; E296-V314 CarbonylContact C-O 3.53Å; E296-V314 WeakPolarHBondContact CA-O 3.48Å; E296-V314 WeakPolarHBondContact CB-O 3.45Å
297	A	92.5	Very high	93.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.3	164.4	0	0	0	0	0	110.2	I290 E291 W292 L299 R313 V314 L325	I290-A297 HydrophobicContact CD1-CB 4.18Å; I290-A297 HydrophobicContact CG1-CB 4.29Å; E291-A297 WeakPolarHBondContact O-CA 3.33Å; W292-A297 HydrophobicContact CD2-CB 4.28Å; W292-A297 HydrophobicContact CE3-CB 3.64Å; W292-A297 HydrophobicContact CH2-CB 4.18Å; W292-A297 HydrophobicContact CZ3-CB 3.62Å; A297-L299 HydrophobicContact CB-CD2 4.4Å; A297-R313 WeakPolarHBondContact O-CA 3.2Å; A297-V314 HydrophobicContact CB-CB 4.46Å; A297-V314 PolarHBondContact N-O 2.68Å; A297-V314 PolarHBondContact O-N 2.76Å; A297-L325 HydrophobicContact CB-CD1 4.17Å
298	L	93.6	Very high	93.2	Very high	19 Å²	19	34.9 Å²	34.9	10%	0.099	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.9	169.3	-60.7	174.2	0	0	0	108.7	I290 E291 T293 R313	I290-L298 WeakPolarHBondContact CA-O 3.47Å; E291-L298 HydrophobicContact CB-CB 4.3Å; E291-L298 PolarHBondContact N-O 3.14Å; E291-L298 PolarHBondContact O-N 2.99Å; T293-L298 HydrophobicContact CG2-CD1 4.38Å; L298-R313 HydrophobicContact CD2-CB 4.06Å; L298-R313 HydrophobicContact CD2-CG 3.74Å
299	L	95.4	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.7	-179.6	-52.8	-174.3	0	0	0	110	W243 F259 F289 I290 A297 C311 F312 V314 L325	W243-L299 HydrophobicContact CB-CD1 4.29Å; W243-L299 HydrophobicContact CG-CD1 4.47Å; W243-L299 HydrophobicContact CG-CD2 4.21Å; F259-L299 HydrophobicContact CB-CD1 3.62Å; F259-L299 HydrophobicContact CD2-CD1 3.97Å; F259-L299 HydrophobicContact CG-CD1 3.83Å; F289-L299 WeakPolarHBondContact O-CA 3.49Å; I290-L299 HydrophobicContact CB-CD2 3.8Å; I290-L299 HydrophobicContact CD1-CD2 3.76Å; I290-L299 HydrophobicContact CG1-CD2 3.6Å; A297-L299 HydrophobicContact CB-CD2 4.4Å; L299-C311 WeakPolarHBondContact O-CA 3.47Å; L299-C311 VanDerWaalsContact O-CB 3.24Å; L299-C311 WeakPolarHBondContact O-CB 3.47Å; L299-C311 PolarHBondContact O-N 3.01Å; L299-F312 HydrophobicContact CB-CB 4.18Å; L299-F312 HydrophobicContact CD1-CB 4.16Å; L299-F312 HydrophobicContact CD1-CD2 4.38Å; L299-F312 HydrophobicContact CG-CB 4.36Å; L299-F312 PolarHBondContact N-O 2.72Å; L299-F312 PolarHBondContact O-N 3.27Å; L299-V314 HydrophobicContact CD1-CG2 4.42Å; L299-L325 HydrophobicContact CD2-CD1 4.42Å
300	R	95.4	Very high	92.9	Very high	46 Å²	46	39.7 Å²	39.7	17%	0.174	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	163.2	176.1	-56.6	-161.1	-171.9	-175.2	9.4	111.2	F289 D307 G309 I353	F289-R300 HydrophobicContact CB-CB 4.22Å; F289-R300 PolarHBondContact N-O 3.5Å; F289-R300 PolarHBondContact O-N 3.47Å; F289-R300 VanDerWaalsContact O-N 3.12Å; R300-D307 IonicContact NH1-OD2 3.12Å; R300-D307 PolarHBondContact NH1-OD2 3.41Å; R300-G309 WeakPolarHBondContact CB-O 3.49Å; R300-G309 WeakPolarHBondContact CG-O 3.41Å; R300-I353 HydrophobicContact CB-CD1 4.44Å
301	F	96.6	Very high	92.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	145.5	175.6	-64.1	-88.3	0	0	0	110.6	V241 Y261 Y276 V286 G287 A288 Q308 C311	V241-F301 HydrophobicContact CB-CE1 4.48Å; V241-F301 VanDerWaalsContact O-CE1 3.3Å; V241-F301 WeakPolarHBondContact O-CE1 3.2Å; Y261-F301 HydrophobicContact CD1-CB 3.51Å; Y261-F301 AromaticContact CD1-CD1 3.75Å; Y261-F301 HydrophobicContact CD1-CD1 3.75Å; Y261-F301 HydrophobicContact CD1-CD2 4.14Å; Y261-F301 AromaticContact CD1-CG 3.53Å; Y261-F301 HydrophobicContact CD1-CG 3.53Å; Y261-F301 HydrophobicContact CE1-CB 3.9Å; Y261-F301 HydrophobicContact CE1-CG 4.41Å; Y261-F301 HydrophobicContact CG-CB 4.37Å; Y261-F301 HydrophobicContact CG-CD1 4.33Å; Y261-F301 HydrophobicContact CG-CD2 4.22Å; Y261-F301 HydrophobicContact CG-CG 4.05Å; Y276-F301 HydrophobicContact CE1-CB 4.27Å; Y276-F301 AromaticContact CE1-CD2 4Å; Y276-F301 HydrophobicContact CE1-CD2 4Å; Y276-F301 PolarHBondContact OH-N 2.72Å; V286-F301 HydrophobicContact CG1-CD1 4.29Å; G287-F301 CarbonylContact O-C 3.52Å; G287-F301 VanDerWaalsContact O-CA 3.23Å; G287-F301 WeakPolarHBondContact O-CA 3.36Å; A288-F301 HydrophobicContact CB-CD1 3.75Å; A288-F301 HydrophobicContact CB-CE1 3.6Å; F301-Q308 VanDerWaalsContact O-CB 3.26Å; F301-Q308 WeakPolarHBondContact O-CB 3.31Å; F301-Q308 WeakPolarHBondContact O-CG 3.44Å; F301-Q308 PolarHBondContact O-N 3.12Å; F301-C311 HydrophobicContact CD2-CB 3.65Å; F301-C311 HydrophobicContact CE2-CB 3.77Å; F301-C311 VanDerWaalsContact CE2-SG 3.56Å
302	S	96.1	Very high	93.1	Very high	11 Å²	11	39.5 Å²	39.5	8%	0.077	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	151.6	167.3	71.3	0	0	0	0	110.7	V286 G287 F289 V306	V286-S302 CarbonylContact C-O 3.46Å; V286-S302 WeakPolarHBondContact CA-O 3.49Å; G287-S302 PolarHBondContact N-O 3.11Å; G287-S302 PolarHBondContact O-N 2.71Å; F289-S302 WeakPolarHBondContact CE2-OG 3.47Å; S302-V306 CarbonylContact C-O 3.15Å; S302-V306 WeakPolarHBondContact CA-O 3.43Å; S302-V306 WeakPolarHBondContact CB-O 3.4Å
303	V	96.7	Very high	93.2	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.055	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124.7	168.1	-177.6	0	0	0	0	108.1	Y261 F280 V285 V286 G305 V306 Q308	Y261-V303 HydrophobicContact CE1-CG2 3.79Å; Y261-V303 WeakPolarHBondContact OH-CG2 3.36Å; F280-V303 HydrophobicContact CB-CG1 4.03Å; F280-V303 HydrophobicContact CD1-CG2 4.19Å; V285-V303 WeakPolarHBondContact O-CA 3.3Å; V286-V303 HydrophobicContact CG2-CG2 4.45Å; V303-G305 PolarHBondContact O-N 2.62Å; V303-G305 VanDerWaalsContact O-N 3.16Å; V303-V306 PolarHBondContact N-O 3.06Å; V303-V306 WeakPolarHBondContact O-CB 3.47Å; V303-V306 PolarHBondContact O-N 2.95Å; V303-Q308 HydrophobicContact CG2-CG 4.14Å
304	N	95.5	Very high	93.5	Very high	59 Å²	59	42.6 Å²	42.6	32%	0.316	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	41.6	-176.4	-58	-32.3	0	0	0	113.2	D284 V285 V306 F349	D284-N304 PolarHBondContact OD1-ND2 2.82Å; V285-N304 PolarHBondContact N-OD1 2.84Å; V285-N304 PolarHBondContact O-N 2.91Å; N304-V306 VanDerWaalsContact C-N 3.34Å; N304-V306 PolarHBondContact O-N 3.34Å; N304-F349 VanDerWaalsContact C-CE1 3.45Å; N304-F349 HydrophobicContact CB-CE1 4.1Å; N304-F349 HydrophobicContact CB-CE2 4.41Å; N304-F349 HydrophobicContact CB-CZ 3.88Å; N304-F349 VanDerWaalsContact O-CD1 3.29Å; N304-F349 WeakPolarHBondContact O-CD1 3.45Å; N304-F349 VanDerWaalsContact O-CE1 3.26Å; N304-F349 WeakPolarHBondContact O-CE1 3.42Å
305	G	91.7	Very high	93.8	Very high	9 Å²	9	39.2 Å²	39.2	9%	0.093	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	1.9	-179.4	0	0	0	0	0	116.3	V303 N352	V303-G305 PolarHBondContact O-N 2.62Å; V303-G305 VanDerWaalsContact O-N 3.16Å; G305-N352 PolarHBondContact O-ND2 2.86Å
306	V	93.8	Very high	93.9	Very high	92 Å²	92	37.1 Å²	37.1	56%	0.558	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.7	176.7	-175.2	0	0	0	0	110	S302 V303 N304 Q308	S302-V306 CarbonylContact C-O 3.15Å; S302-V306 WeakPolarHBondContact CA-O 3.43Å; S302-V306 WeakPolarHBondContact CB-O 3.4Å; V303-V306 PolarHBondContact N-O 3.06Å; V303-V306 WeakPolarHBondContact O-CB 3.47Å; V303-V306 PolarHBondContact O-N 2.95Å; N304-V306 VanDerWaalsContact C-N 3.34Å; N304-V306 PolarHBondContact O-N 3.34Å; V306-Q308 PolarHBondContact O-NE2 2.76Å
307	D	94.1	Very high	93.6	Very high	42 Å²	42	39.9 Å²	39.9	23%	0.225	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	134.9	175.5	-169.8	5.4	0	0	0	110.8	R300 G309 I353	R300-D307 IonicContact NH1-OD2 3.12Å; R300-D307 PolarHBondContact NH1-OD2 3.41Å; D307-G309 PolarHBondContact OD1-N 3.11Å; D307-I353 HydrophobicContact CB-CG1 4.38Å
308	Q	94.8	Very high	93.3	Very high	42 Å²	42	45.1 Å²	45.1	20%	0.196	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-2.2	176.4	-54.1	-59.3	-67.3	0	0	112.2	Y261 Y276 C278 F301 V303 V306	Y261-Q308 HydrophobicContact CE1-CG 4.41Å; Y276-Q308 HydrophobicContact CE1-CB 3.99Å; Y276-Q308 WeakPolarHBondContact OH-CB 3.32Å; C278-Q308 PolarHBondContact SG-OE1 3.03Å; F301-Q308 VanDerWaalsContact O-CB 3.26Å; F301-Q308 WeakPolarHBondContact O-CB 3.31Å; F301-Q308 WeakPolarHBondContact O-CG 3.44Å; F301-Q308 PolarHBondContact O-N 3.12Å; V303-Q308 HydrophobicContact CG2-CG 4.14Å; V306-Q308 PolarHBondContact O-NE2 2.76Å
309	G	92.8	Very high	92.8	Very high	24 Å²	24	44.6 Å²	44.6	25%	0.247	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	98.9	-163.5	174.6	0	0	0	0	0	114.4	Y276 R300 D307 C311	Y276-G309 PolarHBondContact OH-O 2.91Å; Y276-G309 VanDerWaalsContact OH-O 3.11Å; R300-G309 WeakPolarHBondContact CB-O 3.49Å; R300-G309 WeakPolarHBondContact CG-O 3.41Å; D307-G309 PolarHBondContact OD1-N 3.11Å; G309-C311 PolarHBondContact O-N 2.87Å
310	E	93.8	Very high	91.8	Very high	81 Å²	81	46.5 Å²	46.5	38%	0.379	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	116.6	176.8	-168.7	174.9	131.4	0	0	110.7	R313	E310-R313 VanDerWaalsContact CD-NH2 3.27Å; E310-R313 IonicContact OE1-CZ 3.08Å; E310-R313 VanDerWaalsContact OE1-CZ 3.31Å; E310-R313 IonicContact OE1-NE 2.72Å; E310-R313 PolarHBondContact OE1-NE 3.49Å; E310-R313 IonicContact OE1-NH2 2.68Å; E310-R313 PolarHBondContact OE1-NH2 2.71Å; E310-R313 IonicContact OE2-CZ 2.71Å; E310-R313 IonicContact OE2-NE 3.76Å; E310-R313 IonicContact OE2-NH2 2.76Å; E310-R313 PolarHBondContact OE2-NH2 3.08Å
311	C	94.6	Very high	90.4	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.02	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-53.2	-177.3	-160.9	0	0	0	0	111.3	K267 Y276 L299 F301 G309	K267-C311 VanDerWaalsContact CB-SG 3.51Å; K267-C311 WeakPolarHBondContact CD-O 3.4Å; K267-C311 VanDerWaalsContact CD-SG 3.52Å; K267-C311 PolarHBondContact NZ-O 2.71Å; Y276-C311 HydrophobicContact CD2-CB 4.42Å; Y276-C311 HydrophobicContact CE1-CB 4.07Å; Y276-C311 VanDerWaalsContact CE1-SG 3.52Å; Y276-C311 HydrophobicContact CE2-CB 3.71Å; Y276-C311 VanDerWaalsContact CZ-SG 3.58Å; L299-C311 WeakPolarHBondContact O-CA 3.47Å; L299-C311 VanDerWaalsContact O-CB 3.24Å; L299-C311 WeakPolarHBondContact O-CB 3.47Å; L299-C311 PolarHBondContact O-N 3.01Å; F301-C311 HydrophobicContact CD2-CB 3.65Å; F301-C311 HydrophobicContact CE2-CB 3.77Å; F301-C311 VanDerWaalsContact CE2-SG 3.56Å; G309-C311 PolarHBondContact O-N 2.87Å
312	F	95.5	Very high	89	Confident	26 Å²	26	60.5 Å²	60.5	11%	0.114	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	151.7	179.2	-59.8	-77.7	0	0	0	111.2	F259 K267 T269 L299 V314	F259-F312 HydrophobicContact CB-CD2 3.79Å; F259-F312 HydrophobicContact CB-CE2 3.9Å; F259-F312 HydrophobicContact CB-CG 4.39Å; F259-F312 HydrophobicContact CD1-CB 4.35Å; F259-F312 HydrophobicContact CD1-CD1 4.05Å; F259-F312 HydrophobicContact CD1-CD2 4.17Å; F259-F312 HydrophobicContact CD1-CE1 4.36Å; F259-F312 HydrophobicContact CD1-CE2 4.46Å; F259-F312 AromaticContact CD1-CG 3.95Å; F259-F312 HydrophobicContact CD1-CG 3.95Å; F259-F312 HydrophobicContact CG-CD2 4.37Å; K267-F312 HydrophobicContact CB-CE2 4.03Å; K267-F312 HydrophobicContact CB-CZ 3.77Å; K267-F312 HydrophobicContact CD-CE1 4.16Å; K267-F312 HydrophobicContact CD-CE2 4.47Å; K267-F312 HydrophobicContact CD-CZ 4.07Å; K267-F312 HydrophobicContact CG-CE1 4.39Å; K267-F312 HydrophobicContact CG-CZ 4.01Å; T269-F312 HydrophobicContact CG2-CD1 4.38Å; T269-F312 HydrophobicContact CG2-CE1 3.58Å; T269-F312 HydrophobicContact CG2-CZ 4.18Å; L299-F312 HydrophobicContact CB-CB 4.18Å; L299-F312 HydrophobicContact CD1-CB 4.16Å; L299-F312 HydrophobicContact CD1-CD2 4.38Å; L299-F312 HydrophobicContact CG-CB 4.36Å; L299-F312 PolarHBondContact N-O 2.72Å; L299-F312 PolarHBondContact O-N 3.27Å; F312-V314 HydrophobicContact CB-CG2 4.21Å
313	R	94.6	Very high	88	Confident	131 Å²	131	61.7 Å²	61.7	49%	0.494	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.5	173.8	179.3	176.6	-61.5	-122.2	7	107.4	E296 A297 L298 E310	E296-R313 VanDerWaalsContact CD-CG 3.5Å; E296-R313 HydrophobicContact CG-CG 4.46Å; E296-R313 WeakPolarHBondContact OE1-CD 3.34Å; E296-R313 IonicContact OE1-CZ 3.26Å; E296-R313 IonicContact OE1-NE 2.87Å; E296-R313 IonicContact OE1-NH1 3.98Å; E296-R313 PolarHBondContact OE1-NH1 3.17Å; E296-R313 VanDerWaalsContact OE2-CD 3.3Å; E296-R313 WeakPolarHBondContact OE2-CD 3.46Å; E296-R313 WeakPolarHBondContact OE2-CG 3.35Å; A297-R313 WeakPolarHBondContact O-CA 3.2Å; L298-R313 HydrophobicContact CD2-CB 4.06Å; L298-R313 HydrophobicContact CD2-CG 3.74Å; E310-R313 VanDerWaalsContact CD-NH2 3.27Å; E310-R313 IonicContact OE1-CZ 3.08Å; E310-R313 VanDerWaalsContact OE1-CZ 3.31Å; E310-R313 IonicContact OE1-NE 2.72Å; E310-R313 PolarHBondContact OE1-NE 3.49Å; E310-R313 IonicContact OE1-NH2 2.68Å; E310-R313 PolarHBondContact OE1-NH2 2.71Å; E310-R313 IonicContact OE2-CZ 2.71Å; E310-R313 IonicContact OE2-NE 3.76Å; E310-R313 IonicContact OE2-NH2 2.76Å; E310-R313 PolarHBondContact OE2-NH2 3.08Å
314	V	92.5	Very high	87.8	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.024	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.9	-166.1	-171.8	0	0	0	0	109.5	F259 E296 A297 L299 F312 L319	F259-V314 HydrophobicContact CD1-CG2 4.23Å; F259-V314 HydrophobicContact CD2-CG2 4.37Å; F259-V314 HydrophobicContact CE1-CG2 3.76Å; F259-V314 HydrophobicContact CE2-CG1 4.07Å; F259-V314 HydrophobicContact CE2-CG2 3.91Å; F259-V314 HydrophobicContact CZ-CB 4.34Å; F259-V314 HydrophobicContact CZ-CG1 3.74Å; F259-V314 HydrophobicContact CZ-CG2 3.58Å; E296-V314 CarbonylContact C-O 3.53Å; E296-V314 WeakPolarHBondContact CA-O 3.48Å; E296-V314 WeakPolarHBondContact CB-O 3.45Å; A297-V314 HydrophobicContact CB-CB 4.46Å; A297-V314 PolarHBondContact N-O 2.68Å; A297-V314 PolarHBondContact O-N 2.76Å; L299-V314 HydrophobicContact CD1-CG2 4.42Å; F312-V314 HydrophobicContact CB-CG2 4.21Å; V314-L319 HydrophobicContact CG1-CD2 3.85Å; V314-L319 HydrophobicContact CG1-CG 4.18Å
315	Q	91	Very high	87.8	Confident	90 Å²	90	58.7 Å²	58.7	42%	0.421	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	136.7	180	-61.2	174.1	-10.3	0	0	110.4	S317 Q318	Q315-S317 WeakPolarHBondContact CB-OG 3.28Å; Q315-S317 PolarHBondContact O-N 2.75Å; Q315-Q318 HydrophobicContact CB-CG 4.04Å; Q315-Q318 VanDerWaalsContact CD-NE2 3.32Å; Q315-Q318 WeakPolarHBondContact O-CB 3.19Å; Q315-Q318 PolarHBondContact O-N 2.69Å
316	K	88.7	Confident	88	Confident	53 Å²	53	58.5 Å²	58.5	23%	0.23	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-57.1	-35.2	177.6	-77.6	179.2	167.7	178.4	0	112.4	W292 T293 V295 Q318 L319	W292-K316 HydrophobicContact CE3-CD 4.37Å; W292-K316 HydrophobicContact CE3-CG 4.23Å; W292-K316 HydrophobicContact CZ3-CD 4.39Å; W292-K316 HydrophobicContact CZ3-CG 3.84Å; T293-K316 WeakPolarHBondContact O-CE 3.49Å; T293-K316 PolarHBondContact O-NZ 2.71Å; V295-K316 WeakPolarHBondContact O-CB 3.41Å; V295-K316 PolarHBondContact O-N 2.64Å; K316-Q318 PolarHBondContact O-N 3Å; K316-L319 PolarHBondContact O-N 3.28Å
317	S	86.7	Confident	88.2	Confident	96 Å²	96	54.3 Å²	54.3	67%	0.671	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-57.4	-25.4	173.1	50.6	0	0	0	0	114.4	Q315	Q315-S317 WeakPolarHBondContact CB-OG 3.28Å; Q315-S317 PolarHBondContact O-N 2.75Å
318	Q	85.4	Confident	88.4	Confident	110 Å²	110	52.3 Å²	52.3	51%	0.514	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-87.3	-9.3	179.3	-60.5	171.3	13.7	0	0	113	Q257 Q315 K316	Q257-Q318 PolarHBondContact NE2-O 3.35Å; Q315-Q318 HydrophobicContact CB-CG 4.04Å; Q315-Q318 VanDerWaalsContact CD-NE2 3.32Å; Q315-Q318 WeakPolarHBondContact O-CB 3.19Å; Q315-Q318 PolarHBondContact O-N 2.69Å; K316-Q318 PolarHBondContact O-N 3Å
319	L	82.8	Confident	88.5	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.042	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-12.6	180	-60.8	178.2	0	0	0	113.3	T245 Q257 W292 V314 K316 L325	T245-L319 HydrophobicContact CG2-CD2 3.82Å; Q257-L319 HydrophobicContact CG-CD2 4.49Å; W292-L319 HydrophobicContact CH2-CD1 3.6Å; W292-L319 HydrophobicContact CZ3-CD1 3.9Å; V314-L319 HydrophobicContact CG1-CD2 3.85Å; V314-L319 HydrophobicContact CG1-CG 4.18Å; K316-L319 PolarHBondContact O-N 3.28Å; L319-L325 HydrophobicContact CD1-CD1 4.18Å; L319-L325 HydrophobicContact CD1-CG 4.19Å; L319-L325 HydrophobicContact CD2-CD2 4.2Å
320	G	75.6	Confident	88.7	Confident	41 Å²	41	49.3 Å²	49.3	42%	0.423	25%	0.251	S	S	.	.			trans	77.6	-172.2	-177.6	0	0	0	0	0	113.8	H322 S323	G320-H322 PolarHBondContact O-N 2.86Å; G320-H322 VanDerWaalsContact O-N 3.15Å; G320-S323 PolarHBondContact O-OG 3.06Å
321	E	65	Low	88.7	Confident	188 Å²	188	45.5 Å²	45.5	88%	0.879	23%	0.233	S	C	*	.	S	Bend	trans	-61.8	-22.1	-172.7	-59.8	-175	162.2	0	0	114.1
322	H	66.6	Low	88.6	Confident	151 Å²	151	45.5 Å²	45.5	70%	0.699	23%	0.233	S	C	*	.	S	Bend	trans	-112.1	68.9	178	-59.7	-18.5	0	0	0	109.3	G320 A324	G320-H322 PolarHBondContact O-N 2.86Å; G320-H322 VanDerWaalsContact O-N 3.15Å; H322-A324 PolarHBondContact O-N 2.77Å
323	S	76.7	Confident	88.5	Confident	36 Å²	36	44.3 Å²	44.3	25%	0.252	23%	0.227	S	C	.	.			trans	-72.3	41	-170.5	-34.1	0	0	0	0	114.7	W292 G320	W292-S323 WeakPolarHBondContact CH2-O 3.41Å; G320-S323 PolarHBondContact O-OG 3.06Å
324	A	92.1	Very high	88.5	Confident	5 Å²	5	38.1 Å²	38.1	4%	0.041	20%	0.204	C	C	.	.			trans	-95.1	136.7	-179.9	0	0	0	0	0	111.9	S208 I209 H322 F326 V373	S208-A324 WeakPolarHBondContact O-CA 3.31Å; I209-A324 HydrophobicContact CG2-CB 3.58Å; H322-A324 PolarHBondContact O-N 2.77Å; A324-F326 HydrophobicContact CB-CE2 3.85Å; A324-F326 HydrophobicContact CB-CZ 4.45Å; A324-V373 HydrophobicContact CB-CB 4.07Å; A324-V373 HydrophobicContact CB-CG2 4.26Å
325	L	95.2	Very high	88.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-114.2	121.2	173.8	-74.9	176.3	0	0	0	110.5	G207 S208 W243 T245 F259 I290 W292 A297 L299 L319	G207-L325 CarbonylContact C-O 3.57Å; G207-L325 VanDerWaalsContact CA-O 3.28Å; G207-L325 WeakPolarHBondContact CA-O 3.34Å; S208-L325 PolarHBondContact N-O 3.4Å; S208-L325 PolarHBondContact O-N 2.89Å; W243-L325 HydrophobicContact CB-CB 4.32Å; W243-L325 HydrophobicContact CE3-CB 4.34Å; T245-L325 HydrophobicContact CG2-CD2 3.96Å; F259-L325 HydrophobicContact CD2-CD2 4.47Å; F259-L325 HydrophobicContact CE2-CD2 4.41Å; I290-L325 HydrophobicContact CD1-CB 3.82Å; I290-L325 HydrophobicContact CD1-CD1 3.65Å; I290-L325 HydrophobicContact CD1-CG 4.33Å; W292-L325 HydrophobicContact CH2-CB 4.46Å; W292-L325 HydrophobicContact CH2-CD1 3.91Å; W292-L325 HydrophobicContact CH2-CG 4.02Å; W292-L325 HydrophobicContact CZ2-CB 4.01Å; W292-L325 HydrophobicContact CZ2-CD1 4.1Å; W292-L325 HydrophobicContact CZ2-CG 4.08Å; A297-L325 HydrophobicContact CB-CD1 4.17Å; L299-L325 HydrophobicContact CD2-CD1 4.42Å; L319-L325 HydrophobicContact CD1-CD1 4.18Å; L319-L325 HydrophobicContact CD1-CG 4.19Å; L319-L325 HydrophobicContact CD2-CD2 4.2Å
326	F	96.6	Very high	89	Confident	6 Å²	6	34.4 Å²	34.4	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	134.9	-175.5	-68.4	-101.6	0	0	0	110.7	R203 W243 S244 E246 A324 H328	R203-F326 HydrophobicContact CB-CB 4.36Å; R203-F326 HydrophobicContact CG-CB 4.42Å; W243-F326 WeakPolarHBondContact CA-O 3.4Å; S244-F326 PolarHBondContact N-O 3.33Å; S244-F326 VanDerWaalsContact N-O 3.15Å; S244-F326 PolarHBondContact O-N 2.83Å; E246-F326 HydrophobicContact CB-CE2 3.97Å; E246-F326 HydrophobicContact CB-CZ 4.49Å; A324-F326 HydrophobicContact CB-CE2 3.85Å; A324-F326 HydrophobicContact CB-CZ 4.45Å; F326-H328 PolarHBondContact O-N 2.7Å
327	P	97.5	Very high	89.4	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.019	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	126.2	165.5	-26.3	34.9	0	0	0	110.4	R203 A204 Y206 F215 W243 F340 M364	R203-P327 CarbonylContact C-O 3.54Å; R203-P327 WeakPolarHBondContact CA-O 3.35Å; A204-P327 HydrophobicContact CB-CB 3.85Å; A204-P327 HydrophobicContact CB-CG 3.94Å; A204-P327 PolarHBondContact N-O 2.9Å; Y206-P327 VanDerWaalsContact O-CD 3.27Å; Y206-P327 WeakPolarHBondContact O-CD 3.25Å; F215-P327 HydrophobicContact CD1-CB 3.76Å; F215-P327 HydrophobicContact CD1-CG 3.97Å; F215-P327 HydrophobicContact CD2-CB 4.25Å; F215-P327 HydrophobicContact CE1-CB 3.51Å; F215-P327 HydrophobicContact CE1-CG 4.06Å; F215-P327 HydrophobicContact CE2-CB 4.01Å; F215-P327 HydrophobicContact CG-CB 4.14Å; F215-P327 HydrophobicContact CG-CG 4.49Å; F215-P327 HydrophobicContact CZ-CB 3.64Å; W243-P327 HydrophobicContact CE3-CG 4.31Å; W243-P327 HydrophobicContact CH2-CG 4.21Å; W243-P327 HydrophobicContact CZ3-CB 4.47Å; W243-P327 HydrophobicContact CZ3-CG 3.68Å; P327-F340 HydrophobicContact CB-CE1 3.9Å; P327-F340 HydrophobicContact CG-CE1 4.23Å; P327-M364 HydrophobicContact CG-CE 3.93Å; P327-M364 HydrophobicContact CG-CG 4.03Å; P327-M364 HydrophobicContact CG-SD 4.31Å
328	H	97.7	Very high	89.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	131.7	-174.7	-163.1	158	0	0	0	109.6	V202 R203 G242 S244 L252 F326	V202-H328 WeakPolarHBondContact O-CA 3.49Å; V202-H328 PolarHBondContact O-CD2 3.2Å; V202-H328 VanDerWaalsContact O-CD2 3.27Å; R203-H328 HydrophobicContact CG-CB 4.28Å; G242-H328 PolarHBondContact N-O 3.4Å; G242-H328 PolarHBondContact O-N 2.91Å; S244-H328 PolarHBondContact OG-ND1 3.27Å; L252-H328 HydrophobicContact CD1-CB 4.03Å; L252-H328 HydrophobicContact CD2-CB 4.34Å; L252-H328 WeakPolarHBondContact CD2-O 3.39Å; F326-H328 PolarHBondContact O-N 2.7Å
329	V	97.7	Very high	90.4	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.2	172.2	-176.4	0	0	0	0	109.7	G201 V202 F215 V217 L239 R240 F336	G201-V329 CarbonylContact C-O 3.51Å; G201-V329 WeakPolarHBondContact CA-O 3.26Å; V202-V329 HydrophobicContact CG1-CB 4.29Å; V202-V329 PolarHBondContact N-O 2.92Å; V202-V329 PolarHBondContact O-N 3.21Å; F215-V329 HydrophobicContact CE2-CG2 4.48Å; V217-V329 HydrophobicContact CG1-CG2 4.41Å; V217-V329 HydrophobicContact CG2-CG2 3.86Å; L239-V329 HydrophobicContact CD1-CG1 4.08Å; L239-V329 HydrophobicContact CD2-CG1 4.08Å; L239-V329 HydrophobicContact CG-CG1 3.97Å; R240-V329 WeakPolarHBondContact O-CA 3.36Å; V329-F336 HydrophobicContact CB-CE2 3.94Å; V329-F336 HydrophobicContact CB-CZ 3.9Å; V329-F336 HydrophobicContact CG1-CD1 4.27Å; V329-F336 HydrophobicContact CG1-CD2 4.11Å; V329-F336 HydrophobicContact CG1-CE1 3.93Å; V329-F336 HydrophobicContact CG1-CE2 3.76Å; V329-F336 HydrophobicContact CG1-CG 4.34Å; V329-F336 HydrophobicContact CG1-CZ 3.65Å; V329-F336 HydrophobicContact CG2-CE2 4.03Å; V329-F336 HydrophobicContact CG2-CZ 4.5Å
330	Y	95.8	Very high	91.1	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.008	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	119	177.9	-176.8	-129.6	0	0	0	109.4	W199 R240 F250 T251 L252 E254 M429	W199-Y330 HydrophobicContact CB-CD2 4.22Å; W199-Y330 HydrophobicContact CB-CE1 4.21Å; W199-Y330 HydrophobicContact CB-CE2 3.41Å; W199-Y330 VanDerWaalsContact CB-CE2 3.41Å; W199-Y330 VanDerWaalsContact CB-CZ 3.43Å; W199-Y330 WeakPolarHBondContact CB-OH 3.36Å; W199-Y330 HydrophobicContact CD2-CD1 4.32Å; W199-Y330 AromaticContact CD2-CE1 3.82Å; W199-Y330 HydrophobicContact CD2-CE1 3.82Å; W199-Y330 AromaticContact CD2-CZ 3.96Å; W199-Y330 AromaticContact CE3-CD1 3.66Å; W199-Y330 HydrophobicContact CE3-CD1 3.66Å; W199-Y330 HydrophobicContact CE3-CD2 4.48Å; W199-Y330 AromaticContact CE3-CE1 3.64Å; W199-Y330 HydrophobicContact CE3-CE1 3.64Å; W199-Y330 HydrophobicContact CE3-CE2 4.45Å; W199-Y330 HydrophobicContact CE3-CG 4.12Å; W199-Y330 HydrophobicContact CG-CE1 4.11Å; W199-Y330 HydrophobicContact CG-CE2 4.19Å; W199-Y330 AromaticContact CG-CZ 3.73Å; W199-Y330 HydrophobicContact CZ3-CD1 4.02Å; W199-Y330 HydrophobicContact CZ3-CE1 4.23Å; R240-Y330 PolarHBondContact N-O 3.42Å; R240-Y330 PolarHBondContact O-N 3.47Å; F250-Y330 WeakPolarHBondContact O-CD2 3.31Å; F250-Y330 WeakPolarHBondContact O-CE2 3.47Å; T251-Y330 HydrophobicContact CG2-CE2 3.88Å; T251-Y330 WeakPolarHBondContact CG2-OH 3.33Å; L252-Y330 HydrophobicContact CB-CD1 4.42Å; L252-Y330 HydrophobicContact CB-CG 4.22Å; E254-Y330 PolarHBondContact OE1-OH 2.72Å; Y330-M429 HydrophobicContact CE1-SD 4.06Å
331	V	94.9	Very high	91.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	149.7	-161	70.9	0	0	0	0	113.1	L178 P189 W199 A200 L239 V334 F336	L178-V331 HydrophobicContact CD1-CG1 3.81Å; P189-V331 HydrophobicContact CB-CG1 4.48Å; P189-V331 HydrophobicContact CG-CG1 4.16Å; W199-V331 CarbonylContact C-O 3.57Å; W199-V331 WeakPolarHBondContact CA-O 3.43Å; A200-V331 HydrophobicContact CB-CG1 4.42Å; A200-V331 PolarHBondContact N-O 3.44Å; A200-V331 WeakPolarHBondContact O-CG1 3.43Å; A200-V331 PolarHBondContact O-N 2.83Å; L239-V331 HydrophobicContact CB-CG2 4.31Å; L239-V331 HydrophobicContact CD1-CB 4.49Å; L239-V331 HydrophobicContact CD1-CG2 3.94Å; L239-V331 HydrophobicContact CG-CB 4.49Å; L239-V331 HydrophobicContact CG-CG2 4.22Å; V331-V334 HydrophobicContact CG2-CB 3.58Å; V331-V334 HydrophobicContact CG2-CG1 4.03Å; V331-V334 WeakPolarHBondContact CG2-O 3.14Å; V331-F336 HydrophobicContact CB-CD1 4.3Å; V331-F336 HydrophobicContact CB-CE1 4.14Å; V331-F336 HydrophobicContact CG1-CD1 4.29Å; V331-F336 HydrophobicContact CG1-CE1 3.8Å; V331-F336 HydrophobicContact CG2-CD1 4.12Å; V331-F336 HydrophobicContact CG2-CE1 4.43Å
332	K	92.2	Very high	92.9	Very high	4 Å²	4	11.9 Å²	11.9	2%	0.017	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	121.6	171.7	-172.7	173.6	-157.8	175.3	0	110.6	S196 L197 W199 Y228 H237 V238 V334	S196-K332 WeakPolarHBondContact O-CE 3.45Å; L197-K332 VanDerWaalsContact C-CE 3.44Å; L197-K332 WeakPolarHBondContact O-CE 3.47Å; L197-K332 PolarHBondContact O-NZ 3.2Å; W199-K332 HydrophobicContact CD2-CB 3.83Å; W199-K332 HydrophobicContact CD2-CD 4.23Å; W199-K332 HydrophobicContact CE3-CB 3.8Å; W199-K332 HydrophobicContact CG-CB 4.33Å; W199-K332 HydrophobicContact CG-CD 4.42Å; W199-K332 HydrophobicContact CZ2-CD 4.34Å; W199-K332 HydrophobicContact CZ3-CB 4.15Å; Y228-K332 WeakPolarHBondContact OH-CE 3.49Å; Y228-K332 PolarHBondContact OH-NZ 2.72Å; H237-K332 WeakPolarHBondContact CA-O 3.46Å; V238-K332 PolarHBondContact N-O 3.3Å; V238-K332 VanDerWaalsContact N-O 3.09Å; V238-K332 PolarHBondContact O-N 2.78Å; K332-V334 PolarHBondContact O-N 2.93Å; K332-V334 VanDerWaalsContact O-N 3.14Å
333	N	92.9	Very high	93.7	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.	S	Bend	trans	50.3	33.6	176.5	-55.7	-46.4	0	0	0	115.6	T191 S196 L223 V225 T236 H237	T191-N333 HydrophobicContact CG2-CB 4.48Å; T191-N333 WeakPolarHBondContact CG2-OD1 3.19Å; S196-N333 VanDerWaalsContact CA-OD1 3.25Å; S196-N333 WeakPolarHBondContact CA-OD1 3.47Å; S196-N333 PolarHBondContact O-ND2 3.41Å; S196-N333 PolarHBondContact O-OD1 3.04Å; L223-N333 WeakPolarHBondContact CB-O 3.23Å; L223-N333 PolarHBondContact N-O 3.46Å; V225-N333 HydrophobicContact CG2-CB 3.82Å; V225-N333 VanDerWaalsContact CG2-CG 3.43Å; T236-N333 WeakPolarHBondContact O-CB 3.36Å; T236-N333 PolarHBondContact O-ND2 2.91Å; H237-N333 WeakPolarHBondContact ND1-CB 3.35Å; H237-N333 PolarHBondContact ND1-O 3.21Å
334	V	94.9	Very high	94.1	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.012	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136	-178.4	163	0	0	0	0	109.1	P189 V219 K221 H237 L239 V331 K332	P189-V334 WeakPolarHBondContact CD-O 3.27Å; V219-V334 HydrophobicContact CG1-CG1 3.67Å; K221-V334 WeakPolarHBondContact O-CA 3.37Å; H237-V334 HydrophobicContact CB-CG2 3.73Å; L239-V334 HydrophobicContact CB-CG1 4.44Å; L239-V334 HydrophobicContact CD1-CG1 3.85Å; V331-V334 HydrophobicContact CG2-CB 3.58Å; V331-V334 HydrophobicContact CG2-CG1 4.03Å; V331-V334 WeakPolarHBondContact CG2-O 3.14Å; K332-V334 PolarHBondContact O-N 2.93Å; K332-V334 VanDerWaalsContact O-N 3.14Å
335	E	96.5	Very high	93.9	Very high	15 Å²	15	22.1 Å²	22.1	7%	0.07	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	137.4	165.9	-174.2	165.9	-117.1	0	0	109.2	A187 K188 V220 K221 L223	A187-E335 WeakPolarHBondContact O-CA 3.25Å; K188-E335 HydrophobicContact CB-CB 4.08Å; K188-E335 HydrophobicContact CB-CG 4.05Å; K188-E335 VanDerWaalsContact CD-OE1 3.26Å; K188-E335 WeakPolarHBondContact CD-OE1 3.34Å; K188-E335 WeakPolarHBondContact CE-OE1 3.21Å; K188-E335 IonicContact NZ-OE1 3Å; K188-E335 PolarHBondContact NZ-OE1 2.84Å; V220-E335 WeakPolarHBondContact CA-O 3.39Å; V220-E335 HydrophobicContact CB-CB 4.46Å; V220-E335 HydrophobicContact CB-CG 4.32Å; V220-E335 WeakPolarHBondContact CB-O 3.43Å; V220-E335 HydrophobicContact CG1-CG 4.45Å; V220-E335 PolarHBondContact N-O 3.27Å; K221-E335 WeakPolarHBondContact CE-OE2 3.49Å; K221-E335 HydrophobicContact CG-CB 4.14Å; K221-E335 PolarHBondContact N-O 2.84Å; K221-E335 IonicContact NZ-OE2 2.63Å; K221-E335 PolarHBondContact NZ-OE2 3.33Å; K221-E335 PolarHBondContact O-N 3.3Å; L223-E335 HydrophobicContact CD2-CB 4.08Å; L223-E335 HydrophobicContact CG-CB 4.33Å
336	F	97.6	Very high	93.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	159.5	-177.8	69.9	-88.9	0	0	0	112.3	L169 L178 Q186 A187 V202 V217 R218 L239 V329 V331	L169-F336 HydrophobicContact CD1-CE2 3.85Å; L169-F336 HydrophobicContact CD1-CZ 4.31Å; L169-F336 HydrophobicContact CD2-CE2 4.34Å; L178-F336 HydrophobicContact CD1-CE1 4.27Å; Q186-F336 WeakPolarHBondContact CA-O 3.45Å; A187-F336 HydrophobicContact CB-CE1 3.9Å; A187-F336 HydrophobicContact CB-CE2 4.32Å; A187-F336 HydrophobicContact CB-CZ 3.77Å; A187-F336 PolarHBondContact N-O 3.38Å; A187-F336 WeakPolarHBondContact O-CD1 3.5Å; A187-F336 PolarHBondContact O-N 3.05Å; V202-F336 HydrophobicContact CG1-CZ 3.77Å; V217-F336 HydrophobicContact CG1-CB 4.09Å; V217-F336 HydrophobicContact CG1-CD2 3.86Å; V217-F336 HydrophobicContact CG1-CG 4.3Å; R218-F336 VanDerWaalsContact O-CA 3.25Å; R218-F336 WeakPolarHBondContact O-CA 3.35Å; R218-F336 WeakPolarHBondContact O-CB 3.37Å; L239-F336 HydrophobicContact CD1-CB 3.57Å; L239-F336 HydrophobicContact CD1-CD1 3.96Å; L239-F336 HydrophobicContact CD1-CG 3.86Å; V329-F336 HydrophobicContact CB-CE2 3.94Å; V329-F336 HydrophobicContact CB-CZ 3.9Å; V329-F336 HydrophobicContact CG1-CD1 4.27Å; V329-F336 HydrophobicContact CG1-CD2 4.11Å; V329-F336 HydrophobicContact CG1-CE1 3.93Å; V329-F336 HydrophobicContact CG1-CE2 3.76Å; V329-F336 HydrophobicContact CG1-CG 4.34Å; V329-F336 HydrophobicContact CG1-CZ 3.65Å; V329-F336 HydrophobicContact CG2-CE2 4.03Å; V329-F336 HydrophobicContact CG2-CZ 4.5Å; V331-F336 HydrophobicContact CB-CD1 4.3Å; V331-F336 HydrophobicContact CB-CE1 4.14Å; V331-F336 HydrophobicContact CG1-CD1 4.29Å; V331-F336 HydrophobicContact CG1-CE1 3.8Å; V331-F336 HydrophobicContact CG2-CD1 4.12Å; V331-F336 HydrophobicContact CG2-CE1 4.43Å
337	A	97	Very high	93.5	Very high	8 Å²	8	27.2 Å²	27.2	7%	0.066	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137.8	175.8	0	0	0	0	0	110	F185 Q186 V217 R218 V220 W348	F185-A337 CarbonylContact O-C 3.53Å; F185-A337 WeakPolarHBondContact O-CA 3.31Å; Q186-A337 HydrophobicContact CG-CB 3.83Å; V217-A337 CarbonylContact C-O 3.54Å; V217-A337 WeakPolarHBondContact CA-O 3.43Å; R218-A337 PolarHBondContact N-O 3.19Å; R218-A337 PolarHBondContact O-N 3.33Å; V220-A337 HydrophobicContact CG2-CB 3.67Å; A337-W348 HydrophobicContact CB-CH2 4.26Å
338	C	97.2	Very high	93.3	Very high	2 Å²	2	30 Å²	30	1%	0.014	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.5	177.8	-69.1	0	0	0	0	111.6	F185 E216 F340 Q342	F185-C338 PolarHBondContact O-N 3.43Å; E216-C338 CarbonylContact O-C 3.59Å; E216-C338 VanDerWaalsContact O-CA 3.31Å; E216-C338 WeakPolarHBondContact O-CA 3.36Å; C338-F340 HydrophobicContact CB-CD2 4.15Å; C338-F340 HydrophobicContact CB-CE1 4.36Å; C338-F340 HydrophobicContact CB-CE2 3.51Å; C338-F340 HydrophobicContact CB-CZ 3.63Å; C338-Q342 PolarHBondContact O-NE2 2.74Å
339	N	96.5	Very high	93	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	104.5	167.7	-171.5	8.1	0	0	0	109	F215 E216 G341 S346 P347 W348 Q363	F215-N339 WeakPolarHBondContact CA-O 3.37Å; E216-N339 HydrophobicContact CB-CB 4.14Å; E216-N339 PolarHBondContact N-O 3Å; E216-N339 PolarHBondContact O-N 3.39Å; E216-N339 PolarHBondContact OE2-ND2 3.48Å; N339-G341 PolarHBondContact OD1-N 2.79Å; N339-S346 PolarHBondContact ND2-O 3Å; N339-P347 WeakPolarHBondContact ND2-CA 3.46Å; N339-W348 HydrophobicContact CB-CD2 4.13Å; N339-W348 HydrophobicContact CB-CE3 4.01Å; N339-W348 HydrophobicContact CB-CH2 3.74Å; N339-W348 HydrophobicContact CB-CZ2 3.82Å; N339-W348 HydrophobicContact CB-CZ3 3.8Å; N339-Q363 PolarHBondContact ND2-NE2 3.46Å; N339-Q363 PolarHBondContact OD1-NE2 3.49Å
340	F	96	Very high	92.4	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.009	20%	0.199	C	C	.	.	S	Bend	trans	-96.1	-2.2	172.5	-57.9	-66.8	0	0	0	112	V167 L169 F185 A204 F215 P327 C338 Q363 M364 N365	V167-F340 HydrophobicContact CB-CB 4.1Å; V167-F340 HydrophobicContact CB-CG 4.31Å; V167-F340 HydrophobicContact CG1-CB 4.19Å; V167-F340 HydrophobicContact CG1-CD1 3.95Å; V167-F340 HydrophobicContact CG1-CD2 4.35Å; V167-F340 HydrophobicContact CG1-CE1 4.45Å; V167-F340 HydrophobicContact CG1-CG 3.91Å; V167-F340 WeakPolarHBondContact O-CD2 3.23Å; L169-F340 HydrophobicContact CD2-CE2 4.24Å; L169-F340 HydrophobicContact CD2-CZ 3.99Å; L169-F340 HydrophobicContact CG-CE2 4.3Å; F185-F340 HydrophobicContact CD1-CD2 4.14Å; F185-F340 HydrophobicContact CE1-CD2 4.38Å; A204-F340 HydrophobicContact CB-CE1 4.08Å; A204-F340 HydrophobicContact CB-CZ 3.96Å; F215-F340 HydrophobicContact CB-CD1 3.57Å; F215-F340 HydrophobicContact CB-CE1 3.87Å; F215-F340 HydrophobicContact CD2-CD1 4.39Å; F215-F340 AromaticContact CD2-CE1 3.81Å; F215-F340 HydrophobicContact CD2-CE1 3.81Å; F215-F340 HydrophobicContact CG-CD1 4.16Å; F215-F340 AromaticContact CG-CE1 3.94Å; F215-F340 HydrophobicContact CG-CE1 3.94Å; P327-F340 HydrophobicContact CB-CE1 3.9Å; P327-F340 HydrophobicContact CG-CE1 4.23Å; C338-F340 HydrophobicContact CB-CD2 4.15Å; C338-F340 HydrophobicContact CB-CE1 4.36Å; C338-F340 HydrophobicContact CB-CE2 3.51Å; C338-F340 HydrophobicContact CB-CZ 3.63Å; F340-Q363 VanDerWaalsContact O-CB 3.31Å; F340-Q363 WeakPolarHBondContact O-CB 3.13Å; F340-M364 HydrophobicContact CB-CB 4.38Å; F340-M364 HydrophobicContact CD1-CB 4.25Å; F340-M364 PolarHBondContact O-N 2.94Å; F340-N365 HydrophobicContact CB-CB 4.27Å; F340-N365 WeakPolarHBondContact O-CA 3.29Å; F340-N365 WeakPolarHBondContact O-CB 3.34Å; F340-N365 PolarHBondContact O-N 3.49Å
341	G	90.8	Very high	91.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	88	25.2	-165.5	0	0	0	0	0	113.4	N339 N365	N339-G341 PolarHBondContact OD1-N 2.79Å; G341-N365 PolarHBondContact O-ND2 3.38Å
342	Q	89.2	Confident	91	Very high	12 Å²	12	44.5 Å²	44.5	6%	0.056	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-58.7	147.6	172.1	60.5	-91.9	10	0	0	112	F185 C338 N344 Q345	F185-Q342 HydrophobicContact CD1-CB 4.19Å; F185-Q342 HydrophobicContact CD1-CG 3.98Å; F185-Q342 HydrophobicContact CD2-CB 4.34Å; F185-Q342 HydrophobicContact CD2-CG 3.84Å; F185-Q342 HydrophobicContact CE1-CB 3.51Å; F185-Q342 HydrophobicContact CE1-CG 3.81Å; F185-Q342 HydrophobicContact CE2-CB 3.69Å; F185-Q342 HydrophobicContact CE2-CG 3.68Å; F185-Q342 HydrophobicContact CG-CG 4.01Å; F185-Q342 HydrophobicContact CZ-CB 3.24Å; F185-Q342 HydrophobicContact CZ-CG 3.69Å; C338-Q342 PolarHBondContact O-NE2 2.74Å; Q342-N344 PolarHBondContact O-N 3.42Å; Q342-Q345 WeakPolarHBondContact O-CB 3.32Å; Q342-Q345 PolarHBondContact O-N 3.06Å
343	E	83.9	Confident	90.3	Very high	176 Å²	176	44.8 Å²	44.8	82%	0.822	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	53.6	25	174.5	-57.4	-178.1	-172.2	0	0	115.1	Q345	E343-Q345 PolarHBondContact O-N 3.21Å
344	N	83.4	Confident	89.1	Confident	155 Å²	155	49.3 Å²	49.3	83%	0.829	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	60.4	25.4	-169.7	-51.7	-48.4	0	0	0	114.3	Q342 S346	Q342-N344 PolarHBondContact O-N 3.42Å; N344-S346 PolarHBondContact O-N 3.1Å
345	Q	89.2	Confident	87.7	Confident	75 Å²	75	50.6 Å²	50.6	35%	0.35	28%	0.279	S	S	.	.			trans	-63.6	113.3	173.5	179.3	163.6	37.3	0	0	110.4	Q342 E343 Q363	Q342-Q345 WeakPolarHBondContact O-CB 3.32Å; Q342-Q345 PolarHBondContact O-N 3.06Å; E343-Q345 PolarHBondContact O-N 3.21Å; Q345-Q363 PolarHBondContact O-NE2 3.49Å; Q345-Q363 PolarHBondContact O-OE1 2.77Å
346	S	89.8	Confident	86	Confident	83 Å²	83	58 Å²	58	58%	0.58	32%	0.319	S	S	*	.			trans	-53.8	155.2	171.6	63.3	0	0	0	0	111.5	N339 N344	N339-S346 PolarHBondContact ND2-O 3Å; N344-S346 PolarHBondContact O-N 3.1Å
347	P	92.1	Very high	84.5	Confident	31 Å²	31	61.7 Å²	61.7	20%	0.201	34%	0.338	C	S	.	.			trans	-56.8	148.6	167.7	27.8	-35.9	0	0	0	110.6	F214 E216 N339 F349	F214-P347 HydrophobicContact CE2-CB 3.91Å; F214-P347 HydrophobicContact CZ-CB 3.93Å; F214-P347 HydrophobicContact CZ-CG 4.24Å; E216-P347 VanDerWaalsContact OE2-CA 3.31Å; E216-P347 WeakPolarHBondContact OE2-CA 3.32Å; N339-P347 WeakPolarHBondContact ND2-CA 3.46Å; P347-F349 VanDerWaalsContact C-N 3.32Å
348	W	93.6	Very high	82.5	Confident	61 Å²	61	65.4 Å²	65.4	23%	0.231	36%	0.362	C	S	.	.	S	Bend	trans	-72.4	-31.1	173.3	-59.8	-39.7	0	0	0	111	E216 R218 V285 A337 N339	E216-W348 HydrophobicContact CB-CE3 3.73Å; E216-W348 HydrophobicContact CB-CZ3 3.93Å; E216-W348 VanDerWaalsContact CD-N 3.27Å; E216-W348 WeakPolarHBondContact OE1-CA 3.37Å; E216-W348 WeakPolarHBondContact OE1-CB 3.39Å; E216-W348 PolarHBondContact OE1-N 2.73Å; E216-W348 PolarHBondContact OE2-N 3.02Å; R218-W348 HydrophobicContact CB-CE3 4.2Å; R218-W348 HydrophobicContact CB-CH2 3.83Å; R218-W348 HydrophobicContact CB-CZ3 3.56Å; R218-W348 VanDerWaalsContact NH2-CD1 3.26Å; R218-W348 VanDerWaalsContact NH2-CD2 3.32Å; R218-W348 VanDerWaalsContact NH2-CE2 3.3Å; V285-W348 HydrophobicContact CG1-CE3 3.72Å; V285-W348 HydrophobicContact CG1-CZ3 4.42Å; V285-W348 HydrophobicContact CG2-CE3 3.94Å; A337-W348 HydrophobicContact CB-CH2 4.26Å; N339-W348 HydrophobicContact CB-CD2 4.13Å; N339-W348 HydrophobicContact CB-CE3 4.01Å; N339-W348 HydrophobicContact CB-CH2 3.74Å; N339-W348 HydrophobicContact CB-CZ2 3.82Å; N339-W348 HydrophobicContact CB-CZ3 3.8Å
349	F	92.1	Very high	80.6	Confident	76 Å²	76	72.5 Å²	72.5	33%	0.333	40%	0.399	S	S	.	.	S	Bend	trans	-128.9	124.5	169.4	-67.4	-92.3	0	0	0	110.8	E216 V285 N304 P347	E216-F349 PolarHBondContact OE1-N 2.97Å; V285-F349 HydrophobicContact CB-CD2 3.87Å; V285-F349 HydrophobicContact CB-CE2 3.67Å; V285-F349 HydrophobicContact CG1-CD2 3.92Å; V285-F349 HydrophobicContact CG1-CE2 4.24Å; V285-F349 HydrophobicContact CG2-CD2 4.3Å; V285-F349 HydrophobicContact CG2-CE2 3.83Å; N304-F349 VanDerWaalsContact C-CE1 3.45Å; N304-F349 HydrophobicContact CB-CE1 4.1Å; N304-F349 HydrophobicContact CB-CE2 4.41Å; N304-F349 HydrophobicContact CB-CZ 3.88Å; N304-F349 VanDerWaalsContact O-CD1 3.29Å; N304-F349 WeakPolarHBondContact O-CD1 3.45Å; N304-F349 VanDerWaalsContact O-CE1 3.26Å; N304-F349 WeakPolarHBondContact O-CE1 3.42Å; P347-F349 VanDerWaalsContact C-N 3.32Å
350	S	84.7	Confident	79.7	Confident	82 Å²	82	73.8 Å²	73.8	57%	0.573	41%	0.408	S	S	*	.			trans	-58.2	142.1	174.1	-59.2	0	0	0	0	111.4	N352	S350-N352 PolarHBondContact O-N 2.85Å
351	P	82.7	Confident	79.4	Confident	30 Å²	30	74.5 Å²	74.5	20%	0.195	41%	0.41	C	S	.	.			trans	-74.2	88.3	-173.1	30.6	-36.6	0	0	0	112.1	F214 F289 I353 W361	F214-P351 HydrophobicContact CE1-CG 4.41Å; F214-P351 HydrophobicContact CZ-CG 4.43Å; F289-P351 HydrophobicContact CE1-CB 3.87Å; F289-P351 HydrophobicContact CZ-CB 4.39Å; P351-I353 PolarHBondContact O-N 2.88Å; P351-W361 HydrophobicContact CB-CB 4.17Å; P351-W361 HydrophobicContact CB-CG 4.31Å; P351-W361 HydrophobicContact CG-CB 3.97Å
352	N	78.1	Confident	79.3	Confident	121 Å²	121	78.2 Å²	78.2	65%	0.647	43%	0.428	S	S	*	.			trans	-75.5	34.1	177.5	-60.5	-39.1	0	0	0	113.4	G305 S350	G305-N352 PolarHBondContact O-ND2 2.86Å; S350-N352 PolarHBondContact O-N 2.85Å
353	I	77.8	Confident	79.5	Confident	9 Å²	9	78.7 Å²	78.7	5%	0.046	43%	0.43	C	S	.	.			trans	-89.2	126	-176.5	-63.2	-173	0	0	0	110.1	F289 R300 D307 P351 S355 W361	F289-I353 HydrophobicContact CB-CD1 4.09Å; F289-I353 HydrophobicContact CD1-CD1 3.43Å; F289-I353 VanDerWaalsContact CD1-CD1 3.43Å; F289-I353 HydrophobicContact CD2-CD1 3.56Å; F289-I353 HydrophobicContact CE1-CD1 3.68Å; F289-I353 HydrophobicContact CE1-CG1 4.49Å; F289-I353 HydrophobicContact CE2-CD1 3.77Å; F289-I353 HydrophobicContact CG-CD1 3.4Å; F289-I353 VanDerWaalsContact CG-CD1 3.4Å; F289-I353 HydrophobicContact CZ-CD1 3.84Å; R300-I353 HydrophobicContact CB-CD1 4.44Å; D307-I353 HydrophobicContact CB-CG1 4.38Å; P351-I353 PolarHBondContact O-N 2.88Å; I353-S355 PolarHBondContact O-N 3.09Å; I353-S355 VanDerWaalsContact O-N 3.07Å; I353-S355 PolarHBondContact O-OG 2.77Å; I353-W361 HydrophobicContact CG2-CZ2 4.09Å
354	P	67.9	Low	80	Confident	96 Å²	96	70.3 Å²	70.3	62%	0.623	39%	0.391	S	S	*	.			trans	-55.3	115.6	174.4	-25.5	34.6	0	0	0	111.6
355	S	65.6	Low	80.4	Confident	29 Å²	29	64.5 Å²	64.5	20%	0.203	36%	0.36	C	S	.	.			trans	-157.5	149.4	179.7	46.3	0	0	0	0	109.6	I353 D357 W361	I353-S355 PolarHBondContact O-N 3.09Å; I353-S355 VanDerWaalsContact O-N 3.07Å; I353-S355 PolarHBondContact O-OG 2.77Å; S355-D357 PolarHBondContact O-N 2.88Å; S355-W361 PolarHBondContact OG-NE1 2.89Å; S355-W361 VanDerWaalsContact OG-NE1 3.1Å
356	D	61	Low	80.4	Confident	170 Å²	170	64 Å²	64	91%	0.909	36%	0.364	S	S	*	.	S	Bend	trans	-65.6	-21.3	-171.7	-46	-71.6	0	0	0	113.6
357	D	65.5	Low	80.4	Confident	77 Å²	77	60.4 Å²	60.4	41%	0.412	34%	0.338	S	S	.	.			trans	-132.5	106.8	168.3	173	20.7	0	0	0	109.6	S355 L359 S360	S355-D357 PolarHBondContact O-N 2.88Å; D357-L359 PolarHBondContact O-N 3.33Å; D357-L359 WeakPolarHBondContact OD1-CB 3.38Å; D357-L359 PolarHBondContact OD1-N 2.73Å; D357-S360 VanDerWaalsContact O-CB 3.3Å; D357-S360 WeakPolarHBondContact O-CB 3.45Å; D357-S360 PolarHBondContact O-N 2.86Å; D357-S360 VanDerWaalsContact O-N 3.12Å; D357-S360 PolarHBondContact O-OG 3.17Å; D357-S360 PolarHBondContact OD2-N 2.83Å
358	P	54.7	Low	80.3	Confident	87 Å²	87	62 Å²	62	57%	0.565	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-12.1	178	28.5	-34.5	0	0	0	113.8	S360	P358-S360 VanDerWaalsContact C-N 3.32Å
359	L	57.2	Low	80	Confident	151 Å²	151	63.9 Å²	63.9	79%	0.791	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.8	172.5	-64.2	168.1	0	0	0	112.9	D357 W361	D357-L359 PolarHBondContact O-N 3.33Å; D357-L359 WeakPolarHBondContact OD1-CB 3.38Å; D357-L359 PolarHBondContact OD1-N 2.73Å; L359-W361 VanDerWaalsContact C-N 3.32Å; L359-W361 PolarHBondContact O-N 3.26Å
360	S	79.2	Confident	79.9	Confident	26 Å²	26	64.8 Å²	64.8	18%	0.182	38%	0.378	C	S	.	.			trans	-73.8	-16	-177.6	66.1	0	0	0	0	114.8	K212 D357 P358 Q362	K212-S360 WeakPolarHBondContact CD-OG 3.35Å; K212-S360 WeakPolarHBondContact CE-OG 3.25Å; D357-S360 VanDerWaalsContact O-CB 3.3Å; D357-S360 WeakPolarHBondContact O-CB 3.45Å; D357-S360 PolarHBondContact O-N 2.86Å; D357-S360 VanDerWaalsContact O-N 3.12Å; D357-S360 PolarHBondContact O-OG 3.17Å; D357-S360 PolarHBondContact OD2-N 2.83Å; P358-S360 VanDerWaalsContact C-N 3.32Å; S360-Q362 PolarHBondContact O-N 3.28Å
361	W	88	Confident	80.2	Confident	17 Å²	17	61.9 Å²	61.9	6%	0.064	36%	0.358	C	S	.	.			trans	-83.5	111.2	-178.6	-70.2	104.1	0	0	0	112.7	K212 F214 F289 E291 P351 I353 S355 L359	K212-W361 HydrophobicContact CB-CD2 4.09Å; K212-W361 HydrophobicContact CB-CE3 3.7Å; K212-W361 HydrophobicContact CB-CH2 4.29Å; K212-W361 HydrophobicContact CB-CZ3 3.82Å; K212-W361 HydrophobicContact CD-CH2 4.48Å; K212-W361 HydrophobicContact CD-CZ2 4.2Å; F214-W361 HydrophobicContact CD1-CB 4.14Å; F214-W361 HydrophobicContact CE1-CB 4.14Å; F289-W361 HydrophobicContact CB-CH2 4.12Å; F289-W361 HydrophobicContact CB-CZ3 3.86Å; F289-W361 HydrophobicContact CD1-CD2 4.2Å; F289-W361 AromaticContact CD1-CE3 3.76Å; F289-W361 HydrophobicContact CD1-CE3 3.76Å; F289-W361 HydrophobicContact CD1-CH2 4.44Å; F289-W361 AromaticContact CD1-CZ3 3.89Å; F289-W361 HydrophobicContact CD1-CZ3 3.89Å; F289-W361 HydrophobicContact CG-CZ3 4.38Å; E291-W361 HydrophobicContact CB-CH2 3.83Å; E291-W361 HydrophobicContact CB-CZ3 4.49Å; P351-W361 HydrophobicContact CB-CB 4.17Å; P351-W361 HydrophobicContact CB-CG 4.31Å; P351-W361 HydrophobicContact CG-CB 3.97Å; I353-W361 HydrophobicContact CG2-CZ2 4.09Å; S355-W361 PolarHBondContact OG-NE1 2.89Å; S355-W361 VanDerWaalsContact OG-NE1 3.1Å; L359-W361 VanDerWaalsContact C-N 3.32Å; L359-W361 PolarHBondContact O-N 3.26Å
362	Q	90.4	Very high	80.6	Confident	79 Å²	79	61.7 Å²	61.7	37%	0.369	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	141.9	178.4	-62.1	-177.2	-3	0	0	111.9	K212 S213 F214 S360 C366 L367	K212-Q362 PolarHBondContact O-N 2.8Å; S213-Q362 CarbonylContact C-O 3.57Å; S213-Q362 WeakPolarHBondContact CA-O 3.12Å; F214-Q362 WeakPolarHBondContact CD1-O 3.44Å; F214-Q362 PolarHBondContact N-O 3.26Å; S360-Q362 PolarHBondContact O-N 3.28Å; Q362-C366 HydrophobicContact CB-CB 4.5Å; Q362-L367 HydrophobicContact CB-CD2 4.37Å
363	Q	93.1	Very high	81.2	Confident	21 Å²	21	58.8 Å²	58.8	10%	0.098	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	148.6	168.9	-63.3	166.4	-78.9	0	0	109.6	F214 N339 F340 Q345 N365 C366 L367	F214-Q363 HydrophobicContact CE1-CG 3.9Å; F214-Q363 HydrophobicContact CE2-CG 3.99Å; F214-Q363 HydrophobicContact CZ-CG 3.57Å; F214-Q363 CarbonylContact O-C 3.55Å; F214-Q363 WeakPolarHBondContact O-CA 3.38Å; N339-Q363 PolarHBondContact ND2-NE2 3.46Å; N339-Q363 PolarHBondContact OD1-NE2 3.49Å; F340-Q363 VanDerWaalsContact O-CB 3.31Å; F340-Q363 WeakPolarHBondContact O-CB 3.13Å; Q345-Q363 PolarHBondContact O-NE2 3.49Å; Q345-Q363 PolarHBondContact O-OE1 2.77Å; Q363-N365 PolarHBondContact O-N 3.09Å; Q363-N365 VanDerWaalsContact O-N 3.08Å; Q363-C366 WeakPolarHBondContact O-CA 3.14Å; Q363-C366 WeakPolarHBondContact O-CB 3.36Å; Q363-C366 PolarHBondContact O-N 3.15Å; Q363-L367 PolarHBondContact O-N 2.86Å
364	M	93.8	Very high	81.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-38	-175.4	-77.8	-64.8	-63.6	0	0	114.8	V167 F214 F215 W243 P327 F340 C366 L367 R372	V167-M364 HydrophobicContact CB-CB 4.48Å; V167-M364 HydrophobicContact CG1-CB 4.18Å; V167-M364 HydrophobicContact CG2-CB 4.35Å; F214-M364 PolarHBondContact O-N 3.49Å; F215-M364 HydrophobicContact CB-CG 4.25Å; W243-M364 HydrophobicContact CH2-CG 4.33Å; W243-M364 HydrophobicContact CH2-SD 3.8Å; W243-M364 HydrophobicContact CZ3-SD 3.99Å; P327-M364 HydrophobicContact CG-CE 3.93Å; P327-M364 HydrophobicContact CG-CG 4.03Å; P327-M364 HydrophobicContact CG-SD 4.31Å; F340-M364 HydrophobicContact CB-CB 4.38Å; F340-M364 HydrophobicContact CD1-CB 4.25Å; F340-M364 PolarHBondContact O-N 2.94Å; M364-C366 VanDerWaalsContact C-N 3.27Å; M364-C366 PolarHBondContact O-N 2.77Å; M364-L367 HydrophobicContact SD-CD1 4.14Å; M364-R372 PolarHBondContact O-NE 3.12Å
365	N	92.3	Very high	83	Confident	33 Å²	33	56.2 Å²	56.2	18%	0.176	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-9	179.4	-166.3	60.3	0	0	0	113.9	S166 V167 F340 G341 Q363 R372	S166-N365 VanDerWaalsContact CA-OD1 3.27Å; S166-N365 WeakPolarHBondContact CA-OD1 3.46Å; V167-N365 HydrophobicContact CB-CB 4.29Å; V167-N365 HydrophobicContact CG2-CB 4.31Å; V167-N365 PolarHBondContact N-OD1 3.31Å; F340-N365 HydrophobicContact CB-CB 4.27Å; F340-N365 WeakPolarHBondContact O-CA 3.29Å; F340-N365 WeakPolarHBondContact O-CB 3.34Å; F340-N365 PolarHBondContact O-N 3.49Å; G341-N365 PolarHBondContact O-ND2 3.38Å; Q363-N365 PolarHBondContact O-N 3.09Å; Q363-N365 VanDerWaalsContact O-N 3.08Å; N365-R372 PolarHBondContact O-NH2 2.97Å
366	C	89.8	Confident	84.2	Confident	66 Å²	66	57.3 Å²	57.3	45%	0.446	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-16.7	177.5	-58.4	0	0	0	0	113.3	Q362 Q363 M364	Q362-C366 HydrophobicContact CB-CB 4.5Å; Q363-C366 WeakPolarHBondContact O-CA 3.14Å; Q363-C366 WeakPolarHBondContact O-CB 3.36Å; Q363-C366 PolarHBondContact O-N 3.15Å; M364-C366 VanDerWaalsContact C-N 3.27Å; M364-C366 PolarHBondContact O-N 2.77Å
367	L	89.4	Confident	85.5	Confident	6 Å²	6	52 Å²	52	3%	0.031	30%	0.296	C	S	.	.	S	Bend	trans	-56.7	146.7	175.7	-81.9	179.5	0	0	0	112.2	Q362 Q363 M364 C371 R372	Q362-L367 HydrophobicContact CB-CD2 4.37Å; Q363-L367 PolarHBondContact O-N 2.86Å; M364-L367 HydrophobicContact SD-CD1 4.14Å; L367-C371 HydrophobicContact CD1-CB 4.48Å; L367-C371 HydrophobicContact CD2-CB 4.35Å; L367-R372 HydrophobicContact CB-CG 4.14Å; L367-R372 HydrophobicContact CD1-CG 4.38Å; L367-R372 VanDerWaalsContact O-CZ 3.28Å; L367-R372 PolarHBondContact O-NE 2.68Å; L367-R372 PolarHBondContact O-NH2 3.34Å
368	P	88.7	Confident	86.7	Confident	65 Å²	65	48.8 Å²	48.8	42%	0.422	28%	0.279	S	S	.	.			trans	-55.4	143.3	166	-23.5	33.9	0	0	0	111.8	S370 C371	P368-S370 PolarHBondContact O-N 2.73Å; P368-C371 WeakPolarHBondContact O-CB 3Å; P368-C371 PolarHBondContact O-N 2.78Å
369	L	88.5	Confident	88.4	Confident	100 Å²	100	45.8 Å²	45.8	52%	0.524	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-59.1	-30	177.8	-72.8	175.3	0	0	0	112.7	A165 Y206 C371 R372	A165-L369 HydrophobicContact CB-CD1 4.38Å; A165-L369 HydrophobicContact CB-CD2 4.25Å; Y206-L369 HydrophobicContact CE1-CD2 4.48Å; L369-C371 PolarHBondContact O-N 2.69Å; L369-R372 PolarHBondContact O-N 2.77Å; L369-R372 VanDerWaalsContact O-O 3.11Å
370	S	89.6	Confident	89.7	Confident	96 Å²	96	46.5 Å²	46.5	67%	0.671	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-64.8	-15.2	173.2	57.4	0	0	0	0	114.6	P368	P368-S370 PolarHBondContact O-N 2.73Å
371	C	90.2	Very high	90.1	Very high	21 Å²	21	47 Å²	47	14%	0.142	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-97.9	0	175	-60.6	0	0	0	0	112.5	I209 S210 L367 P368 L369	I209-C371 WeakPolarHBondContact CG1-O 3.44Å; I209-C371 PolarHBondContact N-O 3.18Å; S210-C371 PolarHBondContact OG-SG 2.91Å; S210-C371 VanDerWaalsContact OG-SG 3.34Å; L367-C371 HydrophobicContact CD1-CB 4.48Å; L367-C371 HydrophobicContact CD2-CB 4.35Å; P368-C371 WeakPolarHBondContact O-CB 3Å; P368-C371 PolarHBondContact O-N 2.78Å; L369-C371 PolarHBondContact O-N 2.69Å
372	R	91.6	Very high	90.1	Very high	25 Å²	25	50.2 Å²	50.2	9%	0.094	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	154.2	-178.6	-48.8	-174.7	-154.3	174.3	1.2	111.3	A165 V167 Y206 G207 M364 N365 L367 L369	A165-R372 PolarHBondContact O-NH1 3.23Å; V167-R372 VanDerWaalsContact CG2-NH1 3.34Å; Y206-R372 HydrophobicContact CD1-CB 3.7Å; Y206-R372 HydrophobicContact CE1-CB 4.4Å; Y206-R372 HydrophobicContact CG-CB 4.35Å; G207-R372 CarbonylContact O-C 3.53Å; G207-R372 WeakPolarHBondContact O-CA 3.2Å; M364-R372 PolarHBondContact O-NE 3.12Å; N365-R372 PolarHBondContact O-NH2 2.97Å; L367-R372 HydrophobicContact CB-CG 4.14Å; L367-R372 HydrophobicContact CD1-CG 4.38Å; L367-R372 VanDerWaalsContact O-CZ 3.28Å; L367-R372 PolarHBondContact O-NE 2.68Å; L367-R372 PolarHBondContact O-NH2 3.34Å; L369-R372 PolarHBondContact O-N 2.77Å; L369-R372 VanDerWaalsContact O-O 3.11Å
373	V	91.9	Very high	90.2	Very high	60 Å²	60	50 Å²	50	36%	0.364	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.3	169.4	175.3	0	0	0	0	108.2	Y206 G207 I209 A324	Y206-V373 CarbonylContact C-O 3.55Å; Y206-V373 WeakPolarHBondContact CA-O 3.28Å; G207-V373 PolarHBondContact N-O 2.89Å; G207-V373 PolarHBondContact O-N 2.9Å; I209-V373 HydrophobicContact CD1-CG2 4.13Å; I209-V373 HydrophobicContact CG1-CG2 4.38Å; I209-V373 HydrophobicContact CG2-CG2 3.65Å; A324-V373 HydrophobicContact CB-CB 4.07Å; A324-V373 HydrophobicContact CB-CG2 4.26Å
374	H	92	Very high	90.1	Very high	45 Å²	45	52.4 Å²	52.4	21%	0.208	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	141	173.8	-164.2	-73.7	0	0	0	109.6	W161 N205 Y206 C377	W161-H374 AromaticContact CZ3-CE1 3.9Å; W161-H374 AromaticContact CZ3-NE2 3.96Å; N205-H374 CarbonylContact O-C 3.19Å; N205-H374 WeakPolarHBondContact O-CA 3.37Å; Y206-H374 HydrophobicContact CD1-CB 4.08Å; Y206-H374 HydrophobicContact CE1-CB 3.79Å; Y206-H374 AromaticContact CE1-CD2 3.94Å; Y206-H374 AromaticContact CE2-CD2 3.76Å; Y206-H374 AromaticContact CZ-CD2 3.57Å; H374-C377 PolarHBondContact CE1-SG 2.94Å
375	G	90.8	Very high	90.2	Very high	6 Å²	6	52.4 Å²	52.4	6%	0.062	30%	0.295	C	S	.	.			trans	-75.3	174.7	175.5	0	0	0	0	0	113.2	N205 E246 C377	N205-G375 PolarHBondContact O-N 2.82Å; E246-G375 VanDerWaalsContact OE1-C 3.32Å; E246-G375 WeakPolarHBondContact OE1-CA 3.39Å; G375-C377 PolarHBondContact O-N 3.15Å
376	R	90	Very high	90.3	Very high	53 Å²	53	51.6 Å²	51.6	20%	0.2	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-55.2	127.1	175.9	-79.2	167.9	-135.7	167.3	10.6	110.8	Y172 N173 E246 D247 R410	Y172-R376 WeakPolarHBondContact CD1-O 3.44Å; Y172-R376 HydrophobicContact CE1-CB 4.28Å; Y172-R376 WeakPolarHBondContact CE1-O 3.33Å; N173-R376 PolarHBondContact ND2-O 2.88Å; E246-R376 WeakPolarHBondContact OE1-CG 3.29Å; E246-R376 PolarHBondContact OE1-N 2.82Å; E246-R376 IonicContact OE1-NE 2.8Å; E246-R376 IonicContact OE2-CZ 2.76Å; E246-R376 IonicContact OE2-NE 2.66Å; E246-R376 PolarHBondContact OE2-NE 3.33Å; E246-R376 IonicContact OE2-NH2 3.14Å; E246-R376 PolarHBondContact OE2-NH2 3.46Å; D247-R376 IonicContact OD1-CZ 2.86Å; D247-R376 IonicContact OD1-NH1 3.2Å; D247-R376 PolarHBondContact OD1-NH1 2.89Å; D247-R376 VanDerWaalsContact OD1-NH1 3.08Å; D247-R376 IonicContact OD1-NH2 2.67Å; D247-R376 PolarHBondContact OD1-NH2 3.24Å; R376-R410 PolarHBondContact NH1-O 3.05Å
377	C	89.8	Confident	90.6	Very high	59 Å²	59	48.4 Å²	48.4	40%	0.399	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-87.5	156.4	179.2	-62.2	0	0	0	0	112.3	E162 H374 G375	E162-C377 HydrophobicContact CB-CB 4.5Å; E162-C377 HydrophobicContact CG-CB 4.18Å; H374-C377 PolarHBondContact CE1-SG 2.94Å; G375-C377 PolarHBondContact O-N 3.15Å
378	P	89.4	Confident	91	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.052	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-60.3	148.9	168.8	24.3	-34.2	0	0	0	113.2	W161 E162 Y172 R463	W161-P378 HydrophobicContact CZ2-CG 4.04Å; E162-P378 HydrophobicContact CG-CG 3.99Å; Y172-P378 HydrophobicContact CD2-CB 3.62Å; Y172-P378 HydrophobicContact CD2-CG 4.38Å; Y172-P378 HydrophobicContact CE2-CB 3.97Å; Y172-P378 HydrophobicContact CG-CB 4.3Å; P378-R463 HydrophobicContact CB-CB 3.78Å; P378-R463 WeakPolarHBondContact CB-O 3.33Å; P378-R463 PolarHBondContact O-NH2 3.29Å
379	P	90.1	Very high	91.3	Very high	25 Å²	25	45.2 Å²	45.2	16%	0.162	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-54.5	143.4	169.2	-22.6	33.4	0	0	0	111.3	S381 E384 R463	P379-S381 PolarHBondContact O-N 3.34Å; P379-E384 HydrophobicContact CB-CB 3.78Å; P379-R463 WeakPolarHBondContact CD-O 3.34Å; P379-R463 VanDerWaalsContact O-CZ 3.28Å; P379-R463 PolarHBondContact O-NE 3.05Å; P379-R463 PolarHBondContact O-NH2 2.84Å
380	Q	85.9	Confident	91.7	Very high	166 Å²	166	40.5 Å²	40.5	78%	0.776	22%	0.224	S	C	*	.	S	Bend	trans	-61.8	-45.6	-167	-65.1	-174.2	-11.7	0	0	111.5	E384 R463	Q380-E384 WeakPolarHBondContact CB-OE2 3.4Å; Q380-E384 PolarHBondContact N-OE2 2.66Å; Q380-R463 PolarHBondContact O-NE 3.27Å; Q380-R463 PolarHBondContact O-NH2 2.94Å
381	S	87.5	Confident	92	Very high	37 Å²	37	35.9 Å²	35.9	26%	0.259	19%	0.192	S	C	.	.	S	Bend	trans	-113.7	154.6	176.2	74.5	0	0	0	0	113.2	P379 S383 E384	P379-S381 PolarHBondContact O-N 3.34Å; S381-S383 WeakPolarHBondContact CB-OG 3.27Å; S381-S383 PolarHBondContact O-N 3.22Å; S381-S383 PolarHBondContact OG-N 2.9Å; S381-S383 PolarHBondContact OG-OG 3.19Å; S381-E384 WeakPolarHBondContact CB-OE1 3.2Å; S381-E384 PolarHBondContact N-OE1 3.35Å; S381-E384 PolarHBondContact O-N 3.05Å; S381-E384 PolarHBondContact OG-N 2.9Å; S381-E384 PolarHBondContact OG-OE1 2.99Å
382	K	88.2	Confident	92.2	Very high	84 Å²	84	34.9 Å²	34.9	37%	0.365	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-33.1	170.1	-164	-173.5	-173.7	-168.2	0	112.1	E384 C385 E486 G487 F488	K382-E384 VanDerWaalsContact C-N 3.29Å; K382-E384 PolarHBondContact O-N 2.87Å; K382-C385 WeakPolarHBondContact O-CB 3.38Å; K382-C385 PolarHBondContact O-N 2.72Å; K382-E486 WeakPolarHBondContact CE-O 3.07Å; K382-E486 PolarHBondContact NZ-O 3.01Å; K382-G487 CarbonylContact C-O 3.58Å; K382-F488 HydrophobicContact CD-CD2 4.46Å; K382-F488 HydrophobicContact CD-CE2 4.29Å; K382-F488 VanDerWaalsContact CE-CD2 3.49Å; K382-F488 HydrophobicContact CG-CD2 4.22Å; K382-F488 HydrophobicContact CG-CE2 4.13Å; K382-F488 HydrophobicContact CG-CZ 4.45Å
383	S	90.8	Very high	92.2	Very high	74 Å²	74	33.9 Å²	33.9	52%	0.517	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-18	176.5	25.4	0	0	0	0	114.7	S381 G487 K489	S381-S383 WeakPolarHBondContact CB-OG 3.27Å; S381-S383 PolarHBondContact O-N 3.22Å; S381-S383 PolarHBondContact OG-N 2.9Å; S381-S383 PolarHBondContact OG-OG 3.19Å; S383-G487 WeakPolarHBondContact CA-O 3.33Å; S383-G487 PolarHBondContact N-O 3.32Å; S383-K489 VanDerWaalsContact O-CE 3.24Å; S383-K489 WeakPolarHBondContact O-CE 3.26Å
384	E	92.6	Very high	92	Very high	71 Å²	71	32 Å²	32	33%	0.332	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-32.6	170.6	-75.3	142.4	-113.6	0	0	112.7	P379 Q380 S381 K382 K489	P379-E384 HydrophobicContact CB-CB 3.78Å; Q380-E384 WeakPolarHBondContact CB-OE2 3.4Å; Q380-E384 PolarHBondContact N-OE2 2.66Å; S381-E384 WeakPolarHBondContact CB-OE1 3.2Å; S381-E384 PolarHBondContact N-OE1 3.35Å; S381-E384 PolarHBondContact O-N 3.05Å; S381-E384 PolarHBondContact OG-N 2.9Å; S381-E384 PolarHBondContact OG-OE1 2.99Å; K382-E384 VanDerWaalsContact C-N 3.29Å; K382-E384 PolarHBondContact O-N 2.87Å; E384-K489 PolarHBondContact O-NZ 2.95Å
385	C	94.1	Very high	91.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.			trans	-60.9	131.9	-175.5	-59.1	0	0	0	0	112.4	K382 N465 F488 K489	K382-C385 WeakPolarHBondContact O-CB 3.38Å; K382-C385 PolarHBondContact O-N 2.72Å; C385-N465 WeakPolarHBondContact CA-OD1 3.49Å; C385-F488 HydrophobicContact CB-CD1 3.36Å; C385-F488 HydrophobicContact CB-CE1 3.58Å; C385-F488 HydrophobicContact CB-CG 4.37Å; C385-K489 PolarHBondContact O-N 3.39Å
386	E	95.2	Very high	91.6	Very high	16 Å²	16	30.3 Å²	30.3	8%	0.075	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.7	-179.8	-62.7	-170.3	132.2	0	0	111.9	K412 Y414 N465 Y466 K489 K491	E386-K412 IonicContact OE2-NZ 2.68Å; E386-K412 PolarHBondContact OE2-NZ 3.42Å; E386-Y414 HydrophobicContact CB-CE1 4.3Å; E386-Y414 PolarHBondContact OE2-OH 3.23Å; E386-N465 PolarHBondContact N-OD1 3.19Å; E386-N465 CarbonylContact O-C 3.51Å; E386-N465 VanDerWaalsContact O-CA 3.26Å; E386-N465 WeakPolarHBondContact O-CA 3.43Å; E386-Y466 PolarHBondContact O-N 2.89Å; E386-K489 HydrophobicContact CG-CB 4.17Å; E386-K489 HydrophobicContact CG-CD 3.9Å; E386-K491 WeakPolarHBondContact OE1-CE 3.15Å; E386-K491 IonicContact OE1-NZ 3.68Å; E386-K491 PolarHBondContact OE1-NZ 2.78Å; E386-K491 VanDerWaalsContact OE1-NZ 3.14Å
387	V	96.5	Very high	91.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.3	169.3	58	0	0	0	0	110	Y466 L468 M482 F485 F488 K489 R490 K491	V387-Y466 WeakPolarHBondContact CA-O 3.36Å; V387-L468 HydrophobicContact CG2-CD1 4.25Å; V387-L468 HydrophobicContact CG2-CG 4.28Å; V387-M482 HydrophobicContact CG1-CE 3.87Å; V387-M482 HydrophobicContact CG2-CE 4.23Å; V387-F485 HydrophobicContact CB-CD1 4.17Å; V387-F485 HydrophobicContact CB-CG 4.35Å; V387-F485 HydrophobicContact CG1-CB 3.78Å; V387-F485 HydrophobicContact CG1-CD1 4.17Å; V387-F485 HydrophobicContact CG1-CG 3.98Å; V387-F485 HydrophobicContact CG2-CD1 4.06Å; V387-F485 HydrophobicContact CG2-CD2 4.19Å; V387-F485 HydrophobicContact CG2-CE1 4.13Å; V387-F485 HydrophobicContact CG2-CE2 4.24Å; V387-F485 HydrophobicContact CG2-CG 4.11Å; V387-F485 HydrophobicContact CG2-CZ 4.22Å; V387-F488 HydrophobicContact CG1-CB 3.77Å; V387-F488 HydrophobicContact CG1-CG 4.31Å; V387-K489 PolarHBondContact N-O 3.44Å; V387-R490 HydrophobicContact CG1-CB 4.3Å; V387-R490 HydrophobicContact CG1-CG 3.76Å; V387-R490 WeakPolarHBondContact O-CA 3.32Å; V387-K491 PolarHBondContact O-N 2.96Å
388	I	96.8	Very high	91.7	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.021	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.2	-174.6	-54.3	-176.1	0	0	0	108.8	M390 Q405 Y414 Y466 I467 L468 K491 I493	I388-M390 HydrophobicContact CG2-SD 4.21Å; I388-Q405 HydrophobicContact CD1-CG 4.24Å; I388-Y414 HydrophobicContact CD1-CD1 4.32Å; I388-Y414 HydrophobicContact CD1-CE1 3.6Å; I388-Y414 HydrophobicContact CG1-CE1 4.19Å; I388-Y466 PolarHBondContact N-O 3.38Å; I388-I467 HydrophobicContact CB-CG1 4.17Å; I388-I467 HydrophobicContact CD1-CG1 4.32Å; I388-I467 CarbonylContact O-C 3.48Å; I388-I467 WeakPolarHBondContact O-CA 3.39Å; I388-L468 PolarHBondContact O-N 2.76Å; I388-K491 CarbonylContact C-O 3.59Å; I388-K491 WeakPolarHBondContact CA-O 3.38Å; I388-K491 HydrophobicContact CG1-CB 4.43Å; I388-I493 HydrophobicContact CG2-CD1 4.15Å; I388-I493 HydrophobicContact CG2-CG1 3.4Å; I388-I493 VanDerWaalsContact CG2-CG1 3.4Å
389	M	96.7	Very high	91.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.3	171.3	-179.9	169.7	-79.5	0	0	110.9	V391 L468 N472 Q478 K481 M482 K491 A492 I493 F543	M389-V391 HydrophobicContact CG-CG2 3.99Å; M389-V391 HydrophobicContact SD-CG2 4.38Å; M389-L468 HydrophobicContact CE-CD1 4.01Å; M389-N472 HydrophobicContact CG-CB 3.94Å; M389-N472 WeakPolarHBondContact CG-ND2 3.4Å; M389-N472 HydrophobicContact SD-CB 3.7Å; M389-Q478 HydrophobicContact SD-CB 4.13Å; M389-Q478 HydrophobicContact SD-CG 3.91Å; M389-K481 HydrophobicContact CE-CB 3.7Å; M389-K481 HydrophobicContact CE-CD 4.05Å; M389-M482 HydrophobicContact CB-CE 4.42Å; M389-M482 HydrophobicContact CB-SD 3.95Å; M389-M482 HydrophobicContact CE-CG 3.73Å; M389-M482 HydrophobicContact CE-SD 3.55Å; M389-M482 VanDerWaalsContact CE-SD 3.55Å; M389-M482 HydrophobicContact SD-CG 4.29Å; M389-M482 HydrophobicContact SD-SD 4.35Å; M389-K491 PolarHBondContact N-O 2.81Å; M389-A492 WeakPolarHBondContact O-CA 3.4Å; M389-I493 PolarHBondContact O-N 3.2Å; M389-F543 HydrophobicContact CB-CE1 3.92Å; M389-F543 HydrophobicContact CB-CZ 4.47Å; M389-F543 HydrophobicContact SD-CE1 4.11Å; M389-F543 HydrophobicContact SD-CZ 3.75Å
390	M	96.5	Very high	91.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	132.5	169.6	-53.1	-47.4	-60.6	0	0	109.6	I388 K398 F401 A402 I467 L468 D469 Q470 N472 I493 I495	I388-M390 HydrophobicContact CG2-SD 4.21Å; M390-K398 HydrophobicContact CB-CB 4.13Å; M390-K398 HydrophobicContact CB-CD 3.89Å; M390-K398 HydrophobicContact CB-CG 4.14Å; M390-F401 HydrophobicContact CE-CB 4.02Å; M390-F401 HydrophobicContact CE-CD1 3.41Å; M390-F401 VanDerWaalsContact CE-CD1 3.41Å; M390-F401 HydrophobicContact CE-CE1 4.23Å; M390-F401 HydrophobicContact CE-CG 3.96Å; M390-F401 HydrophobicContact SD-CD1 4.15Å; M390-A402 HydrophobicContact CG-CB 4.49Å; M390-I467 HydrophobicContact CG-CG2 3.85Å; M390-I467 HydrophobicContact SD-CG2 3.84Å; M390-L468 PolarHBondContact N-O 3.4Å; M390-D469 HydrophobicContact CG-CB 4.31Å; M390-Q470 VanDerWaalsContact O-O 3.06Å; M390-N472 WeakPolarHBondContact O-CB 3.33Å; M390-N472 PolarHBondContact O-ND2 3.42Å; M390-I493 HydrophobicContact CE-CB 3.8Å; M390-I493 HydrophobicContact CE-CG1 4.4Å; M390-I493 HydrophobicContact CE-CG2 3.84Å; M390-I493 HydrophobicContact SD-CB 4.05Å; M390-I493 HydrophobicContact SD-CG1 4.18Å; M390-I495 HydrophobicContact CE-CD1 3.69Å; M390-I495 HydrophobicContact CE-CG1 4.22Å
391	V	95.9	Very high	92.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.2	178.2	-176	0	0	0	0	109.4	M389 T471 N472 I493 V494 I495 F529 P532	M389-V391 HydrophobicContact CG-CG2 3.99Å; M389-V391 HydrophobicContact SD-CG2 4.38Å; V391-T471 WeakPolarHBondContact CA-O 3.47Å; V391-N472 HydrophobicContact CG2-CB 4.14Å; V391-I493 PolarHBondContact N-O 3.39Å; V391-V494 HydrophobicContact CB-CG2 4.38Å; V391-I495 PolarHBondContact O-N 3.26Å; V391-F529 HydrophobicContact CG1-CE1 3.93Å; V391-F529 HydrophobicContact CG1-CZ 4.44Å; V391-P532 HydrophobicContact CG2-CG 4.39Å
392	G	93.8	Very high	92.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.			trans	156.4	159.7	179.9	0	0	0	0	0	113.5	K398 T471	G392-K398 WeakPolarHBondContact O-CE 3.25Å; G392-K398 PolarHBondContact O-NZ 3.41Å; G392-T471 PolarHBondContact N-O 2.86Å; G392-T471 VanDerWaalsContact O-CA 3.31Å; G392-T471 WeakPolarHBondContact O-CA 3.21Å; G392-T471 WeakPolarHBondContact O-CB 3.35Å
393	L	92.1	Very high	92.7	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.021	14%	0.136	C	C	.	.			trans	-60.4	160	-176.6	-68.5	176.8	0	0	0	113.4	A396 K398 V473 F502 M525 K526 F529 Y563	L393-A396 WeakPolarHBondContact O-CB 3.39Å; L393-A396 PolarHBondContact O-N 2.92Å; L393-K398 PolarHBondContact O-NZ 3.08Å; L393-V473 HydrophobicContact CD2-CG1 4.43Å; L393-F502 HydrophobicContact CB-CE2 3.61Å; L393-F502 HydrophobicContact CB-CZ 3.59Å; L393-F502 HydrophobicContact CD1-CE1 3.94Å; L393-F502 HydrophobicContact CD1-CE2 4.09Å; L393-F502 HydrophobicContact CD1-CZ 3.54Å; L393-F502 HydrophobicContact CG-CZ 4.22Å; L393-M525 HydrophobicContact CD2-CB 3.87Å; L393-K526 HydrophobicContact CD1-CG 3.84Å; L393-K526 HydrophobicContact CD2-CG 4.15Å; L393-F529 HydrophobicContact CD2-CD2 4.06Å; L393-F529 HydrophobicContact CG-CD2 4.02Å; L393-F529 HydrophobicContact CG-CE2 4.06Å; L393-Y563 HydrophobicContact CD1-CD2 3.74Å; L393-Y563 HydrophobicContact CD1-CE2 3.47Å; L393-Y563 VanDerWaalsContact CD1-CE2 3.47Å
394	P	87.6	Confident	92.8	Very high	21 Å²	21	26 Å²	26	14%	0.136	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	146.3	166.2	-23.8	34.3	0	0	0	111.2	A396 T471 F502 V517 M525	P394-A396 PolarHBondContact O-N 3.46Å; P394-A396 VanDerWaalsContact O-N 3.11Å; P394-T471 HydrophobicContact CG-CG2 4.01Å; P394-F502 WeakPolarHBondContact O-CE2 3.23Å; P394-V517 HydrophobicContact CB-CG1 4.01Å; P394-V517 HydrophobicContact CG-CG1 4.33Å; P394-M525 HydrophobicContact CG-CE 4.32Å; P394-M525 HydrophobicContact CG-SD 3.78Å
395	G	84.5	Confident	92.8	Very high	14 Å²	14	23.9 Å²	23.9	14%	0.144	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	-31.9	-177.8	0	0	0	0	0	116.1	G397 R509	G395-G397 PolarHBondContact O-N 3.2Å; G395-R509 PolarHBondContact O-NE 2.81Å
396	A	90.3	Very high	92.7	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.008	13%	0.129	C	C	.	.	S	Bend	trans	-64.6	16.7	-168.9	0	0	0	0	0	118.4	L393 P394 I495 P497 F502 R505	L393-A396 WeakPolarHBondContact O-CB 3.39Å; L393-A396 PolarHBondContact O-N 2.92Å; P394-A396 PolarHBondContact O-N 3.46Å; P394-A396 VanDerWaalsContact O-N 3.11Å; A396-I495 WeakPolarHBondContact O-CG2 3.48Å; A396-P497 HydrophobicContact CB-CG 4.17Å; A396-F502 HydrophobicContact CB-CD2 4.06Å; A396-F502 HydrophobicContact CB-CE2 3.96Å; A396-R505 PolarHBondContact O-NH1 2.95Å
397	G	88.4	Confident	92.4	Very high	12 Å²	12	29.9 Å²	29.9	12%	0.124	15%	0.149	C	C	.	.	S	Bend	trans	91.9	-8.7	171.4	0	0	0	0	0	118	G395 T399 Y400 F401	G395-G397 PolarHBondContact O-N 3.2Å; G397-T399 PolarHBondContact O-N 2.93Å; G397-T399 VanDerWaalsContact O-N 3.13Å; G397-Y400 WeakPolarHBondContact O-CB 3.18Å; G397-Y400 PolarHBondContact O-N 2.96Å; G397-F401 PolarHBondContact O-N 2.92Å; G397-F401 VanDerWaalsContact O-N 3.12Å
398	K	92.4	Very high	92.2	Very high	14 Å²	14	35.4 Å²	35.4	6%	0.061	18%	0.175	C	C	.	.	H	α-helix	trans	-43	-49.5	-177.8	-65.6	-176.5	-57.1	-67.5	0	116.7	M390 G392 L393 Y400 F401 A402 D469 Q470 I495	M390-K398 HydrophobicContact CB-CB 4.13Å; M390-K398 HydrophobicContact CB-CD 3.89Å; M390-K398 HydrophobicContact CB-CG 4.14Å; G392-K398 WeakPolarHBondContact O-CE 3.25Å; G392-K398 PolarHBondContact O-NZ 3.41Å; L393-K398 PolarHBondContact O-NZ 3.08Å; K398-Y400 VanDerWaalsContact C-N 3.34Å; K398-Y400 PolarHBondContact O-N 3.35Å; K398-F401 PolarHBondContact O-N 3.09Å; K398-A402 PolarHBondContact O-N 3.42Å; K398-D469 WeakPolarHBondContact CB-OD1 3.35Å; K398-Q470 VanDerWaalsContact CD-O 3.31Å; K398-Q470 WeakPolarHBondContact CD-O 3.43Å; K398-Q470 WeakPolarHBondContact CE-O 3.24Å; K398-I495 HydrophobicContact CG-CD1 4.49Å
399	T	90.9	Very high	91.8	Very high	28 Å²	28	38.1 Å²	38.1	17%	0.172	19%	0.187	C	C	.	.	H	α-helix	trans	-64.7	-39.8	-177.8	-46.1	0	0	0	0	111.4	G397 A402 E403 D469	G397-T399 PolarHBondContact O-N 2.93Å; G397-T399 VanDerWaalsContact O-N 3.13Å; T399-A402 PolarHBondContact O-N 3.35Å; T399-E403 WeakPolarHBondContact CG2-OE1 3.46Å; T399-E403 WeakPolarHBondContact O-CB 3.48Å; T399-E403 WeakPolarHBondContact O-CG 3.21Å; T399-E403 PolarHBondContact O-N 3.12Å; T399-D469 VanDerWaalsContact CB-OD2 3.32Å; T399-D469 WeakPolarHBondContact CB-OD2 3.48Å; T399-D469 WeakPolarHBondContact CG2-OD2 3.39Å; T399-D469 PolarHBondContact OG1-OD2 2.78Å
400	Y	91.5	Very high	91.3	Very high	159 Å²	159	43.9 Å²	43.9	62%	0.624	21%	0.209	S	C	*	.	H	α-helix	trans	-61.9	-45.5	174.6	172.9	-92.4	0	0	0	111.1	G397 K398 A402 E403 Q404	G397-Y400 WeakPolarHBondContact O-CB 3.18Å; G397-Y400 PolarHBondContact O-N 2.96Å; K398-Y400 VanDerWaalsContact C-N 3.34Å; K398-Y400 PolarHBondContact O-N 3.35Å; Y400-A402 VanDerWaalsContact C-N 3.33Å; Y400-A402 PolarHBondContact O-N 3.43Å; Y400-E403 PolarHBondContact O-N 3.12Å; Y400-Q404 VanDerWaalsContact O-CB 3.27Å; Y400-Q404 WeakPolarHBondContact O-CB 3.36Å; Y400-Q404 PolarHBondContact O-N 2.93Å
401	F	93.6	Very high	90.9	Very high	43 Å²	43	49.1 Å²	49.1	19%	0.189	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-39.6	173.9	-174.4	-80.5	0	0	0	112.1	M390 G397 K398 Q404 Q405 I493 I495 T549	M390-F401 HydrophobicContact CE-CB 4.02Å; M390-F401 HydrophobicContact CE-CD1 3.41Å; M390-F401 VanDerWaalsContact CE-CD1 3.41Å; M390-F401 HydrophobicContact CE-CE1 4.23Å; M390-F401 HydrophobicContact CE-CG 3.96Å; M390-F401 HydrophobicContact SD-CD1 4.15Å; G397-F401 PolarHBondContact O-N 2.92Å; G397-F401 VanDerWaalsContact O-N 3.12Å; K398-F401 PolarHBondContact O-N 3.09Å; F401-Q404 PolarHBondContact O-N 3.43Å; F401-Q405 HydrophobicContact CD1-CB 4.39Å; F401-Q405 HydrophobicContact CE1-CB 4.15Å; F401-Q405 HydrophobicContact CE1-CG 4.44Å; F401-Q405 WeakPolarHBondContact O-CB 3.49Å; F401-Q405 PolarHBondContact O-N 3.19Å; F401-I493 HydrophobicContact CD1-CG2 4.17Å; F401-I493 HydrophobicContact CE1-CB 4.46Å; F401-I493 HydrophobicContact CE1-CD1 4.47Å; F401-I493 HydrophobicContact CE1-CG1 4.02Å; F401-I493 HydrophobicContact CE1-CG2 3.86Å; F401-I493 HydrophobicContact CZ-CG2 4.06Å; F401-I495 HydrophobicContact CB-CD1 3.57Å; F401-I495 HydrophobicContact CD2-CD1 4.25Å; F401-I495 HydrophobicContact CG-CD1 3.86Å; F401-T549 HydrophobicContact CD2-CG2 4.11Å; F401-T549 HydrophobicContact CE2-CG2 3.56Å; F401-T549 HydrophobicContact CZ-CG2 3.99Å
402	A	93.9	Very high	90.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-39.1	178.3	0	0	0	0	0	112.5	M390 K398 T399 Y400 K406 I416 I467 D469	M390-A402 HydrophobicContact CG-CB 4.49Å; K398-A402 PolarHBondContact O-N 3.42Å; T399-A402 PolarHBondContact O-N 3.35Å; Y400-A402 VanDerWaalsContact C-N 3.33Å; Y400-A402 PolarHBondContact O-N 3.43Å; A402-K406 WeakPolarHBondContact O-CB 3.25Å; A402-K406 PolarHBondContact O-N 3.04Å; A402-K406 VanDerWaalsContact O-N 3.09Å; A402-I416 HydrophobicContact CB-CD1 4.18Å; A402-I416 HydrophobicContact CB-CG2 4.23Å; A402-I416 WeakPolarHBondContact O-CD1 3Å; A402-I467 HydrophobicContact CB-CG2 3.82Å; A402-D469 HydrophobicContact CB-CB 4.39Å
403	E	92.4	Very high	90.3	Very high	92 Å²	92	52.8 Å²	52.8	43%	0.43	25%	0.25	S	C	.	.	H	α-helix	trans	-69.5	-40.8	174.9	-71.8	163.6	176	0	0	111.5	T399 Y400 K406 T407 I416	T399-E403 WeakPolarHBondContact CG2-OE1 3.46Å; T399-E403 WeakPolarHBondContact O-CB 3.48Å; T399-E403 WeakPolarHBondContact O-CG 3.21Å; T399-E403 PolarHBondContact O-N 3.12Å; Y400-E403 PolarHBondContact O-N 3.12Å; E403-K406 PolarHBondContact O-N 2.56Å; E403-T407 WeakPolarHBondContact O-CB 3.29Å; E403-T407 PolarHBondContact O-N 2.8Å; E403-T407 PolarHBondContact O-OG1 3.09Å; E403-I416 HydrophobicContact CG-CD1 4.45Å
404	Q	93.2	Very high	90.3	Very high	66 Å²	66	52.9 Å²	52.9	31%	0.308	25%	0.25	S	C	.	.	H	α-helix	trans	-61.1	-51.9	172.2	-178.7	175.5	5.8	0	0	111.3	Y400 F401 K406 T407 E408	Y400-Q404 VanDerWaalsContact O-CB 3.27Å; Y400-Q404 WeakPolarHBondContact O-CB 3.36Å; Y400-Q404 PolarHBondContact O-N 2.93Å; F401-Q404 PolarHBondContact O-N 3.43Å; Q404-K406 VanDerWaalsContact C-N 3.26Å; Q404-K406 PolarHBondContact O-N 3.26Å; Q404-T407 CarbonylContact O-C 3.56Å; Q404-T407 WeakPolarHBondContact O-CA 3.45Å; Q404-T407 PolarHBondContact O-N 3.48Å; Q404-E408 VanDerWaalsContact CG-CD 3.47Å; Q404-E408 HydrophobicContact CG-CG 4.18Å; Q404-E408 VanDerWaalsContact CG-OE1 3.24Å; Q404-E408 WeakPolarHBondContact CG-OE1 3.24Å; Q404-E408 PolarHBondContact NE2-OE1 3.25Å; Q404-E408 PolarHBondContact O-N 3.31Å
405	Q	92.4	Very high	90.6	Very high	27 Å²	27	53 Å²	53	13%	0.126	25%	0.249	C	C	.	.	H	α-helix	trans	-57	-36.7	177.5	-175.6	76	63.5	0	0	112.3	I388 F401 H409 Y414 I467	I388-Q405 HydrophobicContact CD1-CG 4.24Å; F401-Q405 HydrophobicContact CD1-CB 4.39Å; F401-Q405 HydrophobicContact CE1-CB 4.15Å; F401-Q405 HydrophobicContact CE1-CG 4.44Å; F401-Q405 WeakPolarHBondContact O-CB 3.49Å; F401-Q405 PolarHBondContact O-N 3.19Å; Q405-H409 PolarHBondContact NE2-CD2 3.18Å; Q405-H409 WeakPolarHBondContact O-CB 3.07Å; Q405-H409 PolarHBondContact O-N 3.05Å; Q405-Y414 HydrophobicContact CG-CD2 4.14Å; Q405-Y414 HydrophobicContact CG-CE2 3.95Å; Q405-I467 HydrophobicContact CB-CD1 4.01Å; Q405-I467 HydrophobicContact CG-CD1 3.79Å
406	K	91.6	Very high	91	Very high	62 Å²	62	53.8 Å²	53.8	27%	0.27	25%	0.25	S	C	.	.	H	α-helix	trans	-69	-36.2	172.6	-178.3	-162.1	172.6	-156.6	0	112.3	D249 A402 E403 Q404 I416	D249-K406 WeakPolarHBondContact OD1-CE 3.42Å; D249-K406 IonicContact OD1-NZ 2.83Å; D249-K406 PolarHBondContact OD1-NZ 3.15Å; D249-K406 IonicContact OD2-NZ 3.19Å; D249-K406 PolarHBondContact OD2-NZ 2.83Å; A402-K406 WeakPolarHBondContact O-CB 3.25Å; A402-K406 PolarHBondContact O-N 3.04Å; A402-K406 VanDerWaalsContact O-N 3.09Å; E403-K406 PolarHBondContact O-N 2.56Å; Q404-K406 VanDerWaalsContact C-N 3.26Å; Q404-K406 PolarHBondContact O-N 3.26Å; K406-I416 HydrophobicContact CB-CD1 4.09Å; K406-I416 HydrophobicContact CD-CD1 3.99Å; K406-I416 HydrophobicContact CD-CG1 4.44Å
407	T	89.9	Confident	91.2	Very high	80 Å²	80	54.4 Å²	54.4	49%	0.491	25%	0.253	S	S	.	.	H	α-helix	trans	-80.3	-34.4	-175.3	-56.5	0	0	0	0	112.9	E403 Q404 R410	E403-T407 WeakPolarHBondContact O-CB 3.29Å; E403-T407 PolarHBondContact O-N 2.8Å; E403-T407 PolarHBondContact O-OG1 3.09Å; Q404-T407 CarbonylContact O-C 3.56Å; Q404-T407 WeakPolarHBondContact O-CA 3.45Å; Q404-T407 PolarHBondContact O-N 3.48Å; T407-R410 WeakPolarHBondContact O-CG 3.5Å
408	E	91.9	Very high	91.4	Very high	117 Å²	117	53.9 Å²	53.9	55%	0.547	25%	0.248	S	C	.	.	H	α-helix	trans	-79.1	-33.8	176.1	-69	173.2	171.4	0	0	111.9	Q404	Q404-E408 VanDerWaalsContact CG-CD 3.47Å; Q404-E408 HydrophobicContact CG-CG 4.18Å; Q404-E408 VanDerWaalsContact CG-OE1 3.24Å; Q404-E408 WeakPolarHBondContact CG-OE1 3.24Å; Q404-E408 PolarHBondContact NE2-OE1 3.25Å; Q404-E408 PolarHBondContact O-N 3.31Å
409	H	89.4	Confident	91.3	Very high	61 Å²	61	54.2 Å²	54.2	28%	0.282	25%	0.251	S	S	.	.			trans	-112	57.8	179.2	-70.4	-81.2	0	0	0	113.2	Q405 E411 K412 Y414	Q405-H409 PolarHBondContact NE2-CD2 3.18Å; Q405-H409 WeakPolarHBondContact O-CB 3.07Å; Q405-H409 PolarHBondContact O-N 3.05Å; H409-E411 WeakPolarHBondContact CA-OE2 3.43Å; H409-E411 IonicContact CE1-OE1 2.69Å; H409-E411 IonicContact CG-OE1 3.78Å; H409-E411 IonicContact ND1-OE1 4Å; H409-E411 PolarHBondContact ND1-OE1 3.26Å; H409-E411 PolarHBondContact O-N 2.9Å; H409-K412 HydrophobicContact CB-CD 4.25Å; H409-K412 PolarHBondContact O-N 3.45Å; H409-Y414 HydrophobicContact CB-CD2 4.07Å; H409-Y414 HydrophobicContact CB-CE2 3.67Å
410	R	85.9	Confident	91	Very high	120 Å²	120	56.1 Å²	56.1	45%	0.453	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-60.8	-32.4	179.1	-63.7	-171.4	178	-153.9	-6.8	112.7	D247 R376 T407 K412 Q413	D247-R410 VanDerWaalsContact CG-NH1 3.34Å; D247-R410 IonicContact OD2-CZ 2.8Å; D247-R410 IonicContact OD2-NH1 2.69Å; D247-R410 PolarHBondContact OD2-NH1 3.08Å; R376-R410 PolarHBondContact NH1-O 3.05Å; T407-R410 WeakPolarHBondContact O-CG 3.5Å; R410-K412 PolarHBondContact O-N 3.04Å; R410-Q413 PolarHBondContact O-N 3.4Å; R410-Q413 VanDerWaalsContact O-N 3.15Å
411	E	86.7	Confident	90.8	Very high	110 Å²	110	51 Å²	51	51%	0.514	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-58.9	-29.5	179	78.1	-66.9	166.9	0	0	112.5	H409	H409-E411 WeakPolarHBondContact CA-OE2 3.43Å; H409-E411 IonicContact CE1-OE1 2.69Å; H409-E411 IonicContact CG-OE1 3.78Å; H409-E411 IonicContact ND1-OE1 4Å; H409-E411 PolarHBondContact ND1-OE1 3.26Å; H409-E411 PolarHBondContact O-N 2.9Å
412	K	88.5	Confident	90.6	Very high	55 Å²	55	49.3 Å²	49.3	24%	0.239	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-86.7	-12.4	-179.7	-68.8	-178.6	-174.1	-176.4	0	114.6	E386 H409 R410 Y414 N465	E386-K412 IonicContact OE2-NZ 2.68Å; E386-K412 PolarHBondContact OE2-NZ 3.42Å; H409-K412 HydrophobicContact CB-CD 4.25Å; H409-K412 PolarHBondContact O-N 3.45Å; R410-K412 PolarHBondContact O-N 3.04Å; K412-Y414 HydrophobicContact CB-CD2 4.18Å; K412-Y414 HydrophobicContact CB-CE2 4Å; K412-Y414 HydrophobicContact CD-CE1 4.37Å; K412-Y414 HydrophobicContact CD-CE2 3.64Å; K412-Y414 VanDerWaalsContact CD-CZ 3.49Å; K412-Y414 WeakPolarHBondContact CD-OH 3.38Å; K412-Y414 HydrophobicContact CG-CE2 4.47Å; K412-Y414 PolarHBondContact NZ-OH 2.88Å; K412-Y414 PolarHBondContact O-N 2.84Å; K412-N465 PolarHBondContact O-ND2 2.83Å
413	Q	89.7	Confident	90.1	Very high	23 Å²	23	50.2 Å²	50.2	11%	0.107	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	39.9	63.4	-171.3	-69.1	-169	-6.6	0	0	113.4	N173 R410 N415	N173-Q413 PolarHBondContact OD1-NE2 3.13Å; N173-Q413 PolarHBondContact OD1-OE1 3.35Å; R410-Q413 PolarHBondContact O-N 3.4Å; R410-Q413 VanDerWaalsContact O-N 3.15Å; Q413-N415 PolarHBondContact O-N 2.81Å; Q413-N415 PolarHBondContact O-ND2 2.85Å
414	Y	92.7	Very high	89.6	Confident	6 Å²	6	47.4 Å²	47.4	2%	0.024	23%	0.228	C	C	.	.			trans	-62	110.4	177.2	-77.7	-64.8	0	0	0	111.9	E386 I388 Q405 H409 K412 I416 N465 I467	E386-Y414 HydrophobicContact CB-CE1 4.3Å; E386-Y414 PolarHBondContact OE2-OH 3.23Å; I388-Y414 HydrophobicContact CD1-CD1 4.32Å; I388-Y414 HydrophobicContact CD1-CE1 3.6Å; I388-Y414 HydrophobicContact CG1-CE1 4.19Å; Q405-Y414 HydrophobicContact CG-CD2 4.14Å; Q405-Y414 HydrophobicContact CG-CE2 3.95Å; H409-Y414 HydrophobicContact CB-CD2 4.07Å; H409-Y414 HydrophobicContact CB-CE2 3.67Å; K412-Y414 HydrophobicContact CB-CD2 4.18Å; K412-Y414 HydrophobicContact CB-CE2 4Å; K412-Y414 HydrophobicContact CD-CE1 4.37Å; K412-Y414 HydrophobicContact CD-CE2 3.64Å; K412-Y414 VanDerWaalsContact CD-CZ 3.49Å; K412-Y414 WeakPolarHBondContact CD-OH 3.38Å; K412-Y414 HydrophobicContact CG-CE2 4.47Å; K412-Y414 PolarHBondContact NZ-OH 2.88Å; K412-Y414 PolarHBondContact O-N 2.84Å; Y414-I416 PolarHBondContact O-N 2.86Å; Y414-N465 HydrophobicContact CD1-CB 3.68Å; Y414-N465 HydrophobicContact CE1-CB 3.88Å; Y414-I467 HydrophobicContact CD1-CD1 4.15Å; Y414-I467 HydrophobicContact CD1-CG1 3.85Å; Y414-I467 HydrophobicContact CD2-CD1 4.26Å; Y414-I467 HydrophobicContact CG-CD1 3.79Å; Y414-I467 HydrophobicContact CG-CG1 3.98Å
415	N	92.9	Very high	89	Confident	22 Å²	22	46.6 Å²	46.6	12%	0.118	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	104.1	176.3	-75.9	-98.6	0	0	0	109.4	Q413 N465 Y466 I467	Q413-N415 PolarHBondContact O-N 2.81Å; Q413-N415 PolarHBondContact O-ND2 2.85Å; N415-N465 PolarHBondContact N-O 3.27Å; N415-Y466 HydrophobicContact CB-CD1 3.67Å; N415-Y466 HydrophobicContact CB-CE1 3.88Å; N415-Y466 WeakPolarHBondContact O-CA 3.18Å; N415-I467 PolarHBondContact O-N 2.98Å
416	I	93.9	Very high	88.5	Confident	31 Å²	31	45.6 Å²	45.6	16%	0.159	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125	-178.1	-43.6	176.4	0	0	0	110.5	A402 E403 K406 Y414 L421 I467 D469	A402-I416 HydrophobicContact CB-CD1 4.18Å; A402-I416 HydrophobicContact CB-CG2 4.23Å; A402-I416 WeakPolarHBondContact O-CD1 3Å; E403-I416 HydrophobicContact CG-CD1 4.45Å; K406-I416 HydrophobicContact CB-CD1 4.09Å; K406-I416 HydrophobicContact CD-CD1 3.99Å; K406-I416 HydrophobicContact CD-CG1 4.44Å; Y414-I416 PolarHBondContact O-N 2.86Å; I416-L421 HydrophobicContact CB-CD1 3.56Å; I416-L421 HydrophobicContact CG2-CD1 3.46Å; I416-L421 VanDerWaalsContact CG2-CD1 3.46Å; I416-L421 WeakPolarHBondContact O-CD1 3.49Å; I416-I467 CarbonylContact C-O 3.58Å; I416-I467 WeakPolarHBondContact CA-O 3.37Å; I416-I467 HydrophobicContact CG1-CB 4.32Å; I416-I467 HydrophobicContact CG1-CD1 4.38Å; I416-I467 HydrophobicContact CG2-CB 4.25Å; I416-I467 HydrophobicContact CG2-CG2 4.4Å; I416-D469 HydrophobicContact CG2-CB 4.03Å
417	L	93.8	Very high	87.6	Confident	15 Å²	15	44.9 Å²	44.9	8%	0.079	22%	0.216	C	C	.	.			trans	-119.5	102.2	-178.1	-56.4	179.5	0	0	0	110.5	L176 L452 A459 Y466 I467 L468 D469	L176-L417 HydrophobicContact CD1-CD1 4.15Å; L176-L417 HydrophobicContact CD1-CD2 4.01Å; L417-L452 HydrophobicContact CB-CD1 4.02Å; L417-A459 HydrophobicContact CD1-CB 3.96Å; L417-Y466 HydrophobicContact CD1-CD1 3.95Å; L417-Y466 HydrophobicContact CG-CD1 4.42Å; L417-I467 PolarHBondContact N-O 3.24Å; L417-L468 HydrophobicContact CB-CD2 4.01Å; L417-L468 HydrophobicContact CD1-CD2 4.11Å; L417-D469 PolarHBondContact O-N 2.94Å
418	G	92.5	Very high	86.2	Confident	1 Å²	1	43 Å²	43	1%	0.01	21%	0.205	C	C	.	.			trans	-145.7	156.7	177.7	0	0	0	0	0	112.3	N420 L421 I422 D469	G418-N420 PolarHBondContact O-N 3.06Å; G418-L421 PolarHBondContact O-N 3.48Å; G418-I422 WeakPolarHBondContact O-CG1 3.22Å; G418-I422 PolarHBondContact O-N 3.28Å; G418-I422 VanDerWaalsContact O-N 3.15Å; G418-D469 VanDerWaalsContact CA-O 3.27Å; G418-D469 WeakPolarHBondContact CA-O 3.08Å
419	T	89.6	Confident	84.7	Confident	20 Å²	20	39.4 Å²	39.4	12%	0.123	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-34.1	-179.4	-48.1	0	0	0	0	111.9	I422 L423 A448 Q470	T419-I422 PolarHBondContact O-N 2.89Å; T419-L423 HydrophobicContact CG2-CD1 4.15Å; T419-L423 HydrophobicContact CG2-CG 4.47Å; T419-L423 WeakPolarHBondContact O-CB 3.38Å; T419-L423 VanDerWaalsContact O-CG 3.31Å; T419-L423 WeakPolarHBondContact O-CG 3.4Å; T419-L423 PolarHBondContact O-N 3.22Å; T419-A448 HydrophobicContact CG2-CB 3.74Å; T419-Q470 PolarHBondContact OG1-NE2 2.81Å
420	N	85.6	Confident	82.7	Confident	68 Å²	68	39.8 Å²	39.8	36%	0.364	21%	0.208	S	C	.	.	H	α-helix	trans	-61.4	-53.4	178.1	-67.2	-24.8	0	0	0	111.5	G418 I422 L423 D424	G418-N420 PolarHBondContact O-N 3.06Å; N420-I422 VanDerWaalsContact C-N 3.28Å; N420-I422 PolarHBondContact O-N 2.66Å; N420-L423 CarbonylContact O-C 3.59Å; N420-L423 WeakPolarHBondContact O-CA 3.39Å; N420-L423 WeakPolarHBondContact O-CB 3.25Å; N420-L423 PolarHBondContact O-N 3.19Å; N420-D424 VanDerWaalsContact O-CG 3.32Å; N420-D424 PolarHBondContact O-N 2.92Å
421	L	87	Confident	81.3	Confident	51 Å²	51	37.6 Å²	37.6	27%	0.267	21%	0.205	S	C	.	.	H	α-helix	trans	-62.3	-35.4	179.7	-62.1	172.6	0	0	0	112.3	I416 G418 D424 K425	I416-L421 HydrophobicContact CB-CD1 3.56Å; I416-L421 HydrophobicContact CG2-CD1 3.46Å; I416-L421 VanDerWaalsContact CG2-CD1 3.46Å; I416-L421 WeakPolarHBondContact O-CD1 3.49Å; G418-L421 PolarHBondContact O-N 3.48Å; L421-D424 PolarHBondContact O-N 2.81Å; L421-K425 PolarHBondContact O-N 3.28Å
422	I	89.2	Confident	79.6	Confident	8 Å²	8	35.7 Å²	35.7	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-45.5	172.8	-70.8	167	0	0	0	110.8	M198 G418 T419 N420 D424 K425 M426 A448 C451 L452 L455	M198-I422 HydrophobicContact CE-CG2 3.77Å; G418-I422 WeakPolarHBondContact O-CG1 3.22Å; G418-I422 PolarHBondContact O-N 3.28Å; G418-I422 VanDerWaalsContact O-N 3.15Å; T419-I422 PolarHBondContact O-N 2.89Å; N420-I422 VanDerWaalsContact C-N 3.28Å; N420-I422 PolarHBondContact O-N 2.66Å; I422-D424 VanDerWaalsContact C-N 3.27Å; I422-D424 PolarHBondContact O-N 3.34Å; I422-K425 PolarHBondContact O-N 2.98Å; I422-M426 HydrophobicContact CG2-CE 3.69Å; I422-M426 HydrophobicContact CG2-SD 4.36Å; I422-M426 VanDerWaalsContact O-CG 3.25Å; I422-M426 WeakPolarHBondContact O-CG 3.4Å; I422-M426 PolarHBondContact O-N 3.15Å; I422-A448 HydrophobicContact CB-CB 4.44Å; I422-A448 HydrophobicContact CG2-CB 3.65Å; I422-C451 HydrophobicContact CG2-CB 4.15Å; I422-L452 HydrophobicContact CD1-CB 3.51Å; I422-L452 HydrophobicContact CD1-CD1 3.64Å; I422-L452 HydrophobicContact CD1-CG 4.1Å; I422-L455 HydrophobicContact CD1-CD1 3.82Å; I422-L455 HydrophobicContact CG1-CD1 4.03Å
423	L	83.6	Confident	77.9	Confident	20 Å²	20	36.6 Å²	36.6	11%	0.105	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-32.1	174.3	-72.3	167.5	0	0	0	111.9	T419 N420 M426 K427 W441 L444 I445 A448	T419-L423 HydrophobicContact CG2-CD1 4.15Å; T419-L423 HydrophobicContact CG2-CG 4.47Å; T419-L423 WeakPolarHBondContact O-CB 3.38Å; T419-L423 VanDerWaalsContact O-CG 3.31Å; T419-L423 WeakPolarHBondContact O-CG 3.4Å; T419-L423 PolarHBondContact O-N 3.22Å; N420-L423 CarbonylContact O-C 3.59Å; N420-L423 WeakPolarHBondContact O-CA 3.39Å; N420-L423 WeakPolarHBondContact O-CB 3.25Å; N420-L423 PolarHBondContact O-N 3.19Å; L423-M426 HydrophobicContact CD2-SD 4.49Å; L423-M426 PolarHBondContact O-N 2.87Å; L423-K427 PolarHBondContact O-N 2.76Å; L423-W441 HydrophobicContact CD1-CH2 4.09Å; L423-W441 HydrophobicContact CD1-CZ3 4.36Å; L423-L444 HydrophobicContact CD2-CB 4.13Å; L423-I445 HydrophobicContact CD1-CG1 4.38Å; L423-A448 HydrophobicContact CD2-CB 3.72Å; L423-A448 HydrophobicContact CG-CB 3.78Å
424	D	80.8	Confident	75.8	Confident	32 Å²	32	40.7 Å²	40.7	17%	0.171	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-46.8	173.7	-65.5	-50	0	0	0	111.8	N420 L421 I422 M426 K427 R433	N420-D424 VanDerWaalsContact O-CG 3.32Å; N420-D424 PolarHBondContact O-N 2.92Å; L421-D424 PolarHBondContact O-N 2.81Å; I422-D424 VanDerWaalsContact C-N 3.27Å; I422-D424 PolarHBondContact O-N 3.34Å; D424-M426 PolarHBondContact O-N 3.01Å; D424-K427 WeakPolarHBondContact O-CB 3.49Å; D424-K427 WeakPolarHBondContact O-CD 3.42Å; D424-K427 VanDerWaalsContact O-CG 3.29Å; D424-K427 WeakPolarHBondContact O-CG 3.26Å; D424-K427 PolarHBondContact O-N 3.03Å; D424-K427 VanDerWaalsContact O-N 3.14Å; D424-K427 WeakPolarHBondContact OD1-CE 3.44Å; D424-K427 IonicContact OD1-NZ 3.46Å; D424-K427 PolarHBondContact OD1-NZ 3.12Å; D424-R433 VanDerWaalsContact CG-NH2 3.31Å; D424-R433 IonicContact OD1-CZ 3.26Å; D424-R433 IonicContact OD1-NE 2.66Å; D424-R433 PolarHBondContact OD1-NE 3.04Å; D424-R433 IonicContact OD1-NH2 2.76Å; D424-R433 PolarHBondContact OD1-NH2 3.05Å; D424-R433 VanDerWaalsContact OD1-NH2 3.12Å; D424-R433 IonicContact OD2-CZ 3.72Å; D424-R433 IonicContact OD2-NE 2.7Å; D424-R433 IonicContact OD2-NH2 3.96Å; D424-R433 PolarHBondContact OD2-NH2 3.16Å
425	K	82.3	Confident	73.6	Confident	50 Å²	50	48.7 Å²	48.7	22%	0.217	26%	0.259	C	S	.	.	H	α-helix	trans	-66.7	-14.6	173.7	-68.3	-162	174.7	-163.4	0	113.8	D175 M198 W199 L421 I422	D175-K425 IonicContact OD1-NZ 2.92Å; D175-K425 PolarHBondContact OD1-NZ 2.81Å; D175-K425 IonicContact OD2-NZ 3.52Å; D175-K425 PolarHBondContact OD2-NZ 2.86Å; M198-K425 WeakPolarHBondContact CA-O 3.42Å; M198-K425 HydrophobicContact CG-CB 3.6Å; M198-K425 HydrophobicContact SD-CB 4.42Å; W199-K425 PolarHBondContact N-O 2.67Å; L421-K425 PolarHBondContact O-N 3.28Å; I422-K425 PolarHBondContact O-N 2.98Å
426	M	81.8	Confident	71.5	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.025	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-7.8	173.3	-72.9	-177.5	-179.4	0	0	114.7	G194 L197 M198 I422 L423 D424 A448 C451	G194-M426 WeakPolarHBondContact O-CE 3.29Å; L197-M426 HydrophobicContact CB-CB 4.01Å; L197-M426 HydrophobicContact CB-CG 3.79Å; L197-M426 HydrophobicContact CB-SD 4.26Å; L197-M426 HydrophobicContact CD1-SD 4.38Å; L197-M426 WeakPolarHBondContact O-CA 3.45Å; M198-M426 HydrophobicContact CB-CG 4.42Å; M198-M426 HydrophobicContact CE-CE 3.8Å; I422-M426 HydrophobicContact CG2-CE 3.69Å; I422-M426 HydrophobicContact CG2-SD 4.36Å; I422-M426 VanDerWaalsContact O-CG 3.25Å; I422-M426 WeakPolarHBondContact O-CG 3.4Å; I422-M426 PolarHBondContact O-N 3.15Å; L423-M426 HydrophobicContact CD2-SD 4.49Å; L423-M426 PolarHBondContact O-N 2.87Å; D424-M426 PolarHBondContact O-N 3.01Å; M426-A448 HydrophobicContact CE-CB 4.28Å; M426-A448 HydrophobicContact SD-CB 4.3Å; M426-C451 HydrophobicContact CE-CB 4.33Å
427	K	71.9	Confident	69.7	Low	47 Å²	47	51.7 Å²	51.7	20%	0.204	27%	0.273	C	S	.	.	S	Bend	trans	-66.3	162.9	-177.7	-69.5	169.5	-179.8	159.8	0	113.5	L423 D424	L423-K427 PolarHBondContact O-N 2.76Å; D424-K427 WeakPolarHBondContact O-CB 3.49Å; D424-K427 WeakPolarHBondContact O-CD 3.42Å; D424-K427 VanDerWaalsContact O-CG 3.29Å; D424-K427 WeakPolarHBondContact O-CG 3.26Å; D424-K427 PolarHBondContact O-N 3.03Å; D424-K427 VanDerWaalsContact O-N 3.14Å; D424-K427 WeakPolarHBondContact OD1-CE 3.44Å; D424-K427 IonicContact OD1-NZ 3.46Å; D424-K427 PolarHBondContact OD1-NZ 3.12Å
428	V	60.7	Low	67.8	Low	41 Å²	41	58.6 Å²	58.6	25%	0.248	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-71.2	133.7	150.3	-174.8	0	0	0	0	108.5	V232 I431	V232-V428 HydrophobicContact CG1-CG2 3.59Å; V428-I431 HydrophobicContact CB-CD1 4.02Å; V428-I431 HydrophobicContact CB-CG1 4.41Å; V428-I431 HydrophobicContact CG1-CD1 3.91Å; V428-I431 HydrophobicContact CG1-CG1 4.41Å; V428-I431 PolarHBondContact O-N 2.9Å
429	M	60	Low	66.2	Low	42 Å²	42	62.5 Å²	62.5	21%	0.207	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	136.9	-174.6	-49.5	-86.8	68.9	0	0	111.2	W199 R240 E254 Y330 I431	W199-M429 HydrophobicContact CD2-SD 4.16Å; W199-M429 HydrophobicContact CH2-SD 4.36Å; W199-M429 HydrophobicContact CZ2-CG 3.77Å; W199-M429 HydrophobicContact CZ2-SD 3.61Å; R240-M429 PolarHBondContact NH2-SD 3.21Å; E254-M429 WeakPolarHBondContact OE1-CE 3.47Å; Y330-M429 HydrophobicContact CE1-SD 4.06Å; M429-I431 VanDerWaalsContact C-N 3.3Å; M429-I431 PolarHBondContact O-N 3.22Å
430	G	48.4	Very low	65.1	Low	68 Å²	68	67.5 Å²	67.5	70%	0.701	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	-2.1	178.1	0	0	0	0	0	116.9
431	I	55.8	Low	64.5	Low	75 Å²	75	69.1 Å²	69.1	39%	0.385	36%	0.363	S	S	.	.			trans	-104.5	131.7	-176.9	-48.2	-174.2	0	0	0	112.3	V428 M429	V428-I431 HydrophobicContact CB-CD1 4.02Å; V428-I431 HydrophobicContact CB-CG1 4.41Å; V428-I431 HydrophobicContact CG1-CD1 3.91Å; V428-I431 HydrophobicContact CG1-CG1 4.41Å; V428-I431 PolarHBondContact O-N 2.9Å; M429-I431 VanDerWaalsContact C-N 3.3Å; M429-I431 PolarHBondContact O-N 3.22Å
432	A	51.3	Low	63.9	Low	70 Å²	70	72.3 Å²	72.3	58%	0.579	38%	0.381	S	S	*	.			trans	-70.6	153.3	179	0	0	0	0	0	113.3	Q434	A432-Q434 PolarHBondContact O-N 3.33Å
433	R	51.6	Low	63.4	Low	73 Å²	73	75.6 Å²	75.6	28%	0.275	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.5	-173.2	-61.5	-173.2	-165.6	138.7	9.1	115.1	D424 E513	D424-R433 VanDerWaalsContact CG-NH2 3.31Å; D424-R433 IonicContact OD1-CZ 3.26Å; D424-R433 IonicContact OD1-NE 2.66Å; D424-R433 PolarHBondContact OD1-NE 3.04Å; D424-R433 IonicContact OD1-NH2 2.76Å; D424-R433 PolarHBondContact OD1-NH2 3.05Å; D424-R433 VanDerWaalsContact OD1-NH2 3.12Å; D424-R433 IonicContact OD2-CZ 3.72Å; D424-R433 IonicContact OD2-NE 2.7Å; D424-R433 IonicContact OD2-NH2 3.96Å; D424-R433 PolarHBondContact OD2-NH2 3.16Å; R433-E513 IonicContact NH1-OE2 2.64Å
434	Q	47	Very low	63.2	Low	110 Å²	110	75 Å²	75	51%	0.514	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-23.1	-153.7	-75.4	173.6	-9.8	0	0	117.2	A432 E513	A432-Q434 PolarHBondContact O-N 3.33Å; Q434-E513 PolarHBondContact NE2-O 3.34Å
435	R	46.1	Very low	63.3	Low	174 Å²	174	76.3 Å²	76.3	66%	0.657	40%	0.404	S	S	*	.	S	Bend	trans	-112.9	-24.8	-173.1	-76	-172.4	172.5	-174.2	-1.6	116.1	Y437 H438	R435-Y437 PolarHBondContact O-N 3.14Å; R435-H438 PolarHBondContact O-CD2 3.43Å
436	N	48.2	Very low	63.5	Low	81 Å²	81	77.9 Å²	77.9	43%	0.433	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.4	-163.1	-69.7	29.4	0	0	0	115.7
437	Y	56.4	Low	63.8	Low	34 Å²	34	79.3 Å²	79.3	13%	0.133	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.2	15.7	-164.3	-57.5	-56.6	0	0	0	116.1	V232 R435 G439 R440 W441 L444	V232-Y437 HydrophobicContact CG2-CE1 4.41Å; R435-Y437 PolarHBondContact O-N 3.14Å; Y437-G439 PolarHBondContact O-N 3.48Å; Y437-R440 PolarHBondContact O-N 3.29Å; Y437-W441 PolarHBondContact O-N 2.86Å; Y437-L444 HydrophobicContact CD1-CD1 3.31Å; Y437-L444 HydrophobicContact CD2-CD1 4.41Å; Y437-L444 HydrophobicContact CE1-CD1 3.82Å; Y437-L444 HydrophobicContact CG-CD1 3.64Å
438	H	54.3	Low	64.6	Low	160 Å²	160	77 Å²	77	74%	0.741	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	134.9	173	-70.4	-78.6	0	0	0	111.4	R435 R440	R435-H438 PolarHBondContact O-CD2 3.43Å; H438-R440 PolarHBondContact O-N 3.43Å
439	G	57.7	Low	66.1	Low	84 Å²	84	77.4 Å²	77.4	87%	0.866	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	-2.3	179.7	0	0	0	0	0	116.6	Y437	Y437-G439 PolarHBondContact O-N 3.48Å
440	R	67.8	Low	67.6	Low	125 Å²	125	81.1 Å²	81.1	47%	0.472	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	0	178.9	-70.1	175.1	173.5	172.6	-8.1	114.4	S230 Y437 H438 D442 V443 L444	S230-R440 PolarHBondContact O-NH1 3.48Å; S230-R440 PolarHBondContact O-NH2 3.36Å; S230-R440 VanDerWaalsContact O-NH2 3.14Å; Y437-R440 PolarHBondContact O-N 3.29Å; H438-R440 PolarHBondContact O-N 3.43Å; R440-D442 VanDerWaalsContact C-N 3.32Å; R440-D442 PolarHBondContact O-N 3.27Å; R440-V443 PolarHBondContact O-N 2.93Å; R440-L444 PolarHBondContact O-N 2.84Å
441	W	72.3	Confident	69.7	Low	101 Å²	101	78 Å²	78	38%	0.383	40%	0.396	S	S	.	.	H	α-helix	trans	-50	-46	-178.6	-178.6	-115.2	0	0	0	113.5	L423 Y437 V443 L444 I445	L423-W441 HydrophobicContact CD1-CH2 4.09Å; L423-W441 HydrophobicContact CD1-CZ3 4.36Å; Y437-W441 PolarHBondContact O-N 2.86Å; W441-V443 PolarHBondContact O-N 3.14Å; W441-L444 PolarHBondContact O-N 2.87Å; W441-L444 VanDerWaalsContact O-N 3.14Å; W441-I445 HydrophobicContact CD2-CD1 4.26Å; W441-I445 HydrophobicContact CD2-CG1 4.4Å; W441-I445 VanDerWaalsContact CE2-CD1 3.5Å; W441-I445 HydrophobicContact CZ2-CD1 3.77Å; W441-I445 HydrophobicContact CZ2-CG1 4.23Å; W441-I445 VanDerWaalsContact NE1-CD1 3.28Å; W441-I445 PolarHBondContact O-N 3.29Å
442	D	75.5	Confident	71.5	Confident	119 Å²	119	74.6 Å²	74.6	64%	0.636	38%	0.378	S	S	*	.	H	α-helix	trans	-62.7	-43.5	-178.2	-52.2	-59.2	0	0	0	112	R440 L444 I445 D446	R440-D442 VanDerWaalsContact C-N 3.32Å; R440-D442 PolarHBondContact O-N 3.27Å; D442-L444 VanDerWaalsContact C-N 3.26Å; D442-L444 PolarHBondContact O-N 3.07Å; D442-I445 PolarHBondContact O-N 2.9Å; D442-D446 VanDerWaalsContact O-CB 3.24Å; D442-D446 WeakPolarHBondContact O-CB 2.88Å; D442-D446 PolarHBondContact O-N 2.83Å
443	V	78.1	Confident	73.5	Confident	77 Å²	77	73.8 Å²	73.8	47%	0.467	36%	0.364	S	S	.	.	H	α-helix	trans	-61.9	-35.8	177.2	-178	0	0	0	0	111.2	R440 W441 K447	R440-V443 PolarHBondContact O-N 2.93Å; W441-V443 PolarHBondContact O-N 3.14Å; V443-K447 WeakPolarHBondContact O-CB 3.47Å; V443-K447 WeakPolarHBondContact O-CG 3.4Å; V443-K447 PolarHBondContact O-N 2.94Å
444	L	79.1	Confident	75.4	Confident	6 Å²	6	73.2 Å²	73.2	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-75.1	-42.3	177.7	-67.5	169.5	0	0	0	112.1	L197 L423 Y437 R440 W441 D442 D446 K447 A448	L197-L444 HydrophobicContact CD1-CD2 3.75Å; L423-L444 HydrophobicContact CD2-CB 4.13Å; Y437-L444 HydrophobicContact CD1-CD1 3.31Å; Y437-L444 HydrophobicContact CD2-CD1 4.41Å; Y437-L444 HydrophobicContact CE1-CD1 3.82Å; Y437-L444 HydrophobicContact CG-CD1 3.64Å; R440-L444 PolarHBondContact O-N 2.84Å; W441-L444 PolarHBondContact O-N 2.87Å; W441-L444 VanDerWaalsContact O-N 3.14Å; D442-L444 VanDerWaalsContact C-N 3.26Å; D442-L444 PolarHBondContact O-N 3.07Å; L444-D446 VanDerWaalsContact C-N 3.27Å; L444-D446 PolarHBondContact O-N 3.32Å; L444-K447 PolarHBondContact O-N 2.85Å; L444-A448 VanDerWaalsContact O-CB 3.28Å; L444-A448 WeakPolarHBondContact O-CB 3.48Å; L444-A448 PolarHBondContact O-N 2.99Å
445	I	83.9	Confident	77.7	Confident	60 Å²	60	68.4 Å²	68.4	31%	0.308	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-42.7	170.6	-79.7	-174.5	0	0	0	110.6	L423 W441 D442 A448 T449	L423-I445 HydrophobicContact CD1-CG1 4.38Å; W441-I445 HydrophobicContact CD2-CD1 4.26Å; W441-I445 HydrophobicContact CD2-CG1 4.4Å; W441-I445 VanDerWaalsContact CE2-CD1 3.5Å; W441-I445 HydrophobicContact CZ2-CD1 3.77Å; W441-I445 HydrophobicContact CZ2-CG1 4.23Å; W441-I445 VanDerWaalsContact NE1-CD1 3.28Å; W441-I445 PolarHBondContact O-N 3.29Å; D442-I445 PolarHBondContact O-N 2.9Å; I445-A448 PolarHBondContact O-N 2.89Å; I445-T449 WeakPolarHBondContact O-CB 3.39Å; I445-T449 PolarHBondContact O-N 3.04Å; I445-T449 PolarHBondContact O-OG1 2.78Å
446	D	86.2	Confident	79.9	Confident	84 Å²	84	60.5 Å²	60.5	45%	0.449	32%	0.318	S	S	.	.	H	α-helix	trans	-69.4	-39.6	-177	-150.6	38.9	0	0	0	110.9	D442 L444 K450	D442-D446 VanDerWaalsContact O-CB 3.24Å; D442-D446 WeakPolarHBondContact O-CB 2.88Å; D442-D446 PolarHBondContact O-N 2.83Å; L444-D446 VanDerWaalsContact C-N 3.27Å; L444-D446 PolarHBondContact O-N 3.32Å; D446-K450 WeakPolarHBondContact O-CB 3.2Å; D446-K450 VanDerWaalsContact O-CD 3.23Å; D446-K450 WeakPolarHBondContact O-CD 3.42Å; D446-K450 WeakPolarHBondContact O-CG 3.41Å; D446-K450 PolarHBondContact O-N 3.3Å; D446-K450 IonicContact OD1-NZ 3.5Å; D446-K450 WeakPolarHBondContact OD2-CE 3.38Å; D446-K450 IonicContact OD2-NZ 2.79Å; D446-K450 PolarHBondContact OD2-NZ 3.38Å
447	K	87	Confident	82	Confident	34 Å²	34	59.5 Å²	59.5	15%	0.148	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-50.9	169.1	-80.8	-174.6	173.1	-146.9	0	112.2	G193 L197 L231 V443 L444 T449 K450 C451	G193-K447 VanDerWaalsContact O-CE 3.25Å; G193-K447 WeakPolarHBondContact O-CE 3.14Å; G193-K447 PolarHBondContact O-NZ 2.95Å; L197-K447 HydrophobicContact CD1-CD 4.25Å; L231-K447 HydrophobicContact CD1-CD 4.29Å; L231-K447 VanDerWaalsContact CD1-NZ 3.25Å; V443-K447 WeakPolarHBondContact O-CB 3.47Å; V443-K447 WeakPolarHBondContact O-CG 3.4Å; V443-K447 PolarHBondContact O-N 2.94Å; L444-K447 PolarHBondContact O-N 2.85Å; K447-T449 VanDerWaalsContact C-N 3.32Å; K447-T449 PolarHBondContact O-N 3.42Å; K447-K450 PolarHBondContact O-N 3.24Å; K447-C451 PolarHBondContact O-N 3.08Å; K447-C451 PolarHBondContact O-SG 3.33Å
448	A	89.3	Confident	83.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-37.9	-179.8	0	0	0	0	0	112.3	T419 I422 L423 M426 L444 I445 C451 L452	T419-A448 HydrophobicContact CG2-CB 3.74Å; I422-A448 HydrophobicContact CB-CB 4.44Å; I422-A448 HydrophobicContact CG2-CB 3.65Å; L423-A448 HydrophobicContact CD2-CB 3.72Å; L423-A448 HydrophobicContact CG-CB 3.78Å; M426-A448 HydrophobicContact CE-CB 4.28Å; M426-A448 HydrophobicContact SD-CB 4.3Å; L444-A448 VanDerWaalsContact O-CB 3.28Å; L444-A448 WeakPolarHBondContact O-CB 3.48Å; L444-A448 PolarHBondContact O-N 2.99Å; I445-A448 PolarHBondContact O-N 2.89Å; A448-C451 WeakPolarHBondContact O-CB 3.31Å; A448-C451 PolarHBondContact O-N 3.2Å; A448-L452 PolarHBondContact O-N 2.72Å
449	T	91.3	Very high	85.4	Confident	48 Å²	48	51.2 Å²	51.2	29%	0.294	28%	0.28	S	S	.	.	H	α-helix	trans	-67.5	-39.6	175.3	-60.8	0	0	0	0	111.4	I445 K447 L452 N453	I445-T449 WeakPolarHBondContact O-CB 3.39Å; I445-T449 PolarHBondContact O-N 3.04Å; I445-T449 PolarHBondContact O-OG1 2.78Å; K447-T449 VanDerWaalsContact C-N 3.32Å; K447-T449 PolarHBondContact O-N 3.42Å; T449-L452 PolarHBondContact O-N 3.42Å; T449-N453 PolarHBondContact O-N 3.18Å; T449-N453 PolarHBondContact O-ND2 2.9Å
450	K	92.1	Very high	87	Confident	121 Å²	121	48 Å²	48	53%	0.526	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-46.5	172.6	-72.3	159	-168.2	165.6	0	110.9	D446 K447 L452 N453 T454	D446-K450 WeakPolarHBondContact O-CB 3.2Å; D446-K450 VanDerWaalsContact O-CD 3.23Å; D446-K450 WeakPolarHBondContact O-CD 3.42Å; D446-K450 WeakPolarHBondContact O-CG 3.41Å; D446-K450 PolarHBondContact O-N 3.3Å; D446-K450 IonicContact OD1-NZ 3.5Å; D446-K450 WeakPolarHBondContact OD2-CE 3.38Å; D446-K450 IonicContact OD2-NZ 2.79Å; D446-K450 PolarHBondContact OD2-NZ 3.38Å; K447-K450 PolarHBondContact O-N 3.24Å; K450-L452 PolarHBondContact O-N 3.09Å; K450-N453 PolarHBondContact O-N 2.84Å; K450-T454 PolarHBondContact O-N 3.43Å; K450-T454 PolarHBondContact O-OG1 2.85Å
451	C	92.7	Very high	87.9	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-55.6	-46.6	172.7	-72	0	0	0	0	112.5	G194 F195 M198 I422 M426 K447 A448 N453 T454 L455	G194-C451 VanDerWaalsContact C-SG 3.51Å; G194-C451 VanDerWaalsContact CA-SG 3.59Å; F195-C451 HydrophobicContact CD1-CB 4.32Å; F195-C451 HydrophobicContact CE1-CB 3.85Å; F195-C451 HydrophobicContact CE2-CB 4.09Å; F195-C451 HydrophobicContact CZ-CB 3.73Å; F195-C451 WeakPolarHBondContact CZ-O 3.49Å; F195-C451 PolarHBondContact N-SG 2.87Å; F195-C451 VanDerWaalsContact N-SG 3.42Å; M198-C451 HydrophobicContact CE-CB 3.97Å; I422-C451 HydrophobicContact CG2-CB 4.15Å; M426-C451 HydrophobicContact CE-CB 4.33Å; K447-C451 PolarHBondContact O-N 3.08Å; K447-C451 PolarHBondContact O-SG 3.33Å; A448-C451 WeakPolarHBondContact O-CB 3.31Å; A448-C451 PolarHBondContact O-N 3.2Å; C451-N453 PolarHBondContact O-N 2.95Å; C451-T454 WeakPolarHBondContact O-CB 3.5Å; C451-T454 PolarHBondContact O-N 2.77Å; C451-T454 VanDerWaalsContact O-N 3.12Å; C451-L455 WeakPolarHBondContact O-CG 3.46Å; C451-L455 PolarHBondContact O-N 2.95Å
452	L	93.8	Very high	88.7	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-59.5	-42.4	-179.8	-175.8	62.3	0	0	0	112.9	L417 I422 A448 T449 K450 T454 L455 I456 Q470	L417-L452 HydrophobicContact CB-CD1 4.02Å; I422-L452 HydrophobicContact CD1-CB 3.51Å; I422-L452 HydrophobicContact CD1-CD1 3.64Å; I422-L452 HydrophobicContact CD1-CG 4.1Å; A448-L452 PolarHBondContact O-N 2.72Å; T449-L452 PolarHBondContact O-N 3.42Å; K450-L452 PolarHBondContact O-N 3.09Å; L452-T454 VanDerWaalsContact C-N 3.29Å; L452-T454 PolarHBondContact O-N 3.04Å; L452-L455 PolarHBondContact O-N 2.94Å; L452-I456 HydrophobicContact CD1-CD1 4.16Å; L452-I456 HydrophobicContact CD1-CG1 4.32Å; L452-I456 HydrophobicContact CG-CD1 3.93Å; L452-I456 HydrophobicContact CG-CG1 4.48Å; L452-I456 WeakPolarHBondContact O-CB 3.42Å; L452-I456 VanDerWaalsContact O-CG1 3.31Å; L452-I456 WeakPolarHBondContact O-CG1 3.23Å; L452-I456 PolarHBondContact O-N 2.67Å; L452-Q470 HydrophobicContact CD2-CG 4.18Å
453	N	92.7	Very high	89.4	Confident	53 Å²	53	38.8 Å²	38.8	28%	0.283	21%	0.205	S	C	.	.	H	α-helix	trans	-66.5	-33.2	178.4	-70.9	-89.1	0	0	0	111.4	T449 K450 C451 S457 R480	T449-N453 PolarHBondContact O-N 3.18Å; T449-N453 PolarHBondContact O-ND2 2.9Å; K450-N453 PolarHBondContact O-N 2.84Å; C451-N453 PolarHBondContact O-N 2.95Å; N453-S457 WeakPolarHBondContact O-CB 3.23Å; N453-S457 PolarHBondContact O-N 3.12Å; N453-S457 PolarHBondContact O-OG 2.71Å; N453-R480 PolarHBondContact OD1-NH1 3.45Å
454	T	93	Very high	90.2	Very high	62 Å²	62	35.2 Å²	35.2	38%	0.38	18%	0.183	S	C	.	.	H	α-helix	trans	-70.1	-45.1	172.1	-58.8	0	0	0	0	111.8	F195 K450 C451 L452 I456 S457 M458	F195-T454 HydrophobicContact CE2-CG2 3.84Å; F195-T454 HydrophobicContact CZ-CG2 3.98Å; K450-T454 PolarHBondContact O-N 3.43Å; K450-T454 PolarHBondContact O-OG1 2.85Å; C451-T454 WeakPolarHBondContact O-CB 3.5Å; C451-T454 PolarHBondContact O-N 2.77Å; C451-T454 VanDerWaalsContact O-N 3.12Å; L452-T454 VanDerWaalsContact C-N 3.29Å; L452-T454 PolarHBondContact O-N 3.04Å; T454-I456 PolarHBondContact O-N 2.86Å; T454-S457 CarbonylContact O-C 3.44Å; T454-S457 WeakPolarHBondContact O-CA 3.31Å; T454-S457 WeakPolarHBondContact O-CB 3.47Å; T454-S457 PolarHBondContact O-N 2.68Å; T454-M458 HydrophobicContact CG2-CE 4.3Å; T454-M458 HydrophobicContact CG2-SD 4.44Å; T454-M458 WeakPolarHBondContact O-CG 3.37Å; T454-M458 PolarHBondContact O-N 3.05Å; T454-M458 VanDerWaalsContact O-N 3.1Å
455	L	93.6	Very high	91	Very high	8 Å²	8	35.4 Å²	35.4	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-46.5	175.9	-71.8	-179.9	0	0	0	111.9	L176 N177 F195 I422 C451 L452 S457 M458 A459	L176-L455 HydrophobicContact CB-CD2 3.77Å; N177-L455 HydrophobicContact CB-CD2 4.19Å; F195-L455 HydrophobicContact CE1-CD1 4.44Å; F195-L455 HydrophobicContact CE1-CD2 3.85Å; F195-L455 HydrophobicContact CE1-CG 3.93Å; F195-L455 HydrophobicContact CZ-CD2 4.21Å; F195-L455 HydrophobicContact CZ-CG 4.08Å; I422-L455 HydrophobicContact CD1-CD1 3.82Å; I422-L455 HydrophobicContact CG1-CD1 4.03Å; C451-L455 WeakPolarHBondContact O-CG 3.46Å; C451-L455 PolarHBondContact O-N 2.95Å; L452-L455 PolarHBondContact O-N 2.94Å; L455-S457 PolarHBondContact O-N 2.81Å; L455-M458 HydrophobicContact CD2-CE 3.74Å; L455-M458 PolarHBondContact O-N 3.03Å; L455-A459 WeakPolarHBondContact O-CB 3.45Å; L455-A459 PolarHBondContact O-N 2.96Å
456	I	93.2	Very high	91.5	Very high	9 Å²	9	32.5 Å²	32.5	5%	0.046	17%	0.169	C	C	.	.	H	α-helix	trans	-57.2	-38.5	174.1	-73.3	169.6	0	0	0	111.5	L452 T454 M458 C460 L468 K481 F485	L452-I456 HydrophobicContact CD1-CD1 4.16Å; L452-I456 HydrophobicContact CD1-CG1 4.32Å; L452-I456 HydrophobicContact CG-CD1 3.93Å; L452-I456 HydrophobicContact CG-CG1 4.48Å; L452-I456 WeakPolarHBondContact O-CB 3.42Å; L452-I456 VanDerWaalsContact O-CG1 3.31Å; L452-I456 WeakPolarHBondContact O-CG1 3.23Å; L452-I456 PolarHBondContact O-N 2.67Å; T454-I456 PolarHBondContact O-N 2.86Å; I456-M458 VanDerWaalsContact C-N 3.27Å; I456-M458 PolarHBondContact O-N 3.15Å; I456-C460 PolarHBondContact O-N 2.96Å; I456-L468 HydrophobicContact CG1-CD2 4.27Å; I456-K481 HydrophobicContact CD1-CG 4.42Å; I456-F485 HydrophobicContact CG2-CE2 3.99Å; I456-F485 HydrophobicContact CG2-CZ 4.39Å
457	S	91.5	Very high	92	Very high	59 Å²	59	28.5 Å²	28.5	41%	0.413	15%	0.148	S	C	.	.	H	α-helix	trans	-73.9	-14.7	179	-54.9	0	0	0	0	113.9	N453 T454 L455 C460	N453-S457 WeakPolarHBondContact O-CB 3.23Å; N453-S457 PolarHBondContact O-N 3.12Å; N453-S457 PolarHBondContact O-OG 2.71Å; T454-S457 CarbonylContact O-C 3.44Å; T454-S457 WeakPolarHBondContact O-CA 3.31Å; T454-S457 WeakPolarHBondContact O-CB 3.47Å; T454-S457 PolarHBondContact O-N 2.68Å; L455-S457 PolarHBondContact O-N 2.81Å; S457-C460 PolarHBondContact O-SG 3.26Å
458	M	90.9	Very high	92.5	Very high	20 Å²	20	27.1 Å²	27.1	10%	0.099	14%	0.142	C	C	.	.	H	α-helix	trans	-97.1	-38.7	173.4	-64.4	-173.6	-53.5	0	0	111.6	M154 L176 L190 T454 L455 I456 C460 M461	M154-M458 HydrophobicContact CE-CB 3.98Å; M154-M458 HydrophobicContact CE-CE 4.33Å; M154-M458 HydrophobicContact CE-CG 4.25Å; M154-M458 HydrophobicContact CE-SD 3.74Å; M154-M458 HydrophobicContact SD-CB 3.99Å; M154-M458 HydrophobicContact SD-CG 4.22Å; M154-M458 HydrophobicContact SD-SD 4.28Å; L176-M458 WeakPolarHBondContact O-CE 3.14Å; L190-M458 HydrophobicContact CD1-CE 3.77Å; L190-M458 HydrophobicContact CD1-SD 4.17Å; T454-M458 HydrophobicContact CG2-CE 4.3Å; T454-M458 HydrophobicContact CG2-SD 4.44Å; T454-M458 WeakPolarHBondContact O-CG 3.37Å; T454-M458 PolarHBondContact O-N 3.05Å; T454-M458 VanDerWaalsContact O-N 3.1Å; L455-M458 HydrophobicContact CD2-CE 3.74Å; L455-M458 PolarHBondContact O-N 3.03Å; I456-M458 VanDerWaalsContact C-N 3.27Å; I456-M458 PolarHBondContact O-N 3.15Å; M458-C460 VanDerWaalsContact C-N 3.28Å; M458-C460 PolarHBondContact O-N 3.33Å; M458-M461 HydrophobicContact CG-CE 4.37Å; M458-M461 WeakPolarHBondContact O-CB 3.46Å; M458-M461 PolarHBondContact O-N 3.37Å
459	A	92.6	Very high	92.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-53.1	-42.5	177.2	0	0	0	0	0	112.6	L176 L417 L455 M461 R462 Y466 F485	L176-A459 HydrophobicContact CD1-CB 3.93Å; L417-A459 HydrophobicContact CD1-CB 3.96Å; L455-A459 WeakPolarHBondContact O-CB 3.45Å; L455-A459 PolarHBondContact O-N 2.96Å; A459-M461 PolarHBondContact O-N 3Å; A459-M461 VanDerWaalsContact O-N 3.12Å; A459-R462 PolarHBondContact O-N 3.34Å; A459-Y466 WeakPolarHBondContact CA-OH 3.39Å; A459-Y466 HydrophobicContact CB-CD1 4.09Å; A459-Y466 HydrophobicContact CB-CD2 4.23Å; A459-Y466 HydrophobicContact CB-CE1 3.72Å; A459-Y466 HydrophobicContact CB-CE2 3.83Å; A459-Y466 HydrophobicContact CB-CG 4.34Å; A459-Y466 VanDerWaalsContact O-CE2 3.23Å; A459-Y466 WeakPolarHBondContact O-CE2 3.45Å; A459-Y466 PolarHBondContact O-OH 2.85Å; A459-F485 HydrophobicContact CB-CE1 3.87Å; A459-F485 HydrophobicContact CB-CZ 3.88Å
460	C	90.7	Very high	92.7	Very high	17 Å²	17	27.3 Å²	27.3	12%	0.115	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-4.6	180	65.7	0	0	0	0	115.4	I456 S457 M458 P484 F485 F488	I456-C460 PolarHBondContact O-N 2.96Å; S457-C460 PolarHBondContact O-SG 3.26Å; M458-C460 VanDerWaalsContact C-N 3.28Å; M458-C460 PolarHBondContact O-N 3.33Å; C460-P484 HydrophobicContact CB-CB 3.82Å; C460-P484 WeakPolarHBondContact CB-O 3.01Å; C460-F485 HydrophobicContact CB-CD1 3.81Å; C460-F485 HydrophobicContact CB-CE1 3.92Å; C460-F485 HydrophobicContact CB-CG 4.12Å; C460-F485 HydrophobicContact CB-CZ 4.34Å; C460-F488 HydrophobicContact CB-CE2 4.4Å
461	M	86.8	Confident	92.6	Very high	91 Å²	91	23.3 Å²	23.3	45%	0.448	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-1.1	176.1	-56.8	-168	-68.8	0	0	113.5	M154 M458 A459	M154-M461 HydrophobicContact SD-CE 4.44Å; M458-M461 HydrophobicContact CG-CE 4.37Å; M458-M461 WeakPolarHBondContact O-CB 3.46Å; M458-M461 PolarHBondContact O-N 3.37Å; A459-M461 PolarHBondContact O-N 3Å; A459-M461 VanDerWaalsContact O-N 3.12Å
462	R	88.2	Confident	92.6	Very high	17 Å²	17	23.3 Å²	23.3	6%	0.064	13%	0.126	C	C	.	.	S	Bend	trans	-121.5	139.3	-169.3	-69.6	-73.8	-176.8	169	-3.8	111.1	M154 E157 T171 A459 R464 Y466	M154-R462 HydrophobicContact SD-CG 4.36Å; M154-R462 PolarHBondContact SD-NE 3.03Å; M154-R462 VanDerWaalsContact SD-NE 3.42Å; E157-R462 WeakPolarHBondContact OE1-CD 3.33Å; E157-R462 IonicContact OE1-CZ 2.97Å; E157-R462 IonicContact OE1-NE 2.67Å; E157-R462 IonicContact OE1-NH1 3.81Å; E157-R462 PolarHBondContact OE1-NH1 3.13Å; T171-R462 PolarHBondContact OG1-NH1 2.76Å; A459-R462 PolarHBondContact O-N 3.34Å; R462-R464 VanDerWaalsContact C-N 3.3Å; R462-R464 HydrophobicContact CB-CG 4.3Å; R462-R464 PolarHBondContact O-N 3.2Å; R462-Y466 WeakPolarHBondContact CB-OH 3.43Å
463	R	91.5	Very high	92.5	Very high	43 Å²	43	23.2 Å²	23.2	16%	0.162	13%	0.125	C	C	.	.	S	Bend	trans	-75.2	72.6	179	-72	166.4	56.1	-147.8	-10.9	112	E157 E162 Y172 P378 P379 Q380	E157-R463 PolarHBondContact OE2-N 3.36Å; E157-R463 VanDerWaalsContact OE2-N 3.14Å; E162-R463 IonicContact OE1-CZ 2.78Å; E162-R463 IonicContact OE1-NH1 3.14Å; E162-R463 PolarHBondContact OE1-NH1 3.48Å; E162-R463 IonicContact OE1-NH2 3.14Å; E162-R463 PolarHBondContact OE1-NH2 2.91Å; E162-R463 IonicContact OE2-NH1 3.96Å; Y172-R463 WeakPolarHBondContact CD2-O 3.17Å; Y172-R463 WeakPolarHBondContact CE2-O 3.45Å; P378-R463 HydrophobicContact CB-CB 3.78Å; P378-R463 WeakPolarHBondContact CB-O 3.33Å; P378-R463 PolarHBondContact O-NH2 3.29Å; P379-R463 WeakPolarHBondContact CD-O 3.34Å; P379-R463 VanDerWaalsContact O-CZ 3.28Å; P379-R463 PolarHBondContact O-NE 3.05Å; P379-R463 PolarHBondContact O-NH2 2.84Å; Q380-R463 PolarHBondContact O-NE 3.27Å; Q380-R463 PolarHBondContact O-NH2 2.94Å
464	R	93.9	Very high	92.5	Very high	3 Å²	3	23.3 Å²	23.3	1%	0.011	12%	0.122	C	C	.	.			trans	-141.3	166.3	177.3	-34.3	-168.2	-175.4	174.1	-3.3	114.2	T171 Y172 C174 R462 Y466 F488	T171-R464 PolarHBondContact O-NH2 2.83Å; Y172-R464 HydrophobicContact CD2-CB 4.34Å; Y172-R464 HydrophobicContact CD2-CG 3.7Å; Y172-R464 HydrophobicContact CE2-CB 3.93Å; Y172-R464 HydrophobicContact CE2-CG 3.82Å; Y172-R464 PolarHBondContact O-NE 3.35Å; Y172-R464 PolarHBondContact O-NH1 2.66Å; Y172-R464 PolarHBondContact O-NH2 2.8Å; C174-R464 VanDerWaalsContact O-CZ 3.26Å; C174-R464 PolarHBondContact O-NH1 2.82Å; C174-R464 PolarHBondContact O-NH2 3.26Å; C174-R464 PolarHBondContact SG-NH2 3.19Å; R462-R464 VanDerWaalsContact C-N 3.3Å; R462-R464 HydrophobicContact CB-CG 4.3Å; R462-R464 PolarHBondContact O-N 3.2Å; R464-Y466 HydrophobicContact CB-CE1 4.21Å; R464-Y466 HydrophobicContact CB-CE2 4.04Å; R464-Y466 WeakPolarHBondContact CG-OH 3.18Å; R464-Y466 WeakPolarHBondContact O-CD2 3.46Å; R464-Y466 VanDerWaalsContact O-CE2 3.26Å; R464-Y466 WeakPolarHBondContact O-CE2 3.46Å; R464-F488 WeakPolarHBondContact O-CE1 3.44Å
465	N	95.4	Very high	92.4	Very high	9 Å²	9	22.2 Å²	22.2	5%	0.048	12%	0.116	C	C	.	.			trans	-92.8	141.5	173.5	-57.7	-50.5	0	0	0	111.3	C385 E386 K412 Y414 N415	C385-N465 WeakPolarHBondContact CA-OD1 3.49Å; E386-N465 PolarHBondContact N-OD1 3.19Å; E386-N465 CarbonylContact O-C 3.51Å; E386-N465 VanDerWaalsContact O-CA 3.26Å; E386-N465 WeakPolarHBondContact O-CA 3.43Å; K412-N465 PolarHBondContact O-ND2 2.83Å; Y414-N465 HydrophobicContact CD1-CB 3.68Å; Y414-N465 HydrophobicContact CE1-CB 3.88Å; N415-N465 PolarHBondContact N-O 3.27Å
466	Y	96.3	Very high	92.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.5	-172.1	-61.1	-71.4	0	0	0	113.5	L176 E386 V387 I388 N415 L417 A459 R462 R464 F485 F488	L176-Y466 HydrophobicContact CD1-CE1 3.91Å; L176-Y466 HydrophobicContact CD2-CE1 4.45Å; E386-Y466 PolarHBondContact O-N 2.89Å; V387-Y466 WeakPolarHBondContact CA-O 3.36Å; I388-Y466 PolarHBondContact N-O 3.38Å; N415-Y466 HydrophobicContact CB-CD1 3.67Å; N415-Y466 HydrophobicContact CB-CE1 3.88Å; N415-Y466 WeakPolarHBondContact O-CA 3.18Å; L417-Y466 HydrophobicContact CD1-CD1 3.95Å; L417-Y466 HydrophobicContact CG-CD1 4.42Å; A459-Y466 WeakPolarHBondContact CA-OH 3.39Å; A459-Y466 HydrophobicContact CB-CD1 4.09Å; A459-Y466 HydrophobicContact CB-CD2 4.23Å; A459-Y466 HydrophobicContact CB-CE1 3.72Å; A459-Y466 HydrophobicContact CB-CE2 3.83Å; A459-Y466 HydrophobicContact CB-CG 4.34Å; A459-Y466 VanDerWaalsContact O-CE2 3.23Å; A459-Y466 WeakPolarHBondContact O-CE2 3.45Å; A459-Y466 PolarHBondContact O-OH 2.85Å; R462-Y466 WeakPolarHBondContact CB-OH 3.43Å; R464-Y466 HydrophobicContact CB-CE1 4.21Å; R464-Y466 HydrophobicContact CB-CE2 4.04Å; R464-Y466 WeakPolarHBondContact CG-OH 3.18Å; R464-Y466 WeakPolarHBondContact O-CD2 3.46Å; R464-Y466 VanDerWaalsContact O-CE2 3.26Å; R464-Y466 WeakPolarHBondContact O-CE2 3.46Å; Y466-F485 AromaticContact CD2-CE1 3.86Å; Y466-F485 HydrophobicContact CD2-CE1 3.86Å; Y466-F485 HydrophobicContact CE2-CE1 4.25Å; Y466-F488 HydrophobicContact CD2-CE1 4.2Å; Y466-F488 HydrophobicContact CE2-CE1 4.04Å; Y466-F488 HydrophobicContact CE2-CZ 4.34Å
467	I	96.5	Very high	92.2	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.8	168.8	-57	175.4	0	0	0	109.4	I388 M390 A402 Q405 Y414 N415 I416 L417 D469	I388-I467 HydrophobicContact CB-CG1 4.17Å; I388-I467 HydrophobicContact CD1-CG1 4.32Å; I388-I467 CarbonylContact O-C 3.48Å; I388-I467 WeakPolarHBondContact O-CA 3.39Å; M390-I467 HydrophobicContact CG-CG2 3.85Å; M390-I467 HydrophobicContact SD-CG2 3.84Å; A402-I467 HydrophobicContact CB-CG2 3.82Å; Q405-I467 HydrophobicContact CB-CD1 4.01Å; Q405-I467 HydrophobicContact CG-CD1 3.79Å; Y414-I467 HydrophobicContact CD1-CD1 4.15Å; Y414-I467 HydrophobicContact CD1-CG1 3.85Å; Y414-I467 HydrophobicContact CD2-CD1 4.26Å; Y414-I467 HydrophobicContact CG-CD1 3.79Å; Y414-I467 HydrophobicContact CG-CG1 3.98Å; N415-I467 PolarHBondContact O-N 2.98Å; I416-I467 CarbonylContact C-O 3.58Å; I416-I467 WeakPolarHBondContact CA-O 3.37Å; I416-I467 HydrophobicContact CG1-CB 4.32Å; I416-I467 HydrophobicContact CG1-CD1 4.38Å; I416-I467 HydrophobicContact CG2-CB 4.25Å; I416-I467 HydrophobicContact CG2-CG2 4.4Å; L417-I467 PolarHBondContact N-O 3.24Å; I467-D469 PolarHBondContact O-N 3Å
468	L	96	Very high	92.4	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.021	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	77.3	-179	-55.5	-176.6	0	0	0	111	V387 I388 M389 M390 L417 I456 Q470 N472 K481 M482 F485	V387-L468 HydrophobicContact CG2-CD1 4.25Å; V387-L468 HydrophobicContact CG2-CG 4.28Å; I388-L468 PolarHBondContact O-N 2.76Å; M389-L468 HydrophobicContact CE-CD1 4.01Å; M390-L468 PolarHBondContact N-O 3.4Å; L417-L468 HydrophobicContact CB-CD2 4.01Å; L417-L468 HydrophobicContact CD1-CD2 4.11Å; I456-L468 HydrophobicContact CG1-CD2 4.27Å; L468-Q470 PolarHBondContact O-N 3.08Å; L468-N472 PolarHBondContact O-ND2 2.97Å; L468-K481 HydrophobicContact CD1-CB 4.44Å; L468-M482 HydrophobicContact CD1-SD 3.97Å; L468-F485 HydrophobicContact CD1-CE2 4.25Å
469	D	94.3	Very high	92.5	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.032	14%	0.14	C	C	.	.			trans	-72.9	94	177.9	-178	34.8	0	0	0	112.4	M390 K398 T399 A402 I416 L417 G418 I467	M390-D469 HydrophobicContact CG-CB 4.31Å; K398-D469 WeakPolarHBondContact CB-OD1 3.35Å; T399-D469 VanDerWaalsContact CB-OD2 3.32Å; T399-D469 WeakPolarHBondContact CB-OD2 3.48Å; T399-D469 WeakPolarHBondContact CG2-OD2 3.39Å; T399-D469 PolarHBondContact OG1-OD2 2.78Å; A402-D469 HydrophobicContact CB-CB 4.39Å; I416-D469 HydrophobicContact CG2-CB 4.03Å; L417-D469 PolarHBondContact O-N 2.94Å; G418-D469 VanDerWaalsContact CA-O 3.27Å; G418-D469 WeakPolarHBondContact CA-O 3.08Å; I467-D469 PolarHBondContact O-N 3Å
470	Q	91.7	Very high	92.5	Very high	46 Å²	46	34.3 Å²	34.3	22%	0.215	17%	0.166	C	C	.	.	S	Bend	trans	-147.8	176	163.7	-68	-165.7	-57.4	0	0	108.8	M390 K398 T419 L452 L468 N472	M390-Q470 VanDerWaalsContact O-O 3.06Å; K398-Q470 VanDerWaalsContact CD-O 3.31Å; K398-Q470 WeakPolarHBondContact CD-O 3.43Å; K398-Q470 WeakPolarHBondContact CE-O 3.24Å; T419-Q470 PolarHBondContact OG1-NE2 2.81Å; L452-Q470 HydrophobicContact CD2-CG 4.18Å; L468-Q470 PolarHBondContact O-N 3.08Å; Q470-N472 PolarHBondContact O-N 2.78Å; Q470-N472 PolarHBondContact O-ND2 2.67Å; Q470-N472 VanDerWaalsContact O-ND2 3.16Å
471	T	88.8	Confident	92.6	Very high	37 Å²	37	34.3 Å²	34.3	23%	0.227	16%	0.164	C	C	.	.			trans	-63.7	-40.3	180	52.9	0	0	0	0	113.7	V391 G392 P394 V473 M525	V391-T471 WeakPolarHBondContact CA-O 3.47Å; G392-T471 PolarHBondContact N-O 2.86Å; G392-T471 VanDerWaalsContact O-CA 3.31Å; G392-T471 WeakPolarHBondContact O-CA 3.21Å; G392-T471 WeakPolarHBondContact O-CB 3.35Å; P394-T471 HydrophobicContact CG-CG2 4.01Å; T471-V473 WeakPolarHBondContact O-CG1 3.34Å; T471-V473 PolarHBondContact O-N 3.38Å; T471-M525 HydrophobicContact CG2-SD 3.84Å
472	N	92.7	Very high	93	Very high	3 Å²	3	30 Å²	30	2%	0.016	14%	0.143	C	C	.	.			trans	49.2	18.2	175.4	-61.1	-52.3	0	0	0	116.3	M389 M390 V391 L468 Q470 Y474 Q478 K481	M389-N472 HydrophobicContact CG-CB 3.94Å; M389-N472 WeakPolarHBondContact CG-ND2 3.4Å; M389-N472 HydrophobicContact SD-CB 3.7Å; M390-N472 WeakPolarHBondContact O-CB 3.33Å; M390-N472 PolarHBondContact O-ND2 3.42Å; V391-N472 HydrophobicContact CG2-CB 4.14Å; L468-N472 PolarHBondContact O-ND2 2.97Å; Q470-N472 PolarHBondContact O-N 2.78Å; Q470-N472 PolarHBondContact O-ND2 2.67Å; Q470-N472 VanDerWaalsContact O-ND2 3.16Å; N472-Y474 PolarHBondContact O-N 2.86Å; N472-Q478 WeakPolarHBondContact O-CG 3.46Å; N472-Q478 PolarHBondContact O-NE2 2.67Å; N472-K481 PolarHBondContact OD1-NZ 3.24Å
473	V	92.7	Very high	93.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.169	C	C	.	.			trans	-63.7	-26.3	-175.6	-63.7	0	0	0	0	113.7	L393 T471 P475 M525 N528 F529 G530	L393-V473 HydrophobicContact CD2-CG1 4.43Å; T471-V473 WeakPolarHBondContact O-CG1 3.34Å; T471-V473 PolarHBondContact O-N 3.38Å; V473-P475 WeakPolarHBondContact O-CD 3.31Å; V473-M525 HydrophobicContact CG2-CB 3.96Å; V473-M525 HydrophobicContact CG2-CG 4.06Å; V473-M525 HydrophobicContact CG2-SD 4.48Å; V473-N528 VanDerWaalsContact O-O 3.13Å; V473-F529 HydrophobicContact CB-CB 4.18Å; V473-F529 HydrophobicContact CB-CD1 4.13Å; V473-F529 HydrophobicContact CB-CD2 4.46Å; V473-F529 HydrophobicContact CB-CG 3.99Å; V473-F529 HydrophobicContact CG1-CD1 4.14Å; V473-F529 HydrophobicContact CG1-CD2 3.94Å; V473-F529 HydrophobicContact CG1-CE1 4.34Å; V473-F529 HydrophobicContact CG1-CE2 4.15Å; V473-F529 HydrophobicContact CG1-CG 3.94Å; V473-F529 HydrophobicContact CG1-CZ 4.35Å; V473-G530 PolarHBondContact O-N 2.75Å
474	Y	92.5	Very high	93.2	Very high	56 Å²	56	37.2 Å²	37.2	22%	0.22	18%	0.177	C	C	.	.	S	Bend	trans	-81	121.9	179.4	-55.7	-100.7	0	0	0	111.6	N472 S476 A477 Q478 E524 M525 N528	N472-Y474 PolarHBondContact O-N 2.86Å; Y474-S476 PolarHBondContact O-N 2.9Å; Y474-S476 VanDerWaalsContact O-N 3.09Å; Y474-A477 WeakPolarHBondContact O-CA 3.35Å; Y474-A477 WeakPolarHBondContact O-CB 3.48Å; Y474-A477 PolarHBondContact O-N 2.8Å; Y474-Q478 PolarHBondContact O-N 2.93Å; Y474-Q478 VanDerWaalsContact O-N 3.13Å; Y474-E524 WeakPolarHBondContact CE1-OE1 3.46Å; Y474-E524 PolarHBondContact OH-OE1 2.9Å; Y474-M525 HydrophobicContact CE2-CG 4.11Å; Y474-N528 HydrophobicContact CD1-CB 3.61Å; Y474-N528 HydrophobicContact CE1-CB 3.59Å
475	P	91.8	Very high	93.2	Very high	39 Å²	39	37.1 Å²	37.1	25%	0.253	18%	0.176	S	C	.	.	H	α-helix	trans	-60.7	-22.7	177.8	-28.5	37.7	0	0	0	115.2	V473 R479	V473-P475 WeakPolarHBondContact O-CD 3.31Å; P475-R479 PolarHBondContact O-N 3.42Å; P475-R479 VanDerWaalsContact O-N 3.17Å; P475-R479 PolarHBondContact O-NE 2.96Å
476	S	91.6	Very high	93	Very high	80 Å²	80	43.8 Å²	43.8	56%	0.559	21%	0.207	S	C	*	.	H	α-helix	trans	-68.8	-36.2	171.6	56.9	0	0	0	0	112.3	Y474 R480	Y474-S476 PolarHBondContact O-N 2.9Å; Y474-S476 VanDerWaalsContact O-N 3.09Å; S476-R480 WeakPolarHBondContact O-CB 3.27Å; S476-R480 PolarHBondContact O-N 2.87Å; S476-R480 VanDerWaalsContact O-N 3.11Å
477	A	90.7	Very high	92.7	Very high	16 Å²	16	45.7 Å²	45.7	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-74.5	-42.9	176.5	0	0	0	0	0	111.5	Y474 R480 K481	Y474-A477 WeakPolarHBondContact O-CA 3.35Å; Y474-A477 WeakPolarHBondContact O-CB 3.48Å; Y474-A477 PolarHBondContact O-N 2.8Å; A477-R480 PolarHBondContact O-N 3.18Å; A477-K481 WeakPolarHBondContact O-CG 3.35Å; A477-K481 PolarHBondContact O-N 3.15Å
478	Q	94.1	Very high	92.6	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-51.9	-61.1	173.5	-65.2	166.5	6.3	0	0	110.6	M389 N472 Y474 R480 K481 M482 G530 F543	M389-Q478 HydrophobicContact SD-CB 4.13Å; M389-Q478 HydrophobicContact SD-CG 3.91Å; N472-Q478 WeakPolarHBondContact O-CG 3.46Å; N472-Q478 PolarHBondContact O-NE2 2.67Å; Y474-Q478 PolarHBondContact O-N 2.93Å; Y474-Q478 VanDerWaalsContact O-N 3.13Å; Q478-R480 VanDerWaalsContact C-N 3.3Å; Q478-R480 PolarHBondContact O-N 3.23Å; Q478-K481 PolarHBondContact O-N 3.15Å; Q478-M482 WeakPolarHBondContact O-CG 3.34Å; Q478-M482 PolarHBondContact O-N 3.02Å; Q478-G530 PolarHBondContact NE2-O 2.88Å; Q478-F543 HydrophobicContact CB-CE2 4.05Å; Q478-F543 HydrophobicContact CB-CZ 3.97Å; Q478-F543 HydrophobicContact CG-CE2 4.46Å; Q478-F543 HydrophobicContact CG-CZ 4.3Å
479	R	92.8	Very high	92.5	Very high	102 Å²	102	50.2 Å²	50.2	39%	0.385	25%	0.246	S	C	.	.	H	α-helix	trans	-60.5	-34.8	178.8	-69.8	-173.3	-68.2	-100.4	0.4	113.3	P475 R483 V542	P475-R479 PolarHBondContact O-N 3.42Å; P475-R479 VanDerWaalsContact O-N 3.17Å; P475-R479 PolarHBondContact O-NE 2.96Å; R479-R483 WeakPolarHBondContact O-CB 3.25Å; R479-R483 VanDerWaalsContact O-CD 3.25Å; R479-R483 WeakPolarHBondContact O-CD 3.38Å; R479-R483 WeakPolarHBondContact O-CG 3.42Å; R479-R483 PolarHBondContact O-N 3.06Å; R479-V542 HydrophobicContact CB-CG1 4.47Å; R479-V542 HydrophobicContact CG-CG1 4.06Å; R479-V542 HydrophobicContact CG-CG2 4.18Å
480	R	92.9	Very high	92.6	Very high	144 Å²	144	52 Å²	52	54%	0.543	25%	0.253	S	S	.	.	H	α-helix	trans	-67.7	-37.8	178.5	-177.7	171.8	67.9	83.6	-8.5	112.7	N453 S476 A477 Q478	N453-R480 PolarHBondContact OD1-NH1 3.45Å; S476-R480 WeakPolarHBondContact O-CB 3.27Å; S476-R480 PolarHBondContact O-N 2.87Å; S476-R480 VanDerWaalsContact O-N 3.11Å; A477-R480 PolarHBondContact O-N 3.18Å; Q478-R480 VanDerWaalsContact C-N 3.3Å; Q478-R480 PolarHBondContact O-N 3.23Å
481	K	93.7	Very high	92.8	Very high	17 Å²	17	51.7 Å²	51.7	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-88.1	-31	-175.4	-66	173.8	-166.9	175.7	0	113.8	M389 I456 L468 N472 A477 Q478 P484 F485	M389-K481 HydrophobicContact CE-CB 3.7Å; M389-K481 HydrophobicContact CE-CD 4.05Å; I456-K481 HydrophobicContact CD1-CG 4.42Å; L468-K481 HydrophobicContact CD1-CB 4.44Å; N472-K481 PolarHBondContact OD1-NZ 3.24Å; A477-K481 WeakPolarHBondContact O-CG 3.35Å; A477-K481 PolarHBondContact O-N 3.15Å; Q478-K481 PolarHBondContact O-N 3.15Å; K481-P484 WeakPolarHBondContact O-CD 3.25Å; K481-F485 WeakPolarHBondContact O-CD2 3.46Å; K481-F485 WeakPolarHBondContact O-CE2 3.4Å
482	M	94.5	Very high	93.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-83.3	-27.1	179.9	-59.8	-54.2	-77.9	0	0	113.7	V387 M389 L468 Q478 P484 F485 R490 V542 F543	V387-M482 HydrophobicContact CG1-CE 3.87Å; V387-M482 HydrophobicContact CG2-CE 4.23Å; M389-M482 HydrophobicContact CB-CE 4.42Å; M389-M482 HydrophobicContact CB-SD 3.95Å; M389-M482 HydrophobicContact CE-CG 3.73Å; M389-M482 HydrophobicContact CE-SD 3.55Å; M389-M482 VanDerWaalsContact CE-SD 3.55Å; M389-M482 HydrophobicContact SD-CG 4.29Å; M389-M482 HydrophobicContact SD-SD 4.35Å; L468-M482 HydrophobicContact CD1-SD 3.97Å; Q478-M482 WeakPolarHBondContact O-CG 3.34Å; Q478-M482 PolarHBondContact O-N 3.02Å; M482-P484 VanDerWaalsContact C-CD 3.5Å; M482-F485 PolarHBondContact O-N 2.86Å; M482-R490 HydrophobicContact CE-CB 3.64Å; M482-R490 HydrophobicContact CE-CG 4.02Å; M482-V542 HydrophobicContact CB-CB 4.02Å; M482-V542 HydrophobicContact CB-CG2 3.76Å; M482-V542 HydrophobicContact CG-CG2 4.13Å; M482-F543 HydrophobicContact CE-CD1 4.04Å; M482-F543 HydrophobicContact CE-CE1 3.79Å; M482-F543 HydrophobicContact CG-CD1 4.31Å; M482-F543 HydrophobicContact CG-CE1 3.52Å; M482-F543 HydrophobicContact CG-CZ 3.79Å; M482-F543 HydrophobicContact SD-CE1 4.02Å
483	R	92.6	Very high	93.4	Very high	162 Å²	162	50 Å²	50	61%	0.611	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-54.8	-38.8	-179.3	-87	173.6	179	-171.7	-3.4	115.6	R479 F485 E486 V542	R479-R483 WeakPolarHBondContact O-CB 3.25Å; R479-R483 VanDerWaalsContact O-CD 3.25Å; R479-R483 WeakPolarHBondContact O-CD 3.38Å; R479-R483 WeakPolarHBondContact O-CG 3.42Å; R479-R483 PolarHBondContact O-N 3.06Å; R483-F485 PolarHBondContact O-N 2.9Å; R483-E486 PolarHBondContact O-N 2.87Å; R483-V542 HydrophobicContact CG-CG1 4.24Å
484	P	91.7	Very high	93.5	Very high	50 Å²	50	50 Å²	50	33%	0.325	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-62.2	-28.5	174.4	-24.7	35.5	0	0	0	113.9	C460 K481 M482 E486	C460-P484 HydrophobicContact CB-CB 3.82Å; C460-P484 WeakPolarHBondContact CB-O 3.01Å; K481-P484 WeakPolarHBondContact O-CD 3.25Å; M482-P484 VanDerWaalsContact C-CD 3.5Å; P484-E486 PolarHBondContact O-N 2.85Å; P484-E486 VanDerWaalsContact O-N 3.11Å
485	F	93.6	Very high	93.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-83.9	33	179.6	-59.7	-88.8	0	0	0	113.1	V387 I456 A459 C460 Y466 L468 K481 M482 R483 G487 F488	V387-F485 HydrophobicContact CB-CD1 4.17Å; V387-F485 HydrophobicContact CB-CG 4.35Å; V387-F485 HydrophobicContact CG1-CB 3.78Å; V387-F485 HydrophobicContact CG1-CD1 4.17Å; V387-F485 HydrophobicContact CG1-CG 3.98Å; V387-F485 HydrophobicContact CG2-CD1 4.06Å; V387-F485 HydrophobicContact CG2-CD2 4.19Å; V387-F485 HydrophobicContact CG2-CE1 4.13Å; V387-F485 HydrophobicContact CG2-CE2 4.24Å; V387-F485 HydrophobicContact CG2-CG 4.11Å; V387-F485 HydrophobicContact CG2-CZ 4.22Å; I456-F485 HydrophobicContact CG2-CE2 3.99Å; I456-F485 HydrophobicContact CG2-CZ 4.39Å; A459-F485 HydrophobicContact CB-CE1 3.87Å; A459-F485 HydrophobicContact CB-CZ 3.88Å; C460-F485 HydrophobicContact CB-CD1 3.81Å; C460-F485 HydrophobicContact CB-CE1 3.92Å; C460-F485 HydrophobicContact CB-CG 4.12Å; C460-F485 HydrophobicContact CB-CZ 4.34Å; Y466-F485 AromaticContact CD2-CE1 3.86Å; Y466-F485 HydrophobicContact CD2-CE1 3.86Å; Y466-F485 HydrophobicContact CE2-CE1 4.25Å; L468-F485 HydrophobicContact CD1-CE2 4.25Å; K481-F485 WeakPolarHBondContact O-CD2 3.46Å; K481-F485 WeakPolarHBondContact O-CE2 3.4Å; M482-F485 PolarHBondContact O-N 2.86Å; R483-F485 PolarHBondContact O-N 2.9Å; F485-G487 PolarHBondContact O-N 3.32Å; F485-F488 HydrophobicContact CB-CB 4.21Å; F485-F488 HydrophobicContact CB-CD2 3.66Å; F485-F488 HydrophobicContact CB-CE2 4.23Å; F485-F488 HydrophobicContact CB-CG 4.09Å; F485-F488 HydrophobicContact CD1-CD1 4.29Å; F485-F488 AromaticContact CD1-CD2 3.79Å; F485-F488 HydrophobicContact CD1-CD2 3.79Å; F485-F488 HydrophobicContact CD1-CE1 4.19Å; F485-F488 AromaticContact CD1-CE2 3.63Å; F485-F488 HydrophobicContact CD1-CE2 3.63Å; F485-F488 HydrophobicContact CD1-CG 4.12Å; F485-F488 AromaticContact CD1-CZ 3.87Å; F485-F488 HydrophobicContact CD1-CZ 3.87Å; F485-F488 HydrophobicContact CE1-CZ 4.43Å; F485-F488 HydrophobicContact CG-CD2 4.22Å; F485-F488 HydrophobicContact CG-CE2 4.38Å; F485-F488 PolarHBondContact O-N 3.34Å; F485-F488 VanDerWaalsContact O-N 3.13Å
486	E	90.8	Very high	93.6	Very high	149 Å²	149	45.9 Å²	45.9	70%	0.696	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	126.8	169.9	-170.7	167	-162.4	0	0	109.9	K382 R483 P484	K382-E486 WeakPolarHBondContact CE-O 3.07Å; K382-E486 PolarHBondContact NZ-O 3.01Å; R483-E486 PolarHBondContact O-N 2.87Å; P484-E486 PolarHBondContact O-N 2.85Å; P484-E486 VanDerWaalsContact O-N 3.11Å
487	G	89.8	Confident	93.6	Very high	40 Å²	40	42.3 Å²	42.3	41%	0.412	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	1.6	-173.2	0	0	0	0	0	116.1	K382 S383 F485	K382-G487 CarbonylContact C-O 3.58Å; S383-G487 WeakPolarHBondContact CA-O 3.33Å; S383-G487 PolarHBondContact N-O 3.32Å; F485-G487 PolarHBondContact O-N 3.32Å
488	F	94.9	Very high	93.7	Very high	9 Å²	9	44.6 Å²	44.6	4%	0.039	21%	0.207	C	C	.	.	S	Bend	trans	-92.7	163.5	163.1	-69.6	-107.7	0	0	0	110.2	K382 C385 V387 C460 R464 Y466 F485 R490	K382-F488 HydrophobicContact CD-CD2 4.46Å; K382-F488 HydrophobicContact CD-CE2 4.29Å; K382-F488 VanDerWaalsContact CE-CD2 3.49Å; K382-F488 HydrophobicContact CG-CD2 4.22Å; K382-F488 HydrophobicContact CG-CE2 4.13Å; K382-F488 HydrophobicContact CG-CZ 4.45Å; C385-F488 HydrophobicContact CB-CD1 3.36Å; C385-F488 HydrophobicContact CB-CE1 3.58Å; C385-F488 HydrophobicContact CB-CG 4.37Å; V387-F488 HydrophobicContact CG1-CB 3.77Å; V387-F488 HydrophobicContact CG1-CG 4.31Å; C460-F488 HydrophobicContact CB-CE2 4.4Å; R464-F488 WeakPolarHBondContact O-CE1 3.44Å; Y466-F488 HydrophobicContact CD2-CE1 4.2Å; Y466-F488 HydrophobicContact CE2-CE1 4.04Å; Y466-F488 HydrophobicContact CE2-CZ 4.34Å; F485-F488 HydrophobicContact CB-CB 4.21Å; F485-F488 HydrophobicContact CB-CD2 3.66Å; F485-F488 HydrophobicContact CB-CE2 4.23Å; F485-F488 HydrophobicContact CB-CG 4.09Å; F485-F488 HydrophobicContact CD1-CD1 4.29Å; F485-F488 AromaticContact CD1-CD2 3.79Å; F485-F488 HydrophobicContact CD1-CD2 3.79Å; F485-F488 HydrophobicContact CD1-CE1 4.19Å; F485-F488 AromaticContact CD1-CE2 3.63Å; F485-F488 HydrophobicContact CD1-CE2 3.63Å; F485-F488 HydrophobicContact CD1-CG 4.12Å; F485-F488 AromaticContact CD1-CZ 3.87Å; F485-F488 HydrophobicContact CD1-CZ 3.87Å; F485-F488 HydrophobicContact CE1-CZ 4.43Å; F485-F488 HydrophobicContact CG-CD2 4.22Å; F485-F488 HydrophobicContact CG-CE2 4.38Å; F485-F488 PolarHBondContact O-N 3.34Å; F485-F488 VanDerWaalsContact O-N 3.13Å; F488-R490 PolarHBondContact O-N 2.88Å
489	K	94.8	Very high	93.3	Very high	91 Å²	91	46.3 Å²	46.3	40%	0.396	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	113.7	162.5	-65.4	165.1	-176.1	158.8	0	109.4	S383 E384 C385 E386 V387	S383-K489 VanDerWaalsContact O-CE 3.24Å; S383-K489 WeakPolarHBondContact O-CE 3.26Å; E384-K489 PolarHBondContact O-NZ 2.95Å; C385-K489 PolarHBondContact O-N 3.39Å; E386-K489 HydrophobicContact CG-CB 4.17Å; E386-K489 HydrophobicContact CG-CD 3.9Å; V387-K489 PolarHBondContact N-O 3.44Å
490	R	96.5	Very high	93.2	Very high	44 Å²	44	48.4 Å²	48.4	17%	0.166	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	104.4	-170.1	-61.2	160.1	-60.8	173.1	7.8	110.8	V387 M482 F488 V542 F543 D544 E545	V387-R490 HydrophobicContact CG1-CB 4.3Å; V387-R490 HydrophobicContact CG1-CG 3.76Å; V387-R490 WeakPolarHBondContact O-CA 3.32Å; M482-R490 HydrophobicContact CE-CB 3.64Å; M482-R490 HydrophobicContact CE-CG 4.02Å; F488-R490 PolarHBondContact O-N 2.88Å; R490-V542 WeakPolarHBondContact CB-O 3.42Å; R490-V542 VanDerWaalsContact CD-O 3.31Å; R490-V542 WeakPolarHBondContact CD-O 3.31Å; R490-V542 PolarHBondContact NE-O 2.9Å; R490-F543 CarbonylContact O-C 3.58Å; R490-F543 WeakPolarHBondContact O-CA 3.46Å; R490-D544 VanDerWaalsContact CB-OD2 3.28Å; R490-D544 WeakPolarHBondContact CB-OD2 3.48Å; R490-D544 IonicContact CZ-OD1 3.58Å; R490-D544 IonicContact CZ-OD2 3.87Å; R490-D544 PolarHBondContact N-OD2 3.35Å; R490-D544 IonicContact NE-OD1 2.69Å; R490-D544 IonicContact NE-OD2 2.68Å; R490-D544 PolarHBondContact NE-OD2 2.81Å; R490-D544 IonicContact NH2-OD1 3.35Å; R490-D544 PolarHBondContact NH2-OD1 2.76Å; R490-D544 IonicContact NH2-OD2 3.72Å; R490-D544 PolarHBondContact O-N 3.12Å; R490-E545 PolarHBondContact O-N 3.43Å
491	K	96.3	Very high	93	Very high	39 Å²	39	43.3 Å²	43.3	17%	0.17	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	147	-178.6	-49.9	-166.3	178.4	-153.7	0	111.2	E386 V387 I388 M389 E545	E386-K491 WeakPolarHBondContact OE1-CE 3.15Å; E386-K491 IonicContact OE1-NZ 3.68Å; E386-K491 PolarHBondContact OE1-NZ 2.78Å; E386-K491 VanDerWaalsContact OE1-NZ 3.14Å; V387-K491 PolarHBondContact O-N 2.96Å; I388-K491 CarbonylContact C-O 3.59Å; I388-K491 WeakPolarHBondContact CA-O 3.38Å; I388-K491 HydrophobicContact CG1-CB 4.43Å; M389-K491 PolarHBondContact N-O 2.81Å; K491-E545 WeakPolarHBondContact CA-O 3.31Å; K491-E545 WeakPolarHBondContact CD-OE2 3.41Å; K491-E545 WeakPolarHBondContact CE-OE2 3.25Å; K491-E545 HydrophobicContact CG-CB 4.25Å; K491-E545 IonicContact NZ-OE2 3.72Å; K491-E545 PolarHBondContact NZ-OE2 3.4Å
492	A	96.5	Very high	92.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.1	164.1	0	0	0	0	0	110.5	M389 P532 F543 E545 V546 I547	M389-A492 WeakPolarHBondContact O-CA 3.4Å; A492-P532 HydrophobicContact CB-CB 4.25Å; A492-P532 HydrophobicContact CB-CG 3.72Å; A492-F543 HydrophobicContact CB-CD1 3.7Å; A492-F543 HydrophobicContact CB-CE1 3.75Å; A492-F543 HydrophobicContact CB-CG 4.08Å; A492-F543 HydrophobicContact CB-CZ 4.19Å; A492-E545 PolarHBondContact N-O 3.12Å; A492-V546 HydrophobicContact CB-CG1 4.29Å; A492-V546 HydrophobicContact CB-CG2 4.24Å; A492-V546 WeakPolarHBondContact O-CA 3.4Å; A492-I547 PolarHBondContact O-N 2.63Å
493	I	96.1	Very high	92.4	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.5	170.1	-51.3	-58.1	0	0	0	107.6	I388 M389 M390 V391 F401 I495 I547 T549	I388-I493 HydrophobicContact CG2-CD1 4.15Å; I388-I493 HydrophobicContact CG2-CG1 3.4Å; I388-I493 VanDerWaalsContact CG2-CG1 3.4Å; M389-I493 PolarHBondContact O-N 3.2Å; M390-I493 HydrophobicContact CE-CB 3.8Å; M390-I493 HydrophobicContact CE-CG1 4.4Å; M390-I493 HydrophobicContact CE-CG2 3.84Å; M390-I493 HydrophobicContact SD-CB 4.05Å; M390-I493 HydrophobicContact SD-CG1 4.18Å; V391-I493 PolarHBondContact N-O 3.39Å; F401-I493 HydrophobicContact CD1-CG2 4.17Å; F401-I493 HydrophobicContact CE1-CB 4.46Å; F401-I493 HydrophobicContact CE1-CD1 4.47Å; F401-I493 HydrophobicContact CE1-CG1 4.02Å; F401-I493 HydrophobicContact CE1-CG2 3.86Å; F401-I493 HydrophobicContact CZ-CG2 4.06Å; I493-I495 HydrophobicContact CG2-CD1 4.33Å; I493-I495 HydrophobicContact CG2-CG1 3.96Å; I493-I547 WeakPolarHBondContact CA-O 3.39Å; I493-I547 HydrophobicContact CD1-CB 3.88Å; I493-I547 HydrophobicContact CD1-CD1 3.89Å; I493-I547 HydrophobicContact CD1-CG1 4.33Å; I493-T549 HydrophobicContact CG2-CG2 3.43Å; I493-T549 VanDerWaalsContact CG2-CG2 3.43Å
494	V	95.5	Very high	92.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	105.8	-178	-177.9	0	0	0	0	108.6	V391 V496 P532 V546 I547 F548	V391-V494 HydrophobicContact CB-CG2 4.38Å; V494-V496 HydrophobicContact CG1-CG2 3.96Å; V494-P532 HydrophobicContact CG2-CG 3.62Å; V494-V546 HydrophobicContact CG2-CG1 3.76Å; V494-I547 PolarHBondContact N-O 3.48Å; V494-F548 HydrophobicContact CB-CD1 3.89Å; V494-F548 HydrophobicContact CB-CE1 3.87Å; V494-F548 HydrophobicContact CB-CG 4.24Å; V494-F548 HydrophobicContact CB-CZ 4.21Å; V494-F548 HydrophobicContact CG1-CD1 3.84Å; V494-F548 HydrophobicContact CG1-CE1 3.58Å; V494-F548 HydrophobicContact CG1-CZ 4.21Å; V494-F548 HydrophobicContact CG2-CE1 4.4Å; V494-F548 HydrophobicContact CG2-CE2 4.49Å; V494-F548 HydrophobicContact CG2-CZ 4.26Å
495	I	94.1	Very high	92	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.015	23%	0.228	C	C	.	.			trans	-102.1	109.3	179.2	-47.6	-163.3	0	0	0	109.4	M390 V391 A396 K398 F401 I493 E550	M390-I495 HydrophobicContact CE-CD1 3.69Å; M390-I495 HydrophobicContact CE-CG1 4.22Å; V391-I495 PolarHBondContact O-N 3.26Å; A396-I495 WeakPolarHBondContact O-CG2 3.48Å; K398-I495 HydrophobicContact CG-CD1 4.49Å; F401-I495 HydrophobicContact CB-CD1 3.57Å; F401-I495 HydrophobicContact CD2-CD1 4.25Å; F401-I495 HydrophobicContact CG-CD1 3.86Å; I493-I495 HydrophobicContact CG2-CD1 4.33Å; I493-I495 HydrophobicContact CG2-CG1 3.96Å; I495-E550 WeakPolarHBondContact CG2-OE1 3.47Å
496	V	93.1	Very high	91.6	Very high	5 Å²	5	50.8 Å²	50.8	3%	0.03	24%	0.237	C	C	.	.			trans	-131	95.1	176.6	-177.5	0	0	0	0	107.3	V494 F529 L551 A556 L559 V560	V494-V496 HydrophobicContact CG1-CG2 3.96Å; V496-F529 HydrophobicContact CG2-CE2 4.22Å; V496-F529 HydrophobicContact CG2-CZ 3.81Å; V496-L551 HydrophobicContact CG1-CD1 4.28Å; V496-L551 WeakPolarHBondContact O-CB 3.48Å; V496-L551 WeakPolarHBondContact O-CG 3.39Å; V496-L551 PolarHBondContact O-N 2.89Å; V496-A556 HydrophobicContact CB-CB 4.21Å; V496-A556 HydrophobicContact CG1-CB 4.36Å; V496-A556 HydrophobicContact CG2-CB 4.36Å; V496-L559 HydrophobicContact CG1-CD2 3.67Å; V496-V560 HydrophobicContact CG1-CG2 4.37Å; V496-V560 HydrophobicContact CG2-CG2 4.15Å
497	P	91.7	Very high	91.2	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.032	22%	0.218	C	C	.	.			trans	-66	167.9	167.6	25.9	-33.7	0	0	0	111.5	A396 E501 F502 E550	A396-P497 HydrophobicContact CB-CG 4.17Å; P497-E501 HydrophobicContact CB-CB 4.06Å; P497-E501 HydrophobicContact CB-CG 3.81Å; P497-F502 HydrophobicContact CG-CB 3.96Å; P497-F502 HydrophobicContact CG-CD2 4.02Å; P497-F502 HydrophobicContact CG-CG 4.44Å; P497-E550 WeakPolarHBondContact CB-OE2 3.49Å
498	T	90.9	Very high	90.9	Very high	64 Å²	64	47.4 Å²	47.4	39%	0.393	22%	0.217	S	C	.	.			trans	-60.3	152.6	162.4	60.7	0	0	0	0	110.2	E500 E501 F502 L551	T498-E500 PolarHBondContact O-N 3.41Å; T498-E501 PolarHBondContact O-N 2.86Å; T498-E501 VanDerWaalsContact O-N 3.14Å; T498-E501 WeakPolarHBondContact OG1-CB 3.36Å; T498-E501 PolarHBondContact OG1-N 3.19Å; T498-F502 WeakPolarHBondContact O-CB 3.38Å; T498-F502 PolarHBondContact O-N 2.95Å; T498-L551 HydrophobicContact CG2-CD1 4.41Å; T498-L551 HydrophobicContact CG2-CD2 4.03Å; T498-L551 HydrophobicContact CG2-CG 4.45Å
499	D	87.6	Confident	90.1	Very high	44 Å²	44	50.4 Å²	50.4	24%	0.235	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-25.7	-176.8	-171.1	63.3	0	0	0	112.7	R503 Y563	D499-R503 WeakPolarHBondContact O-CB 3.29Å; D499-R503 VanDerWaalsContact O-CG 3.27Å; D499-R503 WeakPolarHBondContact O-CG 3.35Å; D499-R503 PolarHBondContact O-N 3.37Å; D499-R503 PolarHBondContact O-NE 3.21Å; D499-R503 IonicContact OD2-CZ 2.73Å; D499-R503 IonicContact OD2-NE 2.92Å; D499-R503 PolarHBondContact OD2-NE 2.82Å; D499-R503 IonicContact OD2-NH2 3.65Å; D499-R503 PolarHBondContact OD2-NH2 3.47Å; D499-Y563 WeakPolarHBondContact OD1-CE1 3.24Å; D499-Y563 PolarHBondContact OD1-OH 3.19Å
500	E	88.9	Confident	89.4	Confident	147 Å²	147	49.9 Å²	49.9	69%	0.687	23%	0.227	S	C	*	.	H	α-helix	trans	-68.1	-47.1	171.3	-61.6	-176.1	164.8	0	0	112.2	T498 F502 R503 R504	T498-E500 PolarHBondContact O-N 3.41Å; E500-F502 VanDerWaalsContact C-N 3.32Å; E500-R503 PolarHBondContact O-N 3.28Å; E500-R504 WeakPolarHBondContact O-CB 3.38Å; E500-R504 PolarHBondContact O-N 2.96Å
501	E	89.3	Confident	88.3	Confident	36 Å²	36	56.3 Å²	56.3	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-67.3	-35.3	176.4	174	62.3	176.9	0	0	111.4	P497 T498 R504 R505	P497-E501 HydrophobicContact CB-CB 4.06Å; P497-E501 HydrophobicContact CB-CG 3.81Å; T498-E501 PolarHBondContact O-N 2.86Å; T498-E501 VanDerWaalsContact O-N 3.14Å; T498-E501 WeakPolarHBondContact OG1-CB 3.36Å; T498-E501 PolarHBondContact OG1-N 3.19Å; E501-R504 PolarHBondContact O-N 3.49Å; E501-R504 IonicContact OE1-CZ 2.66Å; E501-R504 IonicContact OE1-NH2 2.76Å; E501-R504 PolarHBondContact OE1-NH2 2.96Å; E501-R504 IonicContact OE2-CZ 2.72Å; E501-R504 IonicContact OE2-NE 3.94Å; E501-R504 PolarHBondContact OE2-NE 2.9Å; E501-R504 IonicContact OE2-NH2 2.56Å; E501-R504 PolarHBondContact OE2-NH2 2.8Å; E501-R505 VanDerWaalsContact CG-NH2 3.34Å; E501-R505 WeakPolarHBondContact O-CB 3.48Å; E501-R505 VanDerWaalsContact O-CG 3.32Å; E501-R505 WeakPolarHBondContact O-CG 3.21Å; E501-R505 PolarHBondContact O-N 2.93Å; E501-R505 IonicContact OE1-CZ 3.69Å; E501-R505 IonicContact OE1-NE 3.78Å; E501-R505 PolarHBondContact OE1-NE 2.8Å; E501-R505 IonicContact OE1-NH2 3.28Å; E501-R505 PolarHBondContact OE1-NH2 3.32Å
502	F	88.5	Confident	87.1	Confident	8 Å²	8	60.2 Å²	60.2	4%	0.035	28%	0.275	C	S	.	.	H	α-helix	trans	-59.6	-51	172.3	-173.6	-119.2	0	0	0	111.4	L393 P394 A396 P497 T498 E500 R504 R505 I506	L393-F502 HydrophobicContact CB-CE2 3.61Å; L393-F502 HydrophobicContact CB-CZ 3.59Å; L393-F502 HydrophobicContact CD1-CE1 3.94Å; L393-F502 HydrophobicContact CD1-CE2 4.09Å; L393-F502 HydrophobicContact CD1-CZ 3.54Å; L393-F502 HydrophobicContact CG-CZ 4.22Å; P394-F502 WeakPolarHBondContact O-CE2 3.23Å; A396-F502 HydrophobicContact CB-CD2 4.06Å; A396-F502 HydrophobicContact CB-CE2 3.96Å; P497-F502 HydrophobicContact CG-CB 3.96Å; P497-F502 HydrophobicContact CG-CD2 4.02Å; P497-F502 HydrophobicContact CG-CG 4.44Å; T498-F502 WeakPolarHBondContact O-CB 3.38Å; T498-F502 PolarHBondContact O-N 2.95Å; E500-F502 VanDerWaalsContact C-N 3.32Å; F502-R504 VanDerWaalsContact C-N 3.34Å; F502-R504 PolarHBondContact O-N 2.81Å; F502-R505 PolarHBondContact O-N 2.82Å; F502-I506 HydrophobicContact CD1-CD1 4.12Å; F502-I506 HydrophobicContact CD2-CD1 4.48Å; F502-I506 HydrophobicContact CE1-CD1 3.61Å; F502-I506 HydrophobicContact CE2-CD1 4.03Å; F502-I506 HydrophobicContact CZ-CD1 3.55Å; F502-I506 WeakPolarHBondContact O-CG1 3.22Å; F502-I506 PolarHBondContact O-N 3.35Å
503	R	86.6	Confident	85.6	Confident	143 Å²	143	62.3 Å²	62.3	54%	0.54	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-40.8	174.8	-75.9	-177.3	-102.9	135.1	-9.7	111.7	D499 E500 I506 A507	D499-R503 WeakPolarHBondContact O-CB 3.29Å; D499-R503 VanDerWaalsContact O-CG 3.27Å; D499-R503 WeakPolarHBondContact O-CG 3.35Å; D499-R503 PolarHBondContact O-N 3.37Å; D499-R503 PolarHBondContact O-NE 3.21Å; D499-R503 IonicContact OD2-CZ 2.73Å; D499-R503 IonicContact OD2-NE 2.92Å; D499-R503 PolarHBondContact OD2-NE 2.82Å; D499-R503 IonicContact OD2-NH2 3.65Å; D499-R503 PolarHBondContact OD2-NH2 3.47Å; E500-R503 PolarHBondContact O-N 3.28Å; R503-I506 PolarHBondContact O-N 2.82Å; R503-A507 WeakPolarHBondContact O-CB 3.16Å; R503-A507 PolarHBondContact O-N 3.42Å
504	R	89.1	Confident	83.9	Confident	152 Å²	152	65.1 Å²	65.1	57%	0.574	31%	0.314	S	S	*	.	H	α-helix	trans	-60.6	-48.4	175.1	-169.6	177.6	71.5	122.1	2.8	112	E500 E501 F502 I506 A507 Q508	E500-R504 WeakPolarHBondContact O-CB 3.38Å; E500-R504 PolarHBondContact O-N 2.96Å; E501-R504 PolarHBondContact O-N 3.49Å; E501-R504 IonicContact OE1-CZ 2.66Å; E501-R504 IonicContact OE1-NH2 2.76Å; E501-R504 PolarHBondContact OE1-NH2 2.96Å; E501-R504 IonicContact OE2-CZ 2.72Å; E501-R504 IonicContact OE2-NE 3.94Å; E501-R504 PolarHBondContact OE2-NE 2.9Å; E501-R504 IonicContact OE2-NH2 2.56Å; E501-R504 PolarHBondContact OE2-NH2 2.8Å; F502-R504 VanDerWaalsContact C-N 3.34Å; F502-R504 PolarHBondContact O-N 2.81Å; R504-I506 PolarHBondContact O-N 3.06Å; R504-A507 PolarHBondContact O-N 3.28Å; R504-Q508 WeakPolarHBondContact O-CB 3.24Å; R504-Q508 PolarHBondContact O-N 2.93Å
505	R	88.4	Confident	82.4	Confident	48 Å²	48	68.2 Å²	68.2	18%	0.181	33%	0.327	C	S	.	.	H	α-helix	trans	-64.7	-35	179.5	-72	177.2	-171.7	167.4	11.4	112.9	A396 E501 F502 R509 E550	A396-R505 PolarHBondContact O-NH1 2.95Å; E501-R505 VanDerWaalsContact CG-NH2 3.34Å; E501-R505 WeakPolarHBondContact O-CB 3.48Å; E501-R505 VanDerWaalsContact O-CG 3.32Å; E501-R505 WeakPolarHBondContact O-CG 3.21Å; E501-R505 PolarHBondContact O-N 2.93Å; E501-R505 IonicContact OE1-CZ 3.69Å; E501-R505 IonicContact OE1-NE 3.78Å; E501-R505 PolarHBondContact OE1-NE 2.8Å; E501-R505 IonicContact OE1-NH2 3.28Å; E501-R505 PolarHBondContact OE1-NH2 3.32Å; F502-R505 PolarHBondContact O-N 2.82Å; R505-R509 WeakPolarHBondContact O-CG 3.19Å; R505-R509 PolarHBondContact O-N 2.99Å; R505-R509 VanDerWaalsContact O-N 3.11Å; R505-E550 IonicContact CZ-OE1 3.52Å; R505-E550 IonicContact CZ-OE2 2.68Å; R505-E550 VanDerWaalsContact CZ-OE2 3.26Å; R505-E550 IonicContact NH1-OE1 3.62Å; R505-E550 PolarHBondContact NH1-OE1 2.94Å; R505-E550 IonicContact NH1-OE2 3.05Å; R505-E550 PolarHBondContact NH1-OE2 3.07Å; R505-E550 IonicContact NH2-OE1 3.55Å; R505-E550 PolarHBondContact NH2-OE1 3.37Å; R505-E550 IonicContact NH2-OE2 2.71Å; R505-E550 PolarHBondContact NH2-OE2 2.85Å
506	I	84.7	Confident	80.8	Confident	35 Å²	35	75.8 Å²	75.8	18%	0.179	36%	0.363	C	S	.	.	H	α-helix	trans	-67	-54.6	173.3	-72	174	0	0	0	110.3	F502 R503 R504 Q508 R509 E510	F502-I506 HydrophobicContact CD1-CD1 4.12Å; F502-I506 HydrophobicContact CD2-CD1 4.48Å; F502-I506 HydrophobicContact CE1-CD1 3.61Å; F502-I506 HydrophobicContact CE2-CD1 4.03Å; F502-I506 HydrophobicContact CZ-CD1 3.55Å; F502-I506 WeakPolarHBondContact O-CG1 3.22Å; F502-I506 PolarHBondContact O-N 3.35Å; R503-I506 PolarHBondContact O-N 2.82Å; R504-I506 PolarHBondContact O-N 3.06Å; I506-Q508 PolarHBondContact O-N 3.4Å; I506-Q508 VanDerWaalsContact O-N 3.12Å; I506-R509 PolarHBondContact O-N 2.64Å; I506-E510 HydrophobicContact CG2-CG 4.41Å; I506-E510 VanDerWaalsContact CG2-OE1 3.28Å; I506-E510 WeakPolarHBondContact CG2-OE1 3.27Å; I506-E510 WeakPolarHBondContact O-CG 3.41Å; I506-E510 PolarHBondContact O-N 2.78Å
507	A	82.3	Confident	79.7	Confident	37 Å²	37	78.1 Å²	78.1	31%	0.306	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-22.8	-179.4	0	0	0	0	0	113.5	R503 R504 K511	R503-A507 WeakPolarHBondContact O-CB 3.16Å; R503-A507 PolarHBondContact O-N 3.42Å; R504-A507 PolarHBondContact O-N 3.28Å; A507-K511 VanDerWaalsContact O-CD 3.26Å; A507-K511 WeakPolarHBondContact O-CD 3.42Å; A507-K511 WeakPolarHBondContact O-CE 3.24Å; A507-K511 VanDerWaalsContact O-CG 3.24Å; A507-K511 WeakPolarHBondContact O-CG 3.38Å
508	Q	83.7	Confident	78.8	Confident	82 Å²	82	81.5 Å²	81.5	38%	0.383	40%	0.399	S	S	.	.	H	α-helix	trans	-74.4	-50	169.9	-177.6	170.1	-0.1	0	0	111.6	R504 I506 E510 K511 E512	R504-Q508 WeakPolarHBondContact O-CB 3.24Å; R504-Q508 PolarHBondContact O-N 2.93Å; I506-Q508 PolarHBondContact O-N 3.4Å; I506-Q508 VanDerWaalsContact O-N 3.12Å; Q508-E510 VanDerWaalsContact C-N 3.28Å; Q508-E510 PolarHBondContact O-N 2.68Å; Q508-K511 WeakPolarHBondContact O-CB 3.29Å; Q508-K511 PolarHBondContact O-N 2.9Å; Q508-K511 VanDerWaalsContact O-N 3.09Å; Q508-E512 VanDerWaalsContact CG-CD 3.48Å; Q508-E512 HydrophobicContact CG-CG 4.32Å; Q508-E512 WeakPolarHBondContact CG-OE1 3.3Å; Q508-E512 PolarHBondContact NE2-OE1 3.2Å; Q508-E512 WeakPolarHBondContact O-CG 3.47Å; Q508-E512 PolarHBondContact O-N 3.34Å
509	R	78.5	Confident	78.3	Confident	72 Å²	72	85.9 Å²	85.9	27%	0.272	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-33.9	176.6	-75.2	175.1	179.8	-91	-1.9	113.1	G395 R505 I506 K511 E512 E513	G395-R509 PolarHBondContact O-NE 2.81Å; R505-R509 WeakPolarHBondContact O-CG 3.19Å; R505-R509 PolarHBondContact O-N 2.99Å; R505-R509 VanDerWaalsContact O-N 3.11Å; I506-R509 PolarHBondContact O-N 2.64Å; R509-K511 VanDerWaalsContact C-N 3.32Å; R509-K511 PolarHBondContact O-N 3.46Å; R509-E512 PolarHBondContact O-N 2.97Å; R509-E513 IonicContact CZ-OE1 3.89Å; R509-E513 IonicContact NH1-OE1 2.89Å; R509-E513 PolarHBondContact NH1-OE1 2.81Å; R509-E513 WeakPolarHBondContact O-CA 3.35Å; R509-E513 WeakPolarHBondContact O-CB 3.42Å; R509-E513 PolarHBondContact O-N 3.33Å
510	E	78.2	Confident	78.1	Confident	80 Å²	80	88.2 Å²	88.2	37%	0.374	43%	0.431	S	S	.	.	H	α-helix	trans	-65.9	-36.5	175.8	-73.2	166.1	170.8	0	0	111.9	I506 Q508 G514	I506-E510 HydrophobicContact CG2-CG 4.41Å; I506-E510 VanDerWaalsContact CG2-OE1 3.28Å; I506-E510 WeakPolarHBondContact CG2-OE1 3.27Å; I506-E510 WeakPolarHBondContact O-CG 3.41Å; I506-E510 PolarHBondContact O-N 2.78Å; Q508-E510 VanDerWaalsContact C-N 3.28Å; Q508-E510 PolarHBondContact O-N 2.68Å; E510-G514 WeakPolarHBondContact O-CA 3.44Å; E510-G514 PolarHBondContact O-N 3.17Å
511	K	75.1	Confident	77.8	Confident	179 Å²	179	83 Å²	83	78%	0.778	41%	0.413	S	S	*	.	H	α-helix	trans	-72.9	-40.7	174.8	-68	167	-170.9	174.5	0	113	A507 Q508 R509	A507-K511 VanDerWaalsContact O-CD 3.26Å; A507-K511 WeakPolarHBondContact O-CD 3.42Å; A507-K511 WeakPolarHBondContact O-CE 3.24Å; A507-K511 VanDerWaalsContact O-CG 3.24Å; A507-K511 WeakPolarHBondContact O-CG 3.38Å; Q508-K511 WeakPolarHBondContact O-CB 3.29Å; Q508-K511 PolarHBondContact O-N 2.9Å; Q508-K511 VanDerWaalsContact O-N 3.09Å; R509-K511 VanDerWaalsContact C-N 3.32Å; R509-K511 PolarHBondContact O-N 3.46Å
512	E	70.6	Confident	77.6	Confident	121 Å²	121	82.2 Å²	82.2	57%	0.565	41%	0.41	S	S	*	.	H	α-helix	trans	-87.6	-50.6	-173.9	-68.4	171.3	177.9	0	0	112.8	Q508 R509	Q508-E512 VanDerWaalsContact CG-CD 3.48Å; Q508-E512 HydrophobicContact CG-CG 4.32Å; Q508-E512 WeakPolarHBondContact CG-OE1 3.3Å; Q508-E512 PolarHBondContact NE2-OE1 3.2Å; Q508-E512 WeakPolarHBondContact O-CG 3.47Å; Q508-E512 PolarHBondContact O-N 3.34Å; R509-E512 PolarHBondContact O-N 2.97Å
513	E	63.9	Low	77.5	Confident	44 Å²	44	83.6 Å²	83.6	21%	0.206	42%	0.418	C	S	.	.	H	α-helix	trans	-86.8	-16.9	-175.1	-67	-161.9	-119	0	0	113.3	R433 Q434 R509 K515	R433-E513 IonicContact NH1-OE2 2.64Å; Q434-E513 PolarHBondContact NE2-O 3.34Å; R509-E513 IonicContact CZ-OE1 3.89Å; R509-E513 IonicContact NH1-OE1 2.89Å; R509-E513 PolarHBondContact NH1-OE1 2.81Å; R509-E513 WeakPolarHBondContact O-CA 3.35Å; R509-E513 WeakPolarHBondContact O-CB 3.42Å; R509-E513 PolarHBondContact O-N 3.33Å; E513-K515 HydrophobicContact CB-CB 4.34Å; E513-K515 HydrophobicContact CB-CD 4.38Å; E513-K515 HydrophobicContact CB-CG 4.17Å; E513-K515 PolarHBondContact O-N 3.43Å; E513-K515 IonicContact OE2-NZ 2.68Å; E513-K515 PolarHBondContact OE2-NZ 2.88Å
514	G	60.9	Low	77.6	Confident	62 Å²	62	81.7 Å²	81.7	64%	0.639	42%	0.415	S	S	*	.			trans	64.4	21.1	-174.6	0	0	0	0	0	113.8	E510	E510-G514 WeakPolarHBondContact O-CA 3.44Å; E510-G514 PolarHBondContact O-N 3.17Å
515	K	64.6	Low	77.6	Confident	65 Å²	65	76.3 Å²	76.3	28%	0.283	40%	0.397	S	S	.	.			trans	-111.7	95.8	-174.6	-63.8	-177	-163.8	77.6	0	110.6	E513 V517	E513-K515 HydrophobicContact CB-CB 4.34Å; E513-K515 HydrophobicContact CB-CD 4.38Å; E513-K515 HydrophobicContact CB-CG 4.17Å; E513-K515 PolarHBondContact O-N 3.43Å; E513-K515 IonicContact OE2-NZ 2.68Å; E513-K515 PolarHBondContact OE2-NZ 2.88Å; K515-V517 PolarHBondContact O-N 3.37Å
516	E	60.9	Low	77.7	Confident	163 Å²	163	74.8 Å²	74.8	76%	0.762	39%	0.392	S	S	*	.			trans	-61.6	129.8	162.4	-168.9	179.2	161.9	0	0	109.1
517	V	68.5	Low	77.9	Confident	54 Å²	54	73.3 Å²	73.3	33%	0.327	38%	0.384	S	S	.	.			trans	-100.8	113.8	174.6	-176.6	0	0	0	0	107.3	P394 K515 E519 V522	P394-V517 HydrophobicContact CB-CG1 4.01Å; P394-V517 HydrophobicContact CG-CG1 4.33Å; K515-V517 PolarHBondContact O-N 3.37Å; V517-E519 PolarHBondContact O-N 3.08Å; V517-E519 VanDerWaalsContact O-N 3.17Å; V517-V522 HydrophobicContact CB-CG2 4.39Å; V517-V522 HydrophobicContact CG1-CG2 3.73Å
518	P	74.6	Confident	78.3	Confident	76 Å²	76	73.9 Å²	73.9	49%	0.494	38%	0.383	S	S	.	.			trans	-53.3	123.7	-173.2	-29.5	35.4	0	0	0	112.6	T520 A521 V522	P518-T520 PolarHBondContact O-N 2.96Å; P518-T520 VanDerWaalsContact O-N 3.1Å; P518-A521 WeakPolarHBondContact O-CB 3.4Å; P518-A521 PolarHBondContact O-N 2.93Å; P518-V522 PolarHBondContact O-N 3.02Å
519	E	79.5	Confident	78.8	Confident	156 Å²	156	70.3 Å²	70.3	73%	0.729	37%	0.366	S	S	*	.	H	α-helix	trans	-53.3	-37.1	-176.6	-62	-173.6	146.9	0	0	112	V517 A521 V522 L523	V517-E519 PolarHBondContact O-N 3.08Å; V517-E519 VanDerWaalsContact O-N 3.17Å; E519-A521 VanDerWaalsContact C-N 3.3Å; E519-A521 PolarHBondContact O-N 3.1Å; E519-V522 PolarHBondContact O-N 2.69Å; E519-V522 VanDerWaalsContact O-N 3.13Å; E519-L523 WeakPolarHBondContact O-CB 3.43Å; E519-L523 WeakPolarHBondContact O-CG 3.05Å; E519-L523 PolarHBondContact O-N 2.85Å
520	T	82.4	Confident	79.4	Confident	92 Å²	92	67.8 Å²	67.8	56%	0.564	36%	0.362	S	S	*	.	H	α-helix	trans	-57.3	-38.6	175.8	52.9	0	0	0	0	113.1	P518 E524	P518-T520 PolarHBondContact O-N 2.96Å; P518-T520 VanDerWaalsContact O-N 3.1Å; T520-E524 PolarHBondContact O-N 2.79Å
521	A	82.5	Confident	80	Confident	37 Å²	37	65.8 Å²	65.8	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-75.7	-34.4	176.2	0	0	0	0	0	112	P518 E519 M525	P518-A521 WeakPolarHBondContact O-CB 3.4Å; P518-A521 PolarHBondContact O-N 2.93Å; E519-A521 VanDerWaalsContact C-N 3.3Å; E519-A521 PolarHBondContact O-N 3.1Å; A521-M525 WeakPolarHBondContact O-CB 3.44Å; A521-M525 WeakPolarHBondContact O-CG 3.45Å; A521-M525 PolarHBondContact O-N 2.93Å
522	V	85.6	Confident	80.9	Confident	20 Å²	20	57.6 Å²	57.6	12%	0.121	32%	0.319	C	S	.	.	H	α-helix	trans	-65.9	-44	172.9	-176.4	0	0	0	0	110.4	V517 P518 E519 M525 K526	V517-V522 HydrophobicContact CB-CG2 4.39Å; V517-V522 HydrophobicContact CG1-CG2 3.73Å; P518-V522 PolarHBondContact O-N 3.02Å; E519-V522 PolarHBondContact O-N 2.69Å; E519-V522 VanDerWaalsContact O-N 3.13Å; V522-M525 PolarHBondContact O-N 3.47Å; V522-K526 WeakPolarHBondContact O-CB 3.3Å; V522-K526 WeakPolarHBondContact O-CG 3.48Å; V522-K526 PolarHBondContact O-N 2.99Å
523	L	87.5	Confident	81.8	Confident	37 Å²	37	58.2 Å²	58.2	19%	0.194	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-43.9	175.4	-74.2	167.6	0	0	0	111.8	E519 M525 K526 A527 E566 N570	E519-L523 WeakPolarHBondContact O-CB 3.43Å; E519-L523 WeakPolarHBondContact O-CG 3.05Å; E519-L523 PolarHBondContact O-N 2.85Å; L523-M525 VanDerWaalsContact C-N 3.3Å; L523-M525 PolarHBondContact O-N 3.47Å; L523-K526 PolarHBondContact O-N 3.34Å; L523-A527 VanDerWaalsContact O-CB 3.25Å; L523-A527 WeakPolarHBondContact O-CB 3.46Å; L523-A527 PolarHBondContact O-N 3.36Å; L523-E566 HydrophobicContact CD2-CG 4.28Å; L523-E566 WeakPolarHBondContact CD2-OE1 3.33Å; L523-N570 HydrophobicContact CD1-CB 4.13Å; L523-N570 HydrophobicContact CD2-CB 4.16Å
524	E	88	Confident	83.2	Confident	104 Å²	104	57 Å²	57	49%	0.486	31%	0.312	S	S	.	.	H	α-helix	trans	-62.9	-37.7	175.4	-155.5	-140.3	116.1	0	0	111.9	Y474 T520 A527 N528	Y474-E524 WeakPolarHBondContact CE1-OE1 3.46Å; Y474-E524 PolarHBondContact OH-OE1 2.9Å; T520-E524 PolarHBondContact O-N 2.79Å; E524-A527 PolarHBondContact O-N 3.41Å; E524-N528 PolarHBondContact O-N 3.05Å; E524-N528 PolarHBondContact O-ND2 2.94Å
525	M	88.7	Confident	84.6	Confident	38 Å²	38	56.7 Å²	56.7	19%	0.187	30%	0.298	C	S	.	.	H	α-helix	trans	-70.1	-43.4	175.6	-73.8	-168.4	-147.4	0	0	112.5	L393 P394 T471 V473 Y474 A521 V522 L523 A527 N528 F529	L393-M525 HydrophobicContact CD2-CB 3.87Å; P394-M525 HydrophobicContact CG-CE 4.32Å; P394-M525 HydrophobicContact CG-SD 3.78Å; T471-M525 HydrophobicContact CG2-SD 3.84Å; V473-M525 HydrophobicContact CG2-CB 3.96Å; V473-M525 HydrophobicContact CG2-CG 4.06Å; V473-M525 HydrophobicContact CG2-SD 4.48Å; Y474-M525 HydrophobicContact CE2-CG 4.11Å; A521-M525 WeakPolarHBondContact O-CB 3.44Å; A521-M525 WeakPolarHBondContact O-CG 3.45Å; A521-M525 PolarHBondContact O-N 2.93Å; V522-M525 PolarHBondContact O-N 3.47Å; L523-M525 VanDerWaalsContact C-N 3.3Å; L523-M525 PolarHBondContact O-N 3.47Å; M525-A527 VanDerWaalsContact C-N 3.3Å; M525-A527 PolarHBondContact O-N 3.29Å; M525-N528 PolarHBondContact O-N 2.91Å; M525-F529 PolarHBondContact O-N 3.45Å; M525-F529 VanDerWaalsContact O-N 3.15Å
526	K	91.3	Very high	85.8	Confident	17 Å²	17	58.8 Å²	58.8	7%	0.074	32%	0.32	C	S	.	.	H	α-helix	trans	-54.3	-46.8	171.1	-83	-169.5	173.5	-170.8	0	110.9	L393 V522 L523 N528 F529 Y563 N564 E566	L393-K526 HydrophobicContact CD1-CG 3.84Å; L393-K526 HydrophobicContact CD2-CG 4.15Å; V522-K526 WeakPolarHBondContact O-CB 3.3Å; V522-K526 WeakPolarHBondContact O-CG 3.48Å; V522-K526 PolarHBondContact O-N 2.99Å; L523-K526 PolarHBondContact O-N 3.34Å; K526-N528 PolarHBondContact O-N 3.49Å; K526-N528 VanDerWaalsContact O-N 3.14Å; K526-F529 PolarHBondContact O-N 2.76Å; K526-Y563 CarbonylContact C-O 3.5Å; K526-Y563 HydrophobicContact CD-CD1 3.83Å; K526-Y563 HydrophobicContact CD-CD2 4.44Å; K526-Y563 HydrophobicContact CD-CE1 4.41Å; K526-Y563 HydrophobicContact CD-CG 3.86Å; K526-Y563 VanDerWaalsContact CE-CD1 3.47Å; K526-Y563 HydrophobicContact CG-CD1 4.39Å; K526-Y563 HydrophobicContact CG-CD2 4.13Å; K526-Y563 HydrophobicContact CG-CG 3.9Å; K526-N564 WeakPolarHBondContact O-CA 3.45Å; K526-N564 PolarHBondContact O-OD1 3.47Å; K526-E566 WeakPolarHBondContact CD-OE1 3.13Å; K526-E566 WeakPolarHBondContact CD-OE2 3.42Å; K526-E566 IonicContact NZ-OE1 3.27Å; K526-E566 PolarHBondContact NZ-OE1 2.59Å; K526-E566 IonicContact NZ-OE2 2.66Å; K526-E566 PolarHBondContact NZ-OE2 2.57Å
527	A	89.4	Confident	87.1	Confident	3 Å²	3	55.4 Å²	55.4	3%	0.025	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.5	-177.6	0	0	0	0	0	115.5	L523 E524 M525 N564 G567 R571	L523-A527 VanDerWaalsContact O-CB 3.25Å; L523-A527 WeakPolarHBondContact O-CB 3.46Å; L523-A527 PolarHBondContact O-N 3.36Å; E524-A527 PolarHBondContact O-N 3.41Å; M525-A527 VanDerWaalsContact C-N 3.3Å; M525-A527 PolarHBondContact O-N 3.29Å; A527-N564 VanDerWaalsContact C-OD1 3.31Å; A527-N564 PolarHBondContact O-OD1 2.87Å; A527-G567 WeakPolarHBondContact CB-O 3.23Å; A527-R571 PolarHBondContact O-NH2 3.39Å
528	N	90.5	Very high	88	Confident	50 Å²	50	55.4 Å²	55.4	27%	0.267	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	16.2	-175.3	-64.2	-75.1	0	0	0	112.2	V473 Y474 E524 M525 K526 G530 R571	V473-N528 VanDerWaalsContact O-O 3.13Å; Y474-N528 HydrophobicContact CD1-CB 3.61Å; Y474-N528 HydrophobicContact CE1-CB 3.59Å; E524-N528 PolarHBondContact O-N 3.05Å; E524-N528 PolarHBondContact O-ND2 2.94Å; M525-N528 PolarHBondContact O-N 2.91Å; K526-N528 PolarHBondContact O-N 3.49Å; K526-N528 VanDerWaalsContact O-N 3.14Å; N528-G530 PolarHBondContact O-N 3.29Å; N528-R571 VanDerWaalsContact CG-NH2 3.33Å; N528-R571 PolarHBondContact ND2-NH2 3.26Å; N528-R571 PolarHBondContact OD1-NH2 3.08Å
529	F	93	Very high	88.5	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.026	32%	0.315	C	S	.	.			trans	-74.7	98.6	-178.8	-166.1	-22.9	0	0	0	109.7	V391 L393 V473 V496 M525 K526 I531 V560 N564	V391-F529 HydrophobicContact CG1-CE1 3.93Å; V391-F529 HydrophobicContact CG1-CZ 4.44Å; L393-F529 HydrophobicContact CD2-CD2 4.06Å; L393-F529 HydrophobicContact CG-CD2 4.02Å; L393-F529 HydrophobicContact CG-CE2 4.06Å; V473-F529 HydrophobicContact CB-CB 4.18Å; V473-F529 HydrophobicContact CB-CD1 4.13Å; V473-F529 HydrophobicContact CB-CD2 4.46Å; V473-F529 HydrophobicContact CB-CG 3.99Å; V473-F529 HydrophobicContact CG1-CD1 4.14Å; V473-F529 HydrophobicContact CG1-CD2 3.94Å; V473-F529 HydrophobicContact CG1-CE1 4.34Å; V473-F529 HydrophobicContact CG1-CE2 4.15Å; V473-F529 HydrophobicContact CG1-CG 3.94Å; V473-F529 HydrophobicContact CG1-CZ 4.35Å; V496-F529 HydrophobicContact CG2-CE2 4.22Å; V496-F529 HydrophobicContact CG2-CZ 3.81Å; M525-F529 PolarHBondContact O-N 3.45Å; M525-F529 VanDerWaalsContact O-N 3.15Å; K526-F529 PolarHBondContact O-N 2.76Å; F529-I531 HydrophobicContact CE1-CG1 4.26Å; F529-V560 HydrophobicContact CB-CG1 3.95Å; F529-V560 HydrophobicContact CD1-CG1 4.03Å; F529-V560 HydrophobicContact CD1-CG2 4.45Å; F529-V560 HydrophobicContact CD2-CG1 4.32Å; F529-V560 HydrophobicContact CD2-CG2 4.06Å; F529-V560 HydrophobicContact CE1-CG2 4.35Å; F529-V560 HydrophobicContact CE2-CG2 3.95Å; F529-V560 HydrophobicContact CG-CG1 3.85Å; F529-V560 HydrophobicContact CG-CG2 4.31Å; F529-V560 HydrophobicContact CZ-CG2 4.1Å; F529-V560 VanDerWaalsContact O-CG1 3.32Å; F529-V560 WeakPolarHBondContact O-CG1 3.32Å; F529-N564 PolarHBondContact N-OD1 3.02Å; F529-N564 PolarHBondContact O-ND2 2.89Å
530	G	91	Very high	88.7	Confident	19 Å²	19	53.6 Å²	53.6	20%	0.196	31%	0.306	C	S	.	.			trans	-97.3	114.5	169.2	0	0	0	0	0	111	V473 Q478 N528	V473-G530 PolarHBondContact O-N 2.75Å; Q478-G530 PolarHBondContact NE2-O 2.88Å; N528-G530 PolarHBondContact O-N 3.29Å
531	I	92.2	Very high	89	Confident	39 Å²	39	50.4 Å²	50.4	20%	0.2	29%	0.288	C	S	.	.			trans	-61.8	130.1	171.4	-64.2	176.5	0	0	0	109	F529 F548 K557 V560	F529-I531 HydrophobicContact CE1-CG1 4.26Å; I531-F548 HydrophobicContact CG2-CE1 4.15Å; I531-F548 HydrophobicContact CG2-CZ 3.65Å; I531-K557 HydrophobicContact CD1-CG 4.07Å; I531-V560 HydrophobicContact CD1-CB 4.02Å; I531-V560 HydrophobicContact CD1-CG1 4.23Å; I531-V560 HydrophobicContact CD1-CG2 4.12Å; I531-V560 HydrophobicContact CG1-CB 4.38Å; I531-V560 HydrophobicContact CG1-CG1 4.11Å; I531-V560 HydrophobicContact CG1-CG2 4.35Å
532	P	92.2	Very high	89.4	Confident	7 Å²	7	49 Å²	49	5%	0.045	28%	0.276	C	S	.	.			trans	-70.3	150.2	174.3	30.4	-35.2	0	0	0	111.4	V391 A492 V494 F543 V546	V391-P532 HydrophobicContact CG2-CG 4.39Å; A492-P532 HydrophobicContact CB-CB 4.25Å; A492-P532 HydrophobicContact CB-CG 3.72Å; V494-P532 HydrophobicContact CG2-CG 3.62Å; P532-F543 HydrophobicContact CB-CD2 3.6Å; P532-F543 HydrophobicContact CB-CE2 3.49Å; P532-F543 VanDerWaalsContact CB-CE2 3.49Å; P532-F543 HydrophobicContact CB-CG 4.5Å; P532-F543 HydrophobicContact CB-CZ 4.32Å; P532-V546 HydrophobicContact CB-CG2 4.37Å; P532-V546 HydrophobicContact CG-CG1 4.03Å; P532-V546 HydrophobicContact CG-CG2 4.46Å
533	R	91	Very high	89.9	Confident	134 Å²	134	48.2 Å²	48.2	51%	0.506	27%	0.27	S	S	.	.			trans	-112.1	151	172	-66.1	-179.9	-175.6	-109.4	9.9	110.4	E537 D538 S541	R533-E537 HydrophobicContact CB-CB 4.25Å; R533-E537 WeakPolarHBondContact CD-OE2 3.24Å; R533-E537 IonicContact CZ-OE2 3.66Å; R533-E537 IonicContact NE-OE2 3.76Å; R533-E537 IonicContact NH1-OE2 2.79Å; R533-E537 PolarHBondContact NH1-OE2 2.86Å; R533-D538 HydrophobicContact CB-CB 4.16Å; R533-S541 WeakPolarHBondContact O-CB 3.3Å; R533-S541 PolarHBondContact O-OG 2.93Å
534	P	93	Very high	90.1	Very high	19 Å²	19	49.8 Å²	49.8	12%	0.123	28%	0.279	C	S	.	.			trans	-71	158.3	169.7	32	-35.8	0	0	0	111.2	S536 E537 D538 F543 V546	P534-S536 WeakPolarHBondContact CB-OG 3.32Å; P534-S536 WeakPolarHBondContact CG-OG 3.21Å; P534-S536 PolarHBondContact O-N 2.7Å; P534-E537 HydrophobicContact CG-CB 4.22Å; P534-E537 HydrophobicContact CG-CG 4.04Å; P534-E537 PolarHBondContact O-N 2.79Å; P534-D538 PolarHBondContact O-N 2.89Å; P534-F543 CarbonylContact C-O 3.58Å; P534-F543 WeakPolarHBondContact CA-O 3.41Å; P534-V546 HydrophobicContact CB-CG2 4.31Å
535	V	90.4	Very high	90.4	Very high	55 Å²	55	48.5 Å²	48.5	33%	0.333	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-22	175.4	163.4	0	0	0	0	112.7	D538 F543	V535-D538 CarbonylContact O-C 3.14Å; V535-F543 WeakPolarHBondContact CG2-O 3.45Å; V535-F543 PolarHBondContact N-O 3.19Å
536	S	89.1	Confident	90.7	Very high	109 Å²	109	48.1 Å²	48.1	76%	0.762	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-28.3	172.5	50.3	0	0	0	0	114.3	P534	P534-S536 WeakPolarHBondContact CB-OG 3.32Å; P534-S536 WeakPolarHBondContact CG-OG 3.21Å; P534-S536 PolarHBondContact O-N 2.7Å
537	E	88.7	Confident	90.8	Very high	92 Å²	92	50.2 Å²	50.2	43%	0.43	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-41.9	172.4	-80.2	-173.7	-140.9	0	0	112.3	R533 P534	R533-E537 HydrophobicContact CB-CB 4.25Å; R533-E537 WeakPolarHBondContact CD-OE2 3.24Å; R533-E537 IonicContact CZ-OE2 3.66Å; R533-E537 IonicContact NE-OE2 3.76Å; R533-E537 IonicContact NH1-OE2 2.79Å; R533-E537 PolarHBondContact NH1-OE2 2.86Å; P534-E537 HydrophobicContact CG-CB 4.22Å; P534-E537 HydrophobicContact CG-CG 4.04Å; P534-E537 PolarHBondContact O-N 2.79Å
538	D	86.2	Confident	91	Very high	53 Å²	53	52 Å²	52	28%	0.283	29%	0.291	S	S	.	.			trans	-133.3	101.5	-173.3	179.3	-2.4	0	0	0	109.9	R533 P534 V535 S540 S541	R533-D538 HydrophobicContact CB-CB 4.16Å; P534-D538 PolarHBondContact O-N 2.89Å; V535-D538 CarbonylContact O-C 3.14Å; D538-S540 VanDerWaalsContact CG-OG 3.28Å; D538-S540 PolarHBondContact O-N 3.21Å; D538-S540 WeakPolarHBondContact OD1-CA 3.35Å; D538-S540 VanDerWaalsContact OD1-CB 3.23Å; D538-S540 WeakPolarHBondContact OD1-CB 3.46Å; D538-S540 PolarHBondContact OD1-N 2.95Å; D538-S540 PolarHBondContact OD1-OG 2.74Å; D538-S540 PolarHBondContact OD2-OG 2.66Å; D538-S541 WeakPolarHBondContact O-CB 3.5Å; D538-S541 PolarHBondContact O-N 3.28Å
539	P	86.4	Confident	91	Very high	117 Å²	117	51.9 Å²	51.9	76%	0.76	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-8.5	176.4	-26.5	35.8	0	0	0	115.2
540	S	84.2	Confident	90.7	Very high	77 Å²	77	55.5 Å²	55.5	54%	0.538	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.4	171.8	83.6	0	0	0	0	114	D538	D538-S540 VanDerWaalsContact CG-OG 3.28Å; D538-S540 PolarHBondContact O-N 3.21Å; D538-S540 WeakPolarHBondContact OD1-CA 3.35Å; D538-S540 VanDerWaalsContact OD1-CB 3.23Å; D538-S540 WeakPolarHBondContact OD1-CB 3.46Å; D538-S540 PolarHBondContact OD1-N 2.95Å; D538-S540 PolarHBondContact OD1-OG 2.74Å; D538-S540 PolarHBondContact OD2-OG 2.66Å
541	S	88.4	Confident	90.6	Very high	25 Å²	25	56.2 Å²	56.2	18%	0.175	31%	0.309	C	S	.	.			trans	-70.8	173	176.8	-165.6	0	0	0	0	113.2	R533 D538 F543	R533-S541 WeakPolarHBondContact O-CB 3.3Å; R533-S541 PolarHBondContact O-OG 2.93Å; D538-S541 WeakPolarHBondContact O-CB 3.5Å; D538-S541 PolarHBondContact O-N 3.28Å; S541-F543 PolarHBondContact OG-N 2.86Å
542	V	91.3	Very high	90.4	Very high	9 Å²	9	56.1 Å²	56.1	6%	0.055	32%	0.317	C	S	.	.	S	Bend	trans	-126.4	6.5	-179.6	-63.8	0	0	0	0	112.4	R479 M482 R483 R490	R479-V542 HydrophobicContact CB-CG1 4.47Å; R479-V542 HydrophobicContact CG-CG1 4.06Å; R479-V542 HydrophobicContact CG-CG2 4.18Å; M482-V542 HydrophobicContact CB-CB 4.02Å; M482-V542 HydrophobicContact CB-CG2 3.76Å; M482-V542 HydrophobicContact CG-CG2 4.13Å; R483-V542 HydrophobicContact CG-CG1 4.24Å; R490-V542 WeakPolarHBondContact CB-O 3.42Å; R490-V542 VanDerWaalsContact CD-O 3.31Å; R490-V542 WeakPolarHBondContact CD-O 3.31Å; R490-V542 PolarHBondContact NE-O 2.9Å
543	F	94.6	Very high	90.3	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.009	33%	0.33	C	S	.	.			trans	-116.4	126.4	-178.2	-59.8	-74.6	0	0	0	109.8	M389 Q478 M482 R490 A492 P532 P534 V535 S541 E545 V546	M389-F543 HydrophobicContact CB-CE1 3.92Å; M389-F543 HydrophobicContact CB-CZ 4.47Å; M389-F543 HydrophobicContact SD-CE1 4.11Å; M389-F543 HydrophobicContact SD-CZ 3.75Å; Q478-F543 HydrophobicContact CB-CE2 4.05Å; Q478-F543 HydrophobicContact CB-CZ 3.97Å; Q478-F543 HydrophobicContact CG-CE2 4.46Å; Q478-F543 HydrophobicContact CG-CZ 4.3Å; M482-F543 HydrophobicContact CE-CD1 4.04Å; M482-F543 HydrophobicContact CE-CE1 3.79Å; M482-F543 HydrophobicContact CG-CD1 4.31Å; M482-F543 HydrophobicContact CG-CE1 3.52Å; M482-F543 HydrophobicContact CG-CZ 3.79Å; M482-F543 HydrophobicContact SD-CE1 4.02Å; R490-F543 CarbonylContact O-C 3.58Å; R490-F543 WeakPolarHBondContact O-CA 3.46Å; A492-F543 HydrophobicContact CB-CD1 3.7Å; A492-F543 HydrophobicContact CB-CE1 3.75Å; A492-F543 HydrophobicContact CB-CG 4.08Å; A492-F543 HydrophobicContact CB-CZ 4.19Å; P532-F543 HydrophobicContact CB-CD2 3.6Å; P532-F543 HydrophobicContact CB-CE2 3.49Å; P532-F543 VanDerWaalsContact CB-CE2 3.49Å; P532-F543 HydrophobicContact CB-CG 4.5Å; P532-F543 HydrophobicContact CB-CZ 4.32Å; P534-F543 CarbonylContact C-O 3.58Å; P534-F543 WeakPolarHBondContact CA-O 3.41Å; V535-F543 WeakPolarHBondContact CG2-O 3.45Å; V535-F543 PolarHBondContact N-O 3.19Å; S541-F543 PolarHBondContact OG-N 2.86Å; F543-E545 VanDerWaalsContact C-N 3.35Å; F543-V546 HydrophobicContact CB-CG2 4.1Å
544	D	93.2	Very high	90.2	Very high	71 Å²	71	57 Å²	57	38%	0.38	33%	0.331	S	S	.	.	S	Bend	trans	-79	-27.7	177.4	-50.7	-57.6	0	0	0	110.3	R490	R490-D544 VanDerWaalsContact CB-OD2 3.28Å; R490-D544 WeakPolarHBondContact CB-OD2 3.48Å; R490-D544 IonicContact CZ-OD1 3.58Å; R490-D544 IonicContact CZ-OD2 3.87Å; R490-D544 PolarHBondContact N-OD2 3.35Å; R490-D544 IonicContact NE-OD1 2.69Å; R490-D544 IonicContact NE-OD2 2.68Å; R490-D544 PolarHBondContact NE-OD2 2.81Å; R490-D544 IonicContact NH2-OD1 3.35Å; R490-D544 PolarHBondContact NH2-OD1 2.76Å; R490-D544 IonicContact NH2-OD2 3.72Å; R490-D544 PolarHBondContact O-N 3.12Å
545	E	93.7	Very high	90.1	Very high	77 Å²	77	60.9 Å²	60.9	36%	0.36	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	145	-179.6	-171.2	178.9	-168.9	0	0	110.7	R490 K491 A492 F543 I547	R490-E545 PolarHBondContact O-N 3.43Å; K491-E545 WeakPolarHBondContact CA-O 3.31Å; K491-E545 WeakPolarHBondContact CD-OE2 3.41Å; K491-E545 WeakPolarHBondContact CE-OE2 3.25Å; K491-E545 HydrophobicContact CG-CB 4.25Å; K491-E545 IonicContact NZ-OE2 3.72Å; K491-E545 PolarHBondContact NZ-OE2 3.4Å; A492-E545 PolarHBondContact N-O 3.12Å; F543-E545 VanDerWaalsContact C-N 3.35Å; E545-I547 HydrophobicContact CG-CD1 4.34Å; E545-I547 HydrophobicContact CG-CG1 4.06Å
546	V	94.7	Very high	90.2	Very high	29 Å²	29	58.3 Å²	58.3	18%	0.176	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	123.3	173.3	-177	0	0	0	0	108.9	A492 V494 P532 P534 F543 F548	A492-V546 HydrophobicContact CB-CG1 4.29Å; A492-V546 HydrophobicContact CB-CG2 4.24Å; A492-V546 WeakPolarHBondContact O-CA 3.4Å; V494-V546 HydrophobicContact CG2-CG1 3.76Å; P532-V546 HydrophobicContact CB-CG2 4.37Å; P532-V546 HydrophobicContact CG-CG1 4.03Å; P532-V546 HydrophobicContact CG-CG2 4.46Å; P534-V546 HydrophobicContact CB-CG2 4.31Å; F543-V546 HydrophobicContact CB-CG2 4.1Å; V546-F548 HydrophobicContact CG1-CD2 4.37Å; V546-F548 HydrophobicContact CG1-CE2 3.73Å; V546-F548 HydrophobicContact CG1-CZ 4.41Å
547	I	94.3	Very high	90.3	Very high	61 Å²	61	56.9 Å²	56.9	31%	0.313	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.2	-176	-54.9	167.2	0	0	0	109	A492 I493 V494 E545	A492-I547 PolarHBondContact O-N 2.63Å; I493-I547 WeakPolarHBondContact CA-O 3.39Å; I493-I547 HydrophobicContact CD1-CB 3.88Å; I493-I547 HydrophobicContact CD1-CD1 3.89Å; I493-I547 HydrophobicContact CD1-CG1 4.33Å; V494-I547 PolarHBondContact N-O 3.48Å; E545-I547 HydrophobicContact CG-CD1 4.34Å; E545-I547 HydrophobicContact CG-CG1 4.06Å
548	F	93.5	Very high	90.5	Very high	40 Å²	40	56.6 Å²	56.6	18%	0.175	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.9	175.2	-68.3	-109.7	0	0	0	108.3	V494 I531 V546 L553 A556	V494-F548 HydrophobicContact CB-CD1 3.89Å; V494-F548 HydrophobicContact CB-CE1 3.87Å; V494-F548 HydrophobicContact CB-CG 4.24Å; V494-F548 HydrophobicContact CB-CZ 4.21Å; V494-F548 HydrophobicContact CG1-CD1 3.84Å; V494-F548 HydrophobicContact CG1-CE1 3.58Å; V494-F548 HydrophobicContact CG1-CZ 4.21Å; V494-F548 HydrophobicContact CG2-CE1 4.4Å; V494-F548 HydrophobicContact CG2-CE2 4.49Å; V494-F548 HydrophobicContact CG2-CZ 4.26Å; I531-F548 HydrophobicContact CG2-CE1 4.15Å; I531-F548 HydrophobicContact CG2-CZ 3.65Å; V546-F548 HydrophobicContact CG1-CD2 4.37Å; V546-F548 HydrophobicContact CG1-CE2 3.73Å; V546-F548 HydrophobicContact CG1-CZ 4.41Å; F548-L553 HydrophobicContact CD1-CB 4.36Å; F548-L553 HydrophobicContact CD2-CB 3.92Å; F548-L553 HydrophobicContact CD2-CD1 4.48Å; F548-L553 HydrophobicContact CE1-CB 4.2Å; F548-L553 HydrophobicContact CE2-CB 3.78Å; F548-L553 HydrophobicContact CE2-CD1 3.76Å; F548-L553 HydrophobicContact CE2-CG 4.08Å; F548-L553 HydrophobicContact CG-CB 4.23Å; F548-L553 HydrophobicContact CZ-CB 3.91Å; F548-L553 HydrophobicContact CZ-CD1 4.14Å; F548-L553 HydrophobicContact CZ-CG 4.08Å; F548-A556 HydrophobicContact CD1-CB 3.93Å; F548-A556 HydrophobicContact CE1-CB 3.85Å
549	T	89.5	Confident	90.7	Very high	49 Å²	49	55 Å²	55	30%	0.301	31%	0.311	S	S	.	.	S	Bend	trans	-110.4	-16	-167.4	58.9	0	0	0	0	115.2	F401 I493	F401-T549 HydrophobicContact CD2-CG2 4.11Å; F401-T549 HydrophobicContact CE2-CG2 3.56Å; F401-T549 HydrophobicContact CZ-CG2 3.99Å; I493-T549 HydrophobicContact CG2-CG2 3.43Å; I493-T549 VanDerWaalsContact CG2-CG2 3.43Å
550	E	87.2	Confident	91	Very high	81 Å²	81	49.7 Å²	49.7	38%	0.379	28%	0.276	S	S	.	.	S	Bend	trans	-129.6	-81.8	-175.7	-68	-176.4	-132.8	0	0	109.9	I495 P497 R505	I495-E550 WeakPolarHBondContact CG2-OE1 3.47Å; P497-E550 WeakPolarHBondContact CB-OE2 3.49Å; R505-E550 IonicContact CZ-OE1 3.52Å; R505-E550 IonicContact CZ-OE2 2.68Å; R505-E550 VanDerWaalsContact CZ-OE2 3.26Å; R505-E550 IonicContact NH1-OE1 3.62Å; R505-E550 PolarHBondContact NH1-OE1 2.94Å; R505-E550 IonicContact NH1-OE2 3.05Å; R505-E550 PolarHBondContact NH1-OE2 3.07Å; R505-E550 IonicContact NH2-OE1 3.55Å; R505-E550 PolarHBondContact NH2-OE1 3.37Å; R505-E550 IonicContact NH2-OE2 2.71Å; R505-E550 PolarHBondContact NH2-OE2 2.85Å
551	L	88.5	Confident	91.4	Very high	35 Å²	35	49.5 Å²	49.5	18%	0.183	27%	0.272	C	S	.	.	S	Bend	trans	-78.3	140.5	168.6	-71.1	177.8	0	0	0	111.8	V496 T498 D555 A556 L559	V496-L551 HydrophobicContact CG1-CD1 4.28Å; V496-L551 WeakPolarHBondContact O-CB 3.48Å; V496-L551 WeakPolarHBondContact O-CG 3.39Å; V496-L551 PolarHBondContact O-N 2.89Å; T498-L551 HydrophobicContact CG2-CD1 4.41Å; T498-L551 HydrophobicContact CG2-CD2 4.03Å; T498-L551 HydrophobicContact CG2-CG 4.45Å; L551-D555 HydrophobicContact CB-CB 4.3Å; L551-D555 HydrophobicContact CD2-CB 4.27Å; L551-A556 HydrophobicContact CB-CB 4.32Å; L551-L559 HydrophobicContact CD1-CD1 3.8Å
552	G	87.9	Confident	91.5	Very high	36 Å²	36	53.7 Å²	53.7	37%	0.371	29%	0.289	S	S	.	.			trans	-63.3	161.6	174.6	0	0	0	0	0	112.6	D554 D555 A556	G552-D554 PolarHBondContact O-N 2.78Å; G552-D554 VanDerWaalsContact O-N 3.14Å; G552-D555 PolarHBondContact O-N 3.14Å; G552-A556 WeakPolarHBondContact O-CB 3.16Å; G552-A556 PolarHBondContact O-N 3Å
553	L	89.5	Confident	91.5	Very high	60 Å²	60	53.7 Å²	53.7	31%	0.314	29%	0.288	S	S	.	.	H	α-helix	trans	-57.7	-30.6	-172.4	159.6	152.9	0	0	0	113.9	F548 K557	F548-L553 HydrophobicContact CD1-CB 4.36Å; F548-L553 HydrophobicContact CD2-CB 3.92Å; F548-L553 HydrophobicContact CD2-CD1 4.48Å; F548-L553 HydrophobicContact CE1-CB 4.2Å; F548-L553 HydrophobicContact CE2-CB 3.78Å; F548-L553 HydrophobicContact CE2-CD1 3.76Å; F548-L553 HydrophobicContact CE2-CG 4.08Å; F548-L553 HydrophobicContact CG-CB 4.23Å; F548-L553 HydrophobicContact CZ-CB 3.91Å; F548-L553 HydrophobicContact CZ-CD1 4.14Å; F548-L553 HydrophobicContact CZ-CG 4.08Å; L553-K557 VanDerWaalsContact CD2-CE 3.5Å; L553-K557 WeakPolarHBondContact O-CD 3.42Å; L553-K557 WeakPolarHBondContact O-CG 3.34Å; L553-K557 PolarHBondContact O-N 2.94Å
554	D	90	Very high	91.4	Very high	100 Å²	100	55.2 Å²	55.2	54%	0.535	30%	0.296	S	S	.	.	H	α-helix	trans	-85.2	-42.4	178	-67.2	-54.1	0	0	0	113.3	G552 A556 K557 V558	G552-D554 PolarHBondContact O-N 2.78Å; G552-D554 VanDerWaalsContact O-N 3.14Å; D554-A556 VanDerWaalsContact C-N 3.31Å; D554-A556 PolarHBondContact O-N 3.1Å; D554-K557 WeakPolarHBondContact O-CB 3.16Å; D554-K557 PolarHBondContact O-N 3.04Å; D554-K557 VanDerWaalsContact O-N 3.14Å; D554-K557 IonicContact OD1-NZ 2.7Å; D554-K557 PolarHBondContact OD1-NZ 2.85Å; D554-V558 WeakPolarHBondContact O-CG2 3.29Å; D554-V558 PolarHBondContact O-N 3.29Å
555	D	91.1	Very high	91.3	Very high	101 Å²	101	57.8 Å²	57.8	54%	0.54	31%	0.306	S	S	.	.	H	α-helix	trans	-60.3	-43.2	172.6	-57.2	-48.8	0	0	0	111.2	L551 G552 K557 V558 L559	L551-D555 HydrophobicContact CB-CB 4.3Å; L551-D555 HydrophobicContact CD2-CB 4.27Å; G552-D555 PolarHBondContact O-N 3.14Å; D555-K557 VanDerWaalsContact C-N 3.34Å; D555-K557 PolarHBondContact O-N 2.82Å; D555-V558 PolarHBondContact O-N 2.98Å; D555-L559 WeakPolarHBondContact O-CB 3.45Å; D555-L559 PolarHBondContact O-N 2.81Å
556	A	92	Very high	91	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-37.6	175.4	0	0	0	0	0	112	V496 F548 L551 G552 D554 V560	V496-A556 HydrophobicContact CB-CB 4.21Å; V496-A556 HydrophobicContact CG1-CB 4.36Å; V496-A556 HydrophobicContact CG2-CB 4.36Å; F548-A556 HydrophobicContact CD1-CB 3.93Å; F548-A556 HydrophobicContact CE1-CB 3.85Å; L551-A556 HydrophobicContact CB-CB 4.32Å; G552-A556 WeakPolarHBondContact O-CB 3.16Å; G552-A556 PolarHBondContact O-N 3Å; D554-A556 VanDerWaalsContact C-N 3.31Å; D554-A556 PolarHBondContact O-N 3.1Å; A556-V560 WeakPolarHBondContact O-CB 3.41Å; A556-V560 WeakPolarHBondContact O-CG2 3.25Å; A556-V560 PolarHBondContact O-N 2.85Å
557	K	91.8	Very high	90.7	Very high	79 Å²	79	56.1 Å²	56.1	34%	0.343	30%	0.297	S	S	.	.	H	α-helix	trans	-63	-44.1	172	-76.7	165	-161.8	165.2	0	111.7	I531 L553 D554 D555 T561	I531-K557 HydrophobicContact CD1-CG 4.07Å; L553-K557 VanDerWaalsContact CD2-CE 3.5Å; L553-K557 WeakPolarHBondContact O-CD 3.42Å; L553-K557 WeakPolarHBondContact O-CG 3.34Å; L553-K557 PolarHBondContact O-N 2.94Å; D554-K557 WeakPolarHBondContact O-CB 3.16Å; D554-K557 PolarHBondContact O-N 3.04Å; D554-K557 VanDerWaalsContact O-N 3.14Å; D554-K557 IonicContact OD1-NZ 2.7Å; D554-K557 PolarHBondContact OD1-NZ 2.85Å; D555-K557 VanDerWaalsContact C-N 3.34Å; D555-K557 PolarHBondContact O-N 2.82Å; K557-T561 VanDerWaalsContact O-CB 3.28Å; K557-T561 WeakPolarHBondContact O-CB 3.32Å; K557-T561 PolarHBondContact O-N 3.33Å; K557-T561 PolarHBondContact O-OG1 2.8Å
558	V	92.5	Very high	90.3	Very high	86 Å²	86	58.3 Å²	58.3	52%	0.521	31%	0.306	S	S	.	.	H	α-helix	trans	-62.9	-51.7	-179.3	173.1	0	0	0	0	110.1	D554 D555 T561 Q562	D554-V558 WeakPolarHBondContact O-CG2 3.29Å; D554-V558 PolarHBondContact O-N 3.29Å; D555-V558 PolarHBondContact O-N 2.98Å; V558-T561 WeakPolarHBondContact O-CB 3.41Å; V558-T561 PolarHBondContact O-N 3.09Å; V558-T561 VanDerWaalsContact O-N 3.13Å; V558-Q562 WeakPolarHBondContact O-CG 3.26Å; V558-Q562 PolarHBondContact O-N 3.14Å
559	L	91	Very high	89.9	Confident	21 Å²	21	59.9 Å²	59.9	11%	0.11	33%	0.326	C	S	.	.	H	α-helix	trans	-65.7	-41.6	-179.3	-177.4	157.9	0	0	0	111.9	V496 L551 D555 T561 Q562 Y563	V496-L559 HydrophobicContact CG1-CD2 3.67Å; L551-L559 HydrophobicContact CD1-CD1 3.8Å; D555-L559 WeakPolarHBondContact O-CB 3.45Å; D555-L559 PolarHBondContact O-N 2.81Å; L559-T561 VanDerWaalsContact C-N 3.29Å; L559-T561 PolarHBondContact O-N 2.89Å; L559-Q562 WeakPolarHBondContact O-CB 3.49Å; L559-Q562 PolarHBondContact O-N 2.94Å; L559-Y563 HydrophobicContact CD2-CD1 4.42Å; L559-Y563 HydrophobicContact CD2-CD2 3.72Å; L559-Y563 HydrophobicContact CD2-CE1 4.01Å; L559-Y563 HydrophobicContact CD2-CE2 3.24Å; L559-Y563 HydrophobicContact CD2-CG 4.29Å; L559-Y563 HydrophobicContact CG-CE2 4.49Å; L559-Y563 PolarHBondContact O-N 2.83Å
560	V	91.5	Very high	89.6	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-67.3	-28.7	173.3	171.1	0	0	0	0	111.9	V496 F529 I531 A556 N564	V496-V560 HydrophobicContact CG1-CG2 4.37Å; V496-V560 HydrophobicContact CG2-CG2 4.15Å; F529-V560 HydrophobicContact CB-CG1 3.95Å; F529-V560 HydrophobicContact CD1-CG1 4.03Å; F529-V560 HydrophobicContact CD1-CG2 4.45Å; F529-V560 HydrophobicContact CD2-CG1 4.32Å; F529-V560 HydrophobicContact CD2-CG2 4.06Å; F529-V560 HydrophobicContact CE1-CG2 4.35Å; F529-V560 HydrophobicContact CE2-CG2 3.95Å; F529-V560 HydrophobicContact CG-CG1 3.85Å; F529-V560 HydrophobicContact CG-CG2 4.31Å; F529-V560 HydrophobicContact CZ-CG2 4.1Å; F529-V560 VanDerWaalsContact O-CG1 3.32Å; F529-V560 WeakPolarHBondContact O-CG1 3.32Å; I531-V560 HydrophobicContact CD1-CB 4.02Å; I531-V560 HydrophobicContact CD1-CG1 4.23Å; I531-V560 HydrophobicContact CD1-CG2 4.12Å; I531-V560 HydrophobicContact CG1-CB 4.38Å; I531-V560 HydrophobicContact CG1-CG1 4.11Å; I531-V560 HydrophobicContact CG1-CG2 4.35Å; A556-V560 WeakPolarHBondContact O-CB 3.41Å; A556-V560 WeakPolarHBondContact O-CG2 3.25Å; A556-V560 PolarHBondContact O-N 2.85Å; V560-N564 VanDerWaalsContact CG1-ND2 3.34Å; V560-N564 WeakPolarHBondContact CG1-ND2 3.44Å; V560-N564 WeakPolarHBondContact O-CB 3.19Å; V560-N564 PolarHBondContact O-N 3.39Å; V560-N564 PolarHBondContact O-ND2 3.5Å
561	T	92.2	Very high	88.8	Confident	73 Å²	73	64 Å²	64	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-67.9	-41.5	171.7	-61.3	0	0	0	0	111.1	K557 V558 L559 N564 Q565	K557-T561 VanDerWaalsContact O-CB 3.28Å; K557-T561 WeakPolarHBondContact O-CB 3.32Å; K557-T561 PolarHBondContact O-N 3.33Å; K557-T561 PolarHBondContact O-OG1 2.8Å; V558-T561 WeakPolarHBondContact O-CB 3.41Å; V558-T561 PolarHBondContact O-N 3.09Å; V558-T561 VanDerWaalsContact O-N 3.13Å; L559-T561 VanDerWaalsContact C-N 3.29Å; L559-T561 PolarHBondContact O-N 2.89Å; T561-N564 PolarHBondContact O-N 3Å; T561-Q565 WeakPolarHBondContact O-CG 3.37Å; T561-Q565 PolarHBondContact O-N 3.45Å
562	Q	91.4	Very high	87.8	Confident	113 Å²	113	69.9 Å²	69.9	53%	0.528	37%	0.367	S	S	.	.	H	α-helix	trans	-61.2	-48.7	173.4	-66.8	170.2	1.4	0	0	111.3	V558 L559 N564 Q565 E566	V558-Q562 WeakPolarHBondContact O-CG 3.26Å; V558-Q562 PolarHBondContact O-N 3.14Å; L559-Q562 WeakPolarHBondContact O-CB 3.49Å; L559-Q562 PolarHBondContact O-N 2.94Å; Q562-N564 VanDerWaalsContact C-N 3.32Å; Q562-N564 PolarHBondContact O-N 2.78Å; Q562-Q565 WeakPolarHBondContact O-CB 3.38Å; Q562-Q565 PolarHBondContact O-N 2.8Å; Q562-Q565 VanDerWaalsContact O-N 3.08Å; Q562-E566 WeakPolarHBondContact O-CB 3.41Å; Q562-E566 PolarHBondContact O-N 2.99Å
563	Y	91.9	Very high	86.5	Confident	10 Å²	10	73.7 Å²	73.7	4%	0.039	39%	0.385	C	S	.	.	H	α-helix	trans	-58.3	-39.8	174	-74.1	-9.3	0	0	0	113.1	L393 D499 K526 L559 Q565 G567	L393-Y563 HydrophobicContact CD1-CD2 3.74Å; L393-Y563 HydrophobicContact CD1-CE2 3.47Å; L393-Y563 VanDerWaalsContact CD1-CE2 3.47Å; D499-Y563 WeakPolarHBondContact OD1-CE1 3.24Å; D499-Y563 PolarHBondContact OD1-OH 3.19Å; K526-Y563 CarbonylContact C-O 3.5Å; K526-Y563 HydrophobicContact CD-CD1 3.83Å; K526-Y563 HydrophobicContact CD-CD2 4.44Å; K526-Y563 HydrophobicContact CD-CE1 4.41Å; K526-Y563 HydrophobicContact CD-CG 3.86Å; K526-Y563 VanDerWaalsContact CE-CD1 3.47Å; K526-Y563 HydrophobicContact CG-CD1 4.39Å; K526-Y563 HydrophobicContact CG-CD2 4.13Å; K526-Y563 HydrophobicContact CG-CG 3.9Å; L559-Y563 HydrophobicContact CD2-CD1 4.42Å; L559-Y563 HydrophobicContact CD2-CD2 3.72Å; L559-Y563 HydrophobicContact CD2-CE1 4.01Å; L559-Y563 HydrophobicContact CD2-CE2 3.24Å; L559-Y563 HydrophobicContact CD2-CG 4.29Å; L559-Y563 HydrophobicContact CG-CE2 4.49Å; L559-Y563 PolarHBondContact O-N 2.83Å; Y563-Q565 VanDerWaalsContact C-N 3.31Å; Y563-Q565 PolarHBondContact O-N 3.48Å; Y563-G567 PolarHBondContact O-N 3.26Å
564	N	91.4	Very high	85.1	Confident	33 Å²	33	76.7 Å²	76.7	18%	0.176	41%	0.407	C	S	.	.	H	α-helix	trans	-64.9	-35.7	176	-88.1	-76	0	0	0	111.7	K526 A527 F529 V560 T561 Q562 Q568	K526-N564 WeakPolarHBondContact O-CA 3.45Å; K526-N564 PolarHBondContact O-OD1 3.47Å; A527-N564 VanDerWaalsContact C-OD1 3.31Å; A527-N564 PolarHBondContact O-OD1 2.87Å; F529-N564 PolarHBondContact N-OD1 3.02Å; F529-N564 PolarHBondContact O-ND2 2.89Å; V560-N564 VanDerWaalsContact CG1-ND2 3.34Å; V560-N564 WeakPolarHBondContact CG1-ND2 3.44Å; V560-N564 WeakPolarHBondContact O-CB 3.19Å; V560-N564 PolarHBondContact O-N 3.39Å; V560-N564 PolarHBondContact O-ND2 3.5Å; T561-N564 PolarHBondContact O-N 3Å; Q562-N564 VanDerWaalsContact C-N 3.32Å; Q562-N564 PolarHBondContact O-N 2.78Å; N564-Q568 WeakPolarHBondContact O-CB 3.46Å; N564-Q568 WeakPolarHBondContact O-CG 3.35Å; N564-Q568 PolarHBondContact O-N 2.83Å; N564-Q568 PolarHBondContact O-NE2 3.28Å; N564-Q568 VanDerWaalsContact O-NE2 3.11Å
565	Q	91.1	Very high	83.5	Confident	125 Å²	125	80.1 Å²	80.1	58%	0.584	42%	0.42	S	S	*	.	H	α-helix	trans	-71.4	-50.7	175.5	-69.7	173	14.1	0	0	111.9	T561 Q562 Y563 G567 Q568 A569	T561-Q565 WeakPolarHBondContact O-CG 3.37Å; T561-Q565 PolarHBondContact O-N 3.45Å; Q562-Q565 WeakPolarHBondContact O-CB 3.38Å; Q562-Q565 PolarHBondContact O-N 2.8Å; Q562-Q565 VanDerWaalsContact O-N 3.08Å; Y563-Q565 VanDerWaalsContact C-N 3.31Å; Y563-Q565 PolarHBondContact O-N 3.48Å; Q565-G567 PolarHBondContact O-N 3.34Å; Q565-Q568 PolarHBondContact O-N 2.64Å; Q565-Q568 VanDerWaalsContact O-N 3.09Å; Q565-A569 WeakPolarHBondContact O-CB 3.35Å; Q565-A569 PolarHBondContact O-N 3.44Å
566	E	89	Confident	81.3	Confident	69 Å²	69	84.6 Å²	84.6	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-52.3	-54	174.5	178.2	-156.6	150	0	0	111.2	L523 K526 Q562 Q568 A569 N570	L523-E566 HydrophobicContact CD2-CG 4.28Å; L523-E566 WeakPolarHBondContact CD2-OE1 3.33Å; K526-E566 WeakPolarHBondContact CD-OE1 3.13Å; K526-E566 WeakPolarHBondContact CD-OE2 3.42Å; K526-E566 IonicContact NZ-OE1 3.27Å; K526-E566 PolarHBondContact NZ-OE1 2.59Å; K526-E566 IonicContact NZ-OE2 2.66Å; K526-E566 PolarHBondContact NZ-OE2 2.57Å; Q562-E566 WeakPolarHBondContact O-CB 3.41Å; Q562-E566 PolarHBondContact O-N 2.99Å; E566-Q568 VanDerWaalsContact C-N 3.27Å; E566-Q568 PolarHBondContact O-N 3.25Å; E566-A569 PolarHBondContact O-N 3.24Å; E566-N570 WeakPolarHBondContact O-CB 3.45Å; E566-N570 PolarHBondContact O-N 3.16Å; E566-N570 PolarHBondContact O-ND2 3.3Å
567	G	86.5	Confident	79	Confident	2 Å²	2	95.1 Å²	95.1	2%	0.021	48%	0.475	C	S	.	.	H	α-helix	trans	-67	-24.5	178.8	0	0	0	0	0	113.4	A527 Y563 Q565 R571	A527-G567 WeakPolarHBondContact CB-O 3.23Å; Y563-G567 PolarHBondContact O-N 3.26Å; Q565-G567 PolarHBondContact O-N 3.34Å; G567-R571 WeakPolarHBondContact O-CG 3.32Å
568	Q	86.1	Confident	76.5	Confident	108 Å²	108	100 Å²	100	51%	0.505	50%	0.499	S	S	.	.	H	α-helix	trans	-78.9	-40	173	-81.8	172.7	61.5	0	0	112.7	N564 Q565 E566 R571	N564-Q568 WeakPolarHBondContact O-CB 3.46Å; N564-Q568 WeakPolarHBondContact O-CG 3.35Å; N564-Q568 PolarHBondContact O-N 2.83Å; N564-Q568 PolarHBondContact O-NE2 3.28Å; N564-Q568 VanDerWaalsContact O-NE2 3.11Å; Q565-Q568 PolarHBondContact O-N 2.64Å; Q565-Q568 VanDerWaalsContact O-N 3.09Å; E566-Q568 VanDerWaalsContact C-N 3.27Å; E566-Q568 PolarHBondContact O-N 3.25Å; Q568-R571 WeakPolarHBondContact O-CG 3.39Å; Q568-R571 PolarHBondContact O-N 2.94Å
569	A	86.4	Confident	73.6	Confident	73 Å²	73	105.6 Å²	105.6	60%	0.603	51%	0.51	S	S	*	.	H	α-helix	trans	-64.4	-40.5	175.8	0	0	0	0	0	111.6	Q565 E566 R571	Q565-A569 WeakPolarHBondContact O-CB 3.35Å; Q565-A569 PolarHBondContact O-N 3.44Å; E566-A569 PolarHBondContact O-N 3.24Å; A569-R571 VanDerWaalsContact C-N 3.28Å; A569-R571 PolarHBondContact O-N 3.36Å
570	N	82	Confident	71	Confident	97 Å²	97	115.3 Å²	115.3	52%	0.519	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	11.4	179	-67	-27.2	0	0	0	114.1	L523 E566 Q572	L523-N570 HydrophobicContact CD1-CB 4.13Å; L523-N570 HydrophobicContact CD2-CB 4.16Å; E566-N570 WeakPolarHBondContact O-CB 3.45Å; E566-N570 PolarHBondContact O-N 3.16Å; E566-N570 PolarHBondContact O-ND2 3.3Å; N570-Q572 PolarHBondContact O-N 3.43Å
571	R	71.7	Confident	68.4	Low	119 Å²	119	121.3 Å²	121.3	45%	0.449	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-67.2	118.7	172.1	-68.1	-175.2	-179.8	-155.7	-2.6	109.5	A527 N528 G567 Q568 A569	A527-R571 PolarHBondContact O-NH2 3.39Å; N528-R571 VanDerWaalsContact CG-NH2 3.33Å; N528-R571 PolarHBondContact ND2-NH2 3.26Å; N528-R571 PolarHBondContact OD1-NH2 3.08Å; G567-R571 WeakPolarHBondContact O-CG 3.32Å; Q568-R571 WeakPolarHBondContact O-CG 3.39Å; Q568-R571 PolarHBondContact O-N 2.94Å; A569-R571 VanDerWaalsContact C-N 3.28Å; A569-R571 PolarHBondContact O-N 3.36Å
572	Q	67.9	Low	65.8	Low	159 Å²	159	120.3 Å²	120.3	74%	0.743	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-50.5	133.5	158.4	-65.1	-176.8	0.2	0	0	108.3	N570	N570-Q572 PolarHBondContact O-N 3.43Å
573	P	60.1	Low	63	Low	116 Å²	116	117.8 Å²	117.8	75%	0.753	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-51.5	128.3	177.3	-26.2	34.2	0	0	0	108.5	E575	P573-E575 PolarHBondContact O-N 2.98Å
574	P	60.4	Low	60.5	Low	122 Å²	122	123.8 Å²	123.8	79%	0.792	62%	0.619	S	S	*	*			trans	-55.9	115.8	-170.8	21.9	-33.1	0	0	0	107.9	K576	P574-K576 PolarHBondContact O-N 3.44Å; P574-K576 VanDerWaalsContact O-N 3.13Å
575	E	55.8	Low	57.9	Low	172 Å²	172	132.7 Å²	132.7	80%	0.804	65%	0.65	S	S	*	*			trans	-47.4	128.2	-177.2	-176	-172.1	-142.8	0	0	107	P573 R577	P573-E575 PolarHBondContact O-N 2.98Å; E575-R577 PolarHBondContact O-N 2.81Å
576	K	45.5	Very low	55.4	Low	195 Å²	195	134.4 Å²	134.4	85%	0.848	66%	0.663	S	S	*	*			trans	-66.9	82.2	175.2	-76.8	-177.8	-179.9	173.3	0	107	P574 Q578	P574-K576 PolarHBondContact O-N 3.44Å; P574-K576 VanDerWaalsContact O-N 3.13Å; K576-Q578 PolarHBondContact O-N 3.28Å
577	R	43.5	Very low	53	Low	221 Å²	221	140.2 Å²	140.2	83%	0.834	68%	0.682	S	S	*	*			trans	-38.5	119.8	159.6	-74.4	-172.4	177	-160	-2.4	104.4	E575 R579	E575-R577 PolarHBondContact O-N 2.81Å; R577-R579 PolarHBondContact O-N 2.94Å
578	Q	38.3	Very low	50.6	Low	181 Å²	181	146.2 Å²	146.2	85%	0.846	71%	0.714	S	S	*	*			trans	-56.1	104.7	171	-68.2	-174.7	9.7	0	0	105.1	K576 W580	K576-Q578 PolarHBondContact O-N 3.28Å; Q578-W580 VanDerWaalsContact C-N 3.28Å; Q578-W580 PolarHBondContact O-N 3.37Å
579	R	33.2	Very low	48.4	Very low	204 Å²	204	148.6 Å²	148.6	77%	0.77	73%	0.73	S	S	*	*			trans	-54.8	115.6	151	-80.7	-171.1	176	-172.8	1.8	102.2	R577 D581	R577-R579 PolarHBondContact O-N 2.94Å; R579-D581 HydrophobicContact CB-CB 4.22Å; R579-D581 PolarHBondContact O-N 3.49Å
580	W	35.6	Very low	46.1	Very low	226 Å²	226	149.4 Å²	149.4	86%	0.856	73%	0.731	S	S	*	*			trans	-61.8	71	147.7	-129.3	53.8	0	0	0	105.4	Q578 G582	Q578-W580 VanDerWaalsContact C-N 3.28Å; Q578-W580 PolarHBondContact O-N 3.37Å; W580-G582 VanDerWaalsContact O-CA 3.31Å; W580-G582 WeakPolarHBondContact O-CA 3.49Å; W580-G582 PolarHBondContact O-N 2.8Å; W580-G582 VanDerWaalsContact O-N 3.11Å
581	D	37.4	Very low	44	Very low	130 Å²	130	154.7 Å²	154.7	70%	0.695	74%	0.744	S	S	*	*			trans	-62.5	115.6	176.6	-125.6	-15.3	0	0	0	103.5	R579	R579-D581 HydrophobicContact CB-CB 4.22Å; R579-D581 PolarHBondContact O-N 3.49Å
582	G	36.5	Very low	42.3	Very low	51 Å²	51	156.3 Å²	156.3	53%	0.526	76%	0.762	S	S	.	*			trans	-53.7	143.7	-135.2	0	0	0	0	0	112.6	W580 N584	W580-G582 VanDerWaalsContact O-CA 3.31Å; W580-G582 WeakPolarHBondContact O-CA 3.49Å; W580-G582 PolarHBondContact O-N 2.8Å; W580-G582 VanDerWaalsContact O-N 3.11Å; G582-N584 WeakPolarHBondContact O-CB 3.42Å; G582-N584 PolarHBondContact O-N 2.75Å
583	G	33.3	Very low	40.7	Very low	60 Å²	60	153.4 Å²	153.4	62%	0.619	76%	0.759	S	S	*	*			trans	-53.3	85.5	171.1	0	0	0	0	0	110.6	R585	G583-R585 PolarHBondContact O-N 3Å; G583-R585 VanDerWaalsContact O-N 3.09Å
584	N	39.7	Very low	39.5	Very low	137 Å²	137	157.9 Å²	157.9	73%	0.733	76%	0.761	S	S	*	*			trans	-93	53.6	-175.9	-163.9	77.6	0	0	0	108.1	G582	G582-N584 WeakPolarHBondContact O-CB 3.42Å; G582-N584 PolarHBondContact O-N 2.75Å
585	R	36.8	Very low	38.3	Very low	219 Å²	219	161.1 Å²	161.1	83%	0.826	76%	0.762	S	S	*	*	S	Bend	trans	-136.1	150.8	172.8	-60.6	-176.5	-178.4	178.4	-0.3	103.8	G583	G583-R585 PolarHBondContact O-N 3Å; G583-R585 VanDerWaalsContact O-N 3.09Å
586	D	38.7	Very low	37.4	Very low	161 Å²	161	164.3 Å²	164.3	86%	0.861	77%	0.767	S	S	*	*	S	Bend	trans	68.3	29.2	-175.8	-44.1	-23.1	0	0	0	116.6
587	R	37.5	Very low	36.7	Very low	191 Å²	191	159.1 Å²	159.1	72%	0.721	77%	0.769	S	S	*	*	S	Bend	trans	-141.5	-2.5	167.3	-126	178.3	-159.2	170.7	13.5	121.2
588	D	37.1	Very low	36.1	Very low	128 Å²	128	158.6 Å²	158.6	68%	0.684	77%	0.767	S	S	*	*	S	Bend	trans	-83.6	-33	170.2	-76.1	-54.8	0	0	0	112.4	S590	D588-S590 PolarHBondContact O-N 3.4Å
589	D	38.2	Very low	35.7	Very low	158 Å²	158	156 Å²	156	85%	0.845	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	30.3	-175.3	-67.6	-65.6	0	0	0	116.6
590	S	39.7	Very low	36	Very low	90 Å²	90	151.5 Å²	151.5	63%	0.629	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.6	9.2	179.3	-83.5	0	0	0	0	116.3	D588	D588-S590 PolarHBondContact O-N 3.4Å
591	R	36.6	Very low	35.7	Very low	208 Å²	208	151.8 Å²	151.8	79%	0.785	76%	0.76	S	S	*	*	S	Bend	trans	-126.2	-4	178.9	-71.5	-172.9	171.9	179	-1.5	116.4
592	N	35.5	Very low	35.5	Very low	154 Å²	154	151 Å²	151	82%	0.824	76%	0.756	S	S	*	*	S	Bend	trans	-88.3	-8.7	171.9	-151.7	19.3	0	0	0	113.7	R594	N592-R594 PolarHBondContact O-N 2.75Å
593	S	35.7	Very low	35.4	Very low	98 Å²	98	159.6 Å²	159.6	69%	0.685	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	9.5	-169.8	56.9	0	0	0	0	116.5
594	R	34.7	Very low	35.3	Very low	209 Å²	209	160.9 Å²	160.9	79%	0.789	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.6	-2	-168.6	-63.9	-166.2	-176.1	-164.3	0.6	117.7	N592	N592-R594 PolarHBondContact O-N 2.75Å
595	F	34.9	Very low	34.9	Very low	190 Å²	190	165.2 Å²	165.2	83%	0.833	79%	0.791	S	S	*	*	S	Bend	trans	-144.5	130.7	173.1	-80	-78.7	0	0	0	112.4
596	R	36.4	Very low	35	Very low	240 Å²	240	162 Å²	162	91%	0.906	79%	0.79	S	S	*	*			trans	80	36.7	179	-57.4	-173	167.9	-119.9	-11	117.9	R598	R596-R598 PolarHBondContact O-N 2.83Å
597	G	30.6	Very low	34.9	Very low	86 Å²	86	162.7 Å²	162.7	89%	0.887	79%	0.791	S	S	*	*			trans	-72	74.2	142.6	0	0	0	0	0	110.7
598	R	31.3	Very low	35.1	Very low	209 Å²	209	158.1 Å²	158.1	79%	0.789	79%	0.786	S	S	*	*			trans	-164.8	150.8	168.8	-126.1	-167	-168.3	-162.7	3.6	113	R596	R596-R598 PolarHBondContact O-N 2.83Å
599	D	31	Very low	34.8	Very low	127 Å²	127	163.8 Å²	163.8	68%	0.679	80%	0.798	S	S	*	*			trans	70.8	65.7	156.5	-48	-33.3	0	0	0	118.9
600	S	37.9	Very low	34.5	Very low	109 Å²	109	159.5 Å²	159.5	76%	0.762	79%	0.79	S	S	*	*				171.3	123	126.8	-75.7	0	0	0	0	108.9
601	R	30	Very low	34.1	Very low	232 Å²	232	166.1 Å²	166.1	88%	0.875	80%	0.801	S	S	*	*				55.9	108.3	63.6	-61	-176.1	-175.1	178	0.6	109.4
602	D	34	Very low	34	Very low	115 Å²	115	166.8 Å²	166.8	62%	0.615	80%	0.804	S	S	*	*			cis	-155.8	166.4	39.8	-112.1	-103	0	0	0	112.2
603	R	33.9	Very low	34	Very low	231 Å²	231	163.1 Å²	163.1	87%	0.872	78%	0.784	S	S	*	*			trans	49.1	100.9	151.1	-64.2	162.6	-146.2	-155.8	0.8	119
604	G	30.1	Very low	33.8	Very low	86 Å²	86	164.8 Å²	164.8	89%	0.887	79%	0.786	S	S	*	*			trans	-143.6	28	163.8	0	0	0	0	0	113.3
605	R	32.8	Very low	33.7	Very low	228 Å²	228	162.8 Å²	162.8	86%	0.86	78%	0.783	S	S	*	*			trans	-89.7	160	163.2	-95	-168.3	-177.6	179	1.6	109.1
606	D	38.2	Very low	33.6	Very low	151 Å²	151	163.7 Å²	163.7	81%	0.807	78%	0.781	S	S	*	*			trans	85	95	166.9	-47.5	-32.9	0	0	0	116.8
607	M	37.7	Very low	33.4	Very low	177 Å²	177	157.5 Å²	157.5	87%	0.872	78%	0.775	S	S	*	*			trans	-35.6	171.6	142.3	-72.2	-83.1	-166.7	0	0	114.8
608	P	41	Very low	33.7	Very low	95 Å²	95	158.8 Å²	158.8	62%	0.617	77%	0.77	S	S	*	*			cis	-137.5	-171.4	-5.3	26	-1	0	0	0	114.7
609	R	31.2	Very low	34.1	Very low	247 Å²	247	153.7 Å²	153.7	93%	0.932	76%	0.764	S	S	*	*			trans	52.3	120.6	143.3	-75.3	163.9	-175.5	179.2	1.5	120.4
610	G	31.3	Very low	34.3	Very low	67 Å²	67	154.6 Å²	154.6	69%	0.691	77%	0.769	S	S	*	*			trans	157.4	118.4	155.8	0	0	0	0	0	109.5
611	R	32.1	Very low	34.2	Very low	229 Å²	229	160 Å²	160	86%	0.864	77%	0.772	S	S	*	*				45.7	105.7	66.8	-64.6	-87.3	-158.7	-174.3	1.9	111
612	R	34.3	Very low	34.2	Very low	223 Å²	223	159.8 Å²	159.8	84%	0.842	77%	0.772	S	S	*	*				-157.2	122.6	83.6	-155.6	160.9	-167.4	164.6	4.1	115
613	D	34.1	Very low	34.1	Very low	76 Å²	76	161 Å²	161	41%	0.406	78%	0.778	S	S	.	*			trans	28.2	106.4	140.8	-32.8	-18.4	0	0	0	118.8
614	D	32.3	Very low	34.1	Very low	133 Å²	133	156.4 Å²	156.4	71%	0.711	77%	0.771	S	S	*	*				47.2	156.5	110.3	-55.4	-57.5	0	0	0	123.6
615	F	32.9	Very low	34.1	Very low	167 Å²	167	158.3 Å²	158.3	73%	0.732	76%	0.76	S	S	*	*			trans	91.3	125.1	148	-70.3	-58.1	0	0	0	122.5
616	R	32.2	Very low	34.2	Very low	209 Å²	209	158.2 Å²	158.2	79%	0.789	76%	0.76	S	S	*	*			trans	79.8	105.3	136.6	-70.7	167.8	-171.7	-160.1	-0.3	119.8
617	S	32.4	Very low	34.1	Very low	111 Å²	111	154 Å²	154	78%	0.776	75%	0.752	S	S	*	*				71.2	125.5	118.1	-53.8	0	0	0	0	120.9
618	S	37.4	Very low	34.1	Very low	112 Å²	112	155.8 Å²	155.8	78%	0.783	75%	0.749	S	S	*	*			trans	-23	159.8	140.2	-41.5	0	0	0	0	116.3
619	P	40.4	Very low	34	Very low	103 Å²	103	160.2 Å²	160.2	67%	0.669	75%	0.753	S	S	*	*			cis	-143.8	-175.5	21.5	43.4	-24.5	0	0	0	116.7
620	N	33.9	Very low	34	Very low	146 Å²	146	155.6 Å²	155.6	78%	0.781	75%	0.747	S	S	*	*			trans	31	92.4	144.9	-64.1	-6.7	0	0	0	119.3
621	R	35.3	Very low	34.4	Very low	222 Å²	222	161.6 Å²	161.6	84%	0.838	75%	0.75	S	S	*	*			trans	-141.9	113.1	132.7	-87.9	107.7	-157.9	-103.7	7.2	107
622	R	30.5	Very low	34.5	Very low	228 Å²	228	160.6 Å²	160.6	86%	0.86	75%	0.747	S	S	*	*				81	141.3	85	-80.7	-174	178.9	180	-0.9	112.2
623	N	32.7	Very low	34.4	Very low	141 Å²	141	153.7 Å²	153.7	75%	0.754	75%	0.745	S	S	*	*			trans	-30.8	138	147.8	-42.4	-8.5	0	0	0	110.1
624	D	32.5	Very low	34.3	Very low	133 Å²	133	153 Å²	153	71%	0.711	76%	0.756	S	S	*	*				-146.4	133.7	78.9	-75.6	-28.5	0	0	0	110
625	D	31.5	Very low	34.4	Very low	126 Å²	126	156.6 Å²	156.6	67%	0.674	76%	0.761	S	S	*	*				58.4	104.9	77.8	-177.5	22	0	0	0	113
626	R	35	Very low	34.3	Very low	227 Å²	227	155.7 Å²	155.7	86%	0.857	76%	0.764	S	S	*	*			trans	179.9	123.5	132.1	-91.5	143.6	-153.5	-159.5	6.5	111.6
627	G	35.4	Very low	34.3	Very low	61 Å²	61	149.7 Å²	149.7	63%	0.629	76%	0.759	S	S	*	*				127.9	78	122.6	0	0	0	0	0	120.5
628	R	38.3	Very low	34.1	Very low	216 Å²	216	149.4 Å²	149.4	82%	0.815	76%	0.757	S	S	*	*			trans	69.8	148.4	137.9	-58.5	179.5	-179.7	-174.7	1.5	117.9
629	R	38.2	Very low	34	Very low	188 Å²	188	155 Å²	155	71%	0.709	76%	0.761	S	S	*	*			cis	-156.4	143.8	-12.1	-123.7	175.5	-173.3	170	0	109.7
630	D	30.9	Very low	33.5	Very low	149 Å²	149	156.3 Å²	156.3	80%	0.797	76%	0.762	S	S	*	*			trans	-64.9	137.7	162.2	-39.1	-101.5	0	0	0	110.6
631	Y	39.6	Very low	33.7	Very low	193 Å²	193	160.5 Å²	160.5	76%	0.757	77%	0.767	S	S	*	*			trans	-160.7	140.1	144.5	-106.7	-86.3	0	0	0	109.3
632	R	33.9	Very low	33.4	Very low	209 Å²	209	155.1 Å²	155.1	79%	0.789	76%	0.764	S	S	*	*			cis	-175	107.1	-30.1	176.5	-178.4	-175.6	-174.3	2.3	107.7
633	G	32.3	Very low	33.6	Very low	78 Å²	78	154.8 Å²	154.8	80%	0.804	76%	0.762	S	S	*	*			trans	70.5	164.4	169	0	0	0	0	0	116.7
634	G	32.8	Very low	33.5	Very low	62 Å²	62	156 Å²	156	64%	0.639	76%	0.763	S	S	*	*			cis	168.3	174.6	-9.1	0	0	0	0	0	114.7
635	Y	34.1	Very low	33.4	Very low	207 Å²	207	153.5 Å²	153.5	81%	0.812	77%	0.769	S	S	*	*			trans	69.3	113.4	162.4	-50.7	-66.9	0	0	0	118.4
636	N	31.7	Very low	33.4	Very low	148 Å²	148	154.5 Å²	154.5	79%	0.791	78%	0.775	S	S	*	*				56	143.1	114.4	-57.7	0.6	0	0	0	120.2
637	A	31.1	Very low	33.3	Very low	83 Å²	83	154.6 Å²	154.6	69%	0.686	78%	0.775	S	S	*	*			cis	-168.2	168.5	-13.7	0	0	0	0	0	109.4
638	S	29.6	Very low	33.4	Very low	105 Å²	105	162.3 Å²	162.3	73%	0.734	79%	0.792	S	S	*	*			trans	32.5	101.7	148.8	-53.1	0	0	0	0	119.3
639	R	34.7	Very low	33.1	Very low	230 Å²	230	157.6 Å²	157.6	87%	0.868	78%	0.782	S	S	*	*			trans	-155.1	118.6	132.7	-100.5	141	-174	-163.8	1.7	106.9
640	D	30.7	Very low	32.9	Very low	131 Å²	131	158.5 Å²	158.5	70%	0.701	79%	0.786	S	S	*	*				78.9	141.7	71.3	-76.7	-46.9	0	0	0	112.6
641	R	37.1	Very low	33.1	Very low	233 Å²	233	157.6 Å²	157.6	88%	0.879	78%	0.781	S	S	*	*			trans	77.3	114.3	-179.8	-55.4	156.3	-166.2	-170.7	0.9	111.8
642	S	29.7	Very low	32.6	Very low	110 Å²	110	152.5 Å²	152.5	77%	0.769	77%	0.773	S	S	*	*				77.2	140.1	51.7	-56.1	0	0	0	0	112.5
643	R	33.9	Very low	32.5	Very low	220 Å²	220	148.8 Å²	148.8	83%	0.83	77%	0.769	S	S	*	*			trans	73.5	120.5	-166.6	-56.1	-156	146.9	139.7	-3	112.9
644	E	30.9	Very low	32.7	Very low	167 Å²	167	155.5 Å²	155.5	78%	0.78	77%	0.77	S	S	*	*				75.2	129.8	54	-64	170.9	123.2	0	0	112.7
645	G	30.9	Very low	32.5	Very low	81 Å²	81	160.3 Å²	160.3	84%	0.835	78%	0.776	S	S	*	*			trans	78.2	55.5	157.9	0	0	0	0	0	118.2
646	D	31.4	Very low	32.3	Very low	147 Å²	147	154.3 Å²	154.3	79%	0.786	77%	0.765	S	S	*	*			trans	-152.4	52.5	170	-140	-17.5	0	0	0	115
647	R	33.4	Very low	32.3	Very low	229 Å²	229	157 Å²	157	86%	0.864	77%	0.769	S	S	*	*	S	Bend	trans	-159.1	29.4	167.9	-141.1	171	-74.5	-174.6	-2.4	119
648	F	36.5	Very low	32.2	Very low	223 Å²	223	156.2 Å²	156.2	98%	0.978	77%	0.77	S	S	*	*	S	Bend	trans	-163.9	82.1	154.5	-92.4	-59.2	0	0	0	107.9
649	D	31.4	Very low	32.3	Very low	116 Å²	116	162.1 Å²	162.1	62%	0.62	78%	0.776	S	S	*	*			trans	-128.9	145.5	-175.3	-170.2	14	0	0	0	110.6
650	R	35.3	Very low	32.6	Very low	207 Å²	207	159.4 Å²	159.4	78%	0.781	77%	0.773	S	S	*	*			trans	69.2	124.9	177	-45.9	-174.3	-162	174.5	6.7	116.8
651	N	33.7	Very low	33	Very low	131 Å²	131	158.5 Å²	158.5	70%	0.701	77%	0.774	S	S	*	*			cis	-152.5	130.3	-4.5	-124.6	57.9	0	0	0	109.1
652	S	30.5	Very low	32.9	Very low	85 Å²	85	153 Å²	153	59%	0.594	77%	0.771	S	S	*	*	S	Bend	trans	-71.6	170.7	139.4	53.1	0	0	0	0	109.2
653	D	31.1	Very low	33.2	Very low	131 Å²	131	151.2 Å²	151.2	70%	0.701	77%	0.771	S	S	*	*			trans	70	148.3	160.4	-43	-51.8	0	0	0	119
654	R	35.7	Very low	33.1	Very low	219 Å²	219	150.9 Å²	150.9	83%	0.826	77%	0.77	S	S	*	*			trans	65.7	95.6	176.4	-66.2	177.8	174.5	141.6	3.2	114.8
655	E	28.8	Very low	33.5	Very low	164 Å²	164	153.3 Å²	153.3	77%	0.766	77%	0.773	S	S	*	*				66.7	151.4	60	-54.2	174.1	108.3	0	0	115.1
656	S	30.1	Very low	33.8	Very low	81 Å²	81	153.4 Å²	153.4	57%	0.566	77%	0.774	S	S	*	*			trans	66.6	91	145.5	-71	0	0	0	0	119.9
657	F	31.3	Very low	34	Very low	203 Å²	203	150.2 Å²	150.2	89%	0.89	78%	0.776	S	S	*	*			trans	66	138.1	148.4	-38.2	-69.1	0	0	0	118
658	G	29.7	Very low	34.1	Very low	67 Å²	67	143 Å²	143	69%	0.691	77%	0.773	S	S	*	*			cis	116.4	98.5	-0.7	0	0	0	0	0	113.2
659	R	32	Very low	34.3	Very low	229 Å²	229	138.5 Å²	138.5	86%	0.864	77%	0.766	S	S	*	*			trans	-175.8	139.1	151.4	-107.2	165.5	-160.2	-86.4	-3.2	112.4
660	Q	40.4	Very low	34.7	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.813	77%	0.773	S	S	*	*			trans	-80.7	171.6	151.4	-55.4	-179.9	-6.5	0	0	108.6
661	P	39.2	Very low	34.5	Very low	111 Å²	111	132.8 Å²	132.8	72%	0.721	78%	0.777	S	S	*	*				-157.3	156.9	90	40.9	-22	0	0	0	118.8
662	S	35	Very low	34.3	Very low	117 Å²	117	129.7 Å²	129.7	82%	0.818	78%	0.777	S	S	*	*			trans	66.4	145.2	134	68.4	0	0	0	0	124.1
663	G	36.2	Very low	34.3	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	79%	0.79	S	S	*	*			trans	136.6	77.4	167.7	0	0	0	0	0	111.8
664	R	32.6	Very low	34.5	Very low	213 Å²	213	139.5 Å²	139.5	80%	0.804	80%	0.796	S	S	*	*			cis	88.7	145.3	49.4	-168.3	176	-109.6	-117	0.9	112.4
665	Y	38.3	Very low	34.3	Very low	217 Å²	217	132.6 Å²	132.6	85%	0.851	79%	0.793	S	S	*	*			trans	72.4	134.1	-171.6	-52.5	-83	0	0	0	113.8
666	G	37.3	Very low	35.2	Very low	83 Å²	83	130.7 Å²	130.7	86%	0.856	80%	0.795	S	S	*	*			cis	171.5	162.1	-6.2	0	0	0	0	0	108.1
667	G	35.2	Very low	35.8	Very low	81 Å²	81	132.4 Å²	132.4	84%	0.835	80%	0.804	S	S	*	*			cis	-167.9	175.4	-5.2	0	0	0	0	0	109.1
668	G	36.3	Very low	36.1	Very low	76 Å²	76	129.6 Å²	129.6	78%	0.784	80%	0.799	S	S	*	*			trans	-82.3	-159.3	175	0	0	0	0	0	113.7
669	P	39.8	Very low	36.4	Very low	130 Å²	130	137 Å²	137	84%	0.844	81%	0.805	S	S	*	*			cis	-131.5	-124.3	15.2	29	-1.5	0	0	0	114.8
670	P	40.6	Very low	36.7	Very low	119 Å²	119	129.6 Å²	129.6	77%	0.773	80%	0.801	S	S	*	*				-131.4	153.8	-104.8	40.7	-24	0	0	0	118.9
671	G	31.5	Very low	36.9	Very low	84 Å²	84	127.4 Å²	127.4	87%	0.866	80%	0.801	S	S	*	*			trans	80.6	166.7	144.5	0	0	0	0	0	119.6
672	G	29.2	Very low	37	Very low	66 Å²	66	131.5 Å²	131.5	68%	0.68	81%	0.808	S	S	*	*			trans	114.2	56.9	147.5	0	0	0	0	0	122.5
673	R	30.2	Very low	37.3	Very low	231 Å²	231	131.1 Å²	131.1	87%	0.872	80%	0.803	S	S	*	*			trans	64.6	178.5	150.5	-59.4	-176.8	175.5	-154.2	-1.3	118.6
674	F	35.2	Very low	37.3	Very low	191 Å²	191	133.4 Å²	133.4	84%	0.838	81%	0.807	S	S	*	*			trans	72.4	112.2	165.8	-57.3	-74.8	0	0	0	121.1
675	G	30.5	Very low	37.3	Very low	74 Å²	74	126.5 Å²	126.5	76%	0.763	80%	0.802	S	S	*	*				94.7	127.9	109.4	0	0	0	0	0	119.3
676	P	48.3	Very low	37.3	Very low	124 Å²	124	124.6 Å²	124.6	81%	0.805	80%	0.803	S	S	*	*			trans	-104.4	160.3	175	39.2	-33.9	0	0	0	114.5
677	P	43.3	Very low	37.2	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	80%	0.801	S	S	*	*			trans	-118.7	141.6	142.9	37.7	-28.5	0	0	0	109.7
678	N	37.7	Very low	37.4	Very low	144 Å²	144	125.5 Å²	125.5	77%	0.77	79%	0.794	S	S	*	*			cis	66.5	142.6	33.5	-126.4	-2.5	0	0	0	111.9
679	R	35.2	Very low	37.7	Very low	221 Å²	221	128.1 Å²	128.1	83%	0.834	80%	0.798	S	S	*	*			cis	-165.8	124.8	14.8	-171.3	-178.8	-157.5	177.2	5.7	112.9
680	G	37.8	Very low	37.3	Very low	74 Å²	74	125.5 Å²	125.5	76%	0.763	79%	0.794	S	S	*	*			trans	60.2	-170.5	154.1	0	0	0	0	0	119.7
681	P	45.8	Very low	36.9	Very low	128 Å²	128	123.1 Å²	123.1	83%	0.831	79%	0.791	S	S	*	*			cis	-118.2	178.2	-4.6	40.9	-28.5	0	0	0	115.4
682	F	40.6	Very low	36.8	Very low	198 Å²	198	129.4 Å²	129.4	87%	0.868	80%	0.795	S	S	*	*			trans	-72.8	179.8	169.1	-64.6	-79.2	0	0	0	111.6
683	P	41.4	Very low	36.7	Very low	109 Å²	109	130.1 Å²	130.1	71%	0.708	80%	0.802	S	S	*	*			cis	-146.5	-168.6	17.6	44.8	-23.9	0	0	0	118.1
684	S	37.2	Very low	36.7	Very low	122 Å²	122	122.3 Å²	122.3	85%	0.853	79%	0.794	S	S	*	*			trans	73.4	135	151.7	-62.2	0	0	0	0	120.9
685	G	32.1	Very low	36.5	Very low	67 Å²	67	123.2 Å²	123.2	69%	0.691	80%	0.797	S	S	*	*			trans	137.6	89.9	139.3	0	0	0	0	0	118.4
686	M	37.6	Very low	36.6	Very low	177 Å²	177	124 Å²	124	87%	0.872	78%	0.784	S	S	*	*			trans	57.9	103.9	137	-61	162	73.1	0	0	120.2
687	S	36.1	Very low	35.9	Very low	116 Å²	116	121.1 Å²	121.1	81%	0.811	76%	0.762	S	S	*	*				67.5	144.5	128.5	-46.7	0	0	0	0	119.6
688	G	39.9	Very low	35.5	Very low	67 Å²	67	120 Å²	120	69%	0.691	76%	0.757	S	S	*	*			cis	81.8	165.5	13.8	0	0	0	0	0	112.8
689	P	41.9	Very low	35.3	Very low	132 Å²	132	124.8 Å²	124.8	86%	0.857	76%	0.764	S	S	*	*			cis	-102.6	-165.9	-10.8	42.3	-31.4	0	0	0	110.1
690	G	31.6	Very low	35.1	Very low	75 Å²	75	118.2 Å²	118.2	77%	0.773	77%	0.765	S	S	*	*			cis	99.3	143.5	5.4	0	0	0	0	0	113.7
691	G	31.1	Very low	34.8	Very low	68 Å²	68	118.5 Å²	118.5	70%	0.701	77%	0.768	S	S	*	*			trans	119.9	118.7	-176.6	0	0	0	0	0	110.6
692	F	29.6	Very low	34.1	Very low	217 Å²	217	120.6 Å²	120.6	95%	0.952	77%	0.769	S	S	*	*			cis	74.9	134.8	42.1	-75.2	-91.7	0	0	0	115.4
693	G	28.2	Very low	33.8	Very low	81 Å²	81	119.8 Å²	119.8	84%	0.835	77%	0.77	S	S	*	*			trans	84.9	149.2	-178.3	0	0	0	0	0	113.3
694	G	29.8	Very low	33.5	Very low	67 Å²	67	126 Å²	126	69%	0.691	78%	0.779	S	S	*	*			cis	130.5	110.1	-2.7	0	0	0	0	0	112.4
695	F	31.3	Very low	33.5	Very low	209 Å²	209	126.3 Å²	126.3	92%	0.917	78%	0.781	S	S	*	*			trans	57.7	101.6	166.6	-66.3	-83.6	0	0	0	119.7
696	D	32.9	Very low	33.6	Very low	91 Å²	91	126.5 Å²	126.5	49%	0.487	78%	0.783	S	S	.	*				70.6	134.1	125.7	-158.6	34.8	0	0	0	122.7	R889	D696-R889 IonicContact OD1-CZ 2.71Å; D696-R889 IonicContact OD1-NH1 2.75Å; D696-R889 PolarHBondContact OD1-NH1 3.11Å
697	N	33.7	Very low	33.7	Very low	63 Å²	63	124.1 Å²	124.1	34%	0.337	78%	0.781	S	S	.	*			trans	74.5	140.1	148.1	-101.3	-47.1	0	0	0	123	R890	N697-R890 VanDerWaalsContact CG-NE 3.31Å; N697-R890 PolarHBondContact ND2-NE 2.99Å; N697-R890 PolarHBondContact OD1-NE 3.47Å; N697-R890 VanDerWaalsContact OD1-NE 3.15Å; N697-R890 PolarHBondContact OD1-NH2 2.88Å
698	S	34	Very low	33.5	Very low	94 Å²	94	123 Å²	123	66%	0.657	78%	0.779	S	S	*	*			trans	88.3	155	159.7	-113.7	0	0	0	0	120.8	R890	S698-R890 PolarHBondContact OG-NH2 3.47Å
699	R	33	Very low	33.2	Very low	245 Å²	245	131.9 Å²	131.9	93%	0.925	79%	0.791	S	S	*	*			trans	-70.7	151.1	-172	-71.5	175.1	172.1	162.5	-4.3	113.3
700	G	31.5	Very low	32.8	Very low	83 Å²	83	129.4 Å²	129.4	86%	0.856	79%	0.79	S	S	*	*			trans	-66.1	176.7	173.3	0	0	0	0	0	116.8
701	G	31.8	Very low	32.8	Very low	79 Å²	79	129 Å²	129	81%	0.814	79%	0.786	S	S	*	*			trans	176.4	132.1	178	0	0	0	0	0	107.5
702	M	31.2	Very low	32.9	Very low	173 Å²	173	135.3 Å²	135.3	85%	0.852	79%	0.794	S	S	*	*			trans	-84.4	172.5	176	-68.1	-175.2	178.7	0	0	111.2
703	M	35.2	Very low	33	Very low	180 Å²	180	130.9 Å²	130.9	89%	0.887	79%	0.786	S	S	*	*			trans	81.1	165.3	168.3	-51.1	-53	174.2	0	0	116.6
704	R	33.5	Very low	33.5	Very low	241 Å²	241	131.4 Å²	131.4	91%	0.909	78%	0.782	S	S	*	*			trans	-147	142.2	-145.9	-177.9	-170.9	-173.1	-148.9	4.9	110.5
705	S	38.2	Very low	33.8	Very low	128 Å²	128	134.3 Å²	134.3	90%	0.895	79%	0.788	S	S	*	*			trans	77.5	131.1	170.3	-156.2	0	0	0	0	116.5
706	G	33.5	Very low	34	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	78%	0.783	S	S	*	*			trans	147.1	95.3	-179.3	0	0	0	0	0	111
707	P	39.1	Very low	34	Very low	127 Å²	127	136.4 Å²	136.4	83%	0.825	80%	0.8	S	S	*	*			trans	-96.8	143.8	-172.9	35.5	-32.6	0	0	0	113.3
708	A	33.5	Very low	33.9	Very low	93 Å²	93	139.5 Å²	139.5	77%	0.769	82%	0.817	S	S	*	*				162.6	143.5	122.7	0	0	0	0	0	113.8
709	R	33.3	Very low	33.8	Very low	252 Å²	252	139.4 Å²	139.4	95%	0.951	82%	0.816	S	S	*	*			trans	45.3	133.4	147.5	-74.2	-177.6	165.6	-175.2	-4.6	121.6
710	G	33.9	Very low	33.6	Very low	81 Å²	81	138.8 Å²	138.8	84%	0.835	81%	0.814	S	S	*	*			trans	99.4	103.1	142.8	0	0	0	0	0	114.7
711	G	31.6	Very low	33.5	Very low	66 Å²	66	139.6 Å²	139.6	68%	0.68	81%	0.812	S	S	*	*			trans	-103.8	168.2	159.2	0	0	0	0	0	110.2
712	F	31.6	Very low	33.3	Very low	200 Å²	200	139.3 Å²	139.3	88%	0.877	81%	0.81	S	S	*	*			trans	-165.2	145.1	134.9	-106.1	-73.1	0	0	0	110.2
713	T	33.3	Very low	33.1	Very low	125 Å²	125	143.6 Å²	143.6	77%	0.767	82%	0.816	S	S	*	*			trans	5.6	131.1	160.8	47.4	0	0	0	0	121.2
714	A	37.6	Very low	32.8	Very low	92 Å²	92	137.9 Å²	137.9	76%	0.76	80%	0.803	S	S	*	*			trans	-76.2	170.1	157.8	0	0	0	0	0	112
715	P	36.3	Very low	32.8	Very low	127 Å²	127	130.9 Å²	130.9	83%	0.825	80%	0.798	S	S	*	*				-140.6	-179.8	100	39.7	-27.3	0	0	0	114.9
716	N	34.8	Very low	32.5	Very low	150 Å²	150	134.7 Å²	134.7	80%	0.802	79%	0.794	S	S	*	*			trans	-70.5	155.6	175.7	-61.7	-33.1	0	0	0	112.7
717	F	33.7	Very low	32.3	Very low	195 Å²	195	142.2 Å²	142.2	86%	0.855	80%	0.8	S	S	*	*			trans	-159.3	126.8	130.5	-129	-101.2	0	0	0	112.1
718	D	32.2	Very low	32.1	Very low	127 Å²	127	139.8 Å²	139.8	68%	0.679	80%	0.798	S	S	*	*			trans	39.5	143.6	145.9	-120.9	-50.8	0	0	0	126.5
719	S	31.9	Very low	32.1	Very low	92 Å²	92	140.7 Å²	140.7	64%	0.643	80%	0.799	S	S	*	*			trans	75.1	142	134.9	-91.2	0	0	0	0	125.7
720	R	28.5	Very low	32.3	Very low	233 Å²	233	137 Å²	137	88%	0.879	79%	0.794	S	S	*	*			trans	73.9	124.2	148.3	-73.6	174.9	175.1	173.7	-1.1	121.7
721	A	28.8	Very low	32.3	Very low	99 Å²	99	139.7 Å²	139.7	82%	0.818	79%	0.79	S	S	*	*			trans	61.4	111.6	132.5	0	0	0	0	0	121.7
722	G	27.7	Very low	32.5	Very low	74 Å²	74	147.7 Å²	147.7	76%	0.763	80%	0.799	S	S	*	*				79.7	124.8	107.4	0	0	0	0	0	121.6
723	R	26.8	Very low	32.6	Very low	262 Å²	262	141.6 Å²	141.6	99%	0.989	79%	0.792	S	S	*	*			trans	69.6	160.3	160.9	-58.1	-173	176.5	-145.1	3.3	118
724	G	28.2	Very low	32.6	Very low	60 Å²	60	143 Å²	143	62%	0.619	80%	0.795	S	S	*	*			trans	90.2	102.5	174.4	0	0	0	0	0	113.4
725	A	33.8	Very low	32.8	Very low	95 Å²	95	143.8 Å²	143.8	79%	0.785	79%	0.793	S	S	*	*			cis	77.3	73.8	18.1	0	0	0	0	0	116.4
726	Y	32	Very low	32.7	Very low	207 Å²	207	140.7 Å²	140.7	81%	0.812	78%	0.784	S	S	*	*			trans	-154.2	145.1	168.5	-75.6	-67.2	0	0	0	109.9
727	R	30.1	Very low	32.9	Very low	229 Å²	229	145.3 Å²	145.3	86%	0.864	79%	0.792	S	S	*	*			cis	-166.8	140.6	-19.5	-148.6	-174.3	-160.4	-168.2	4.2	111.1
728	G	33.8	Very low	32.9	Very low	76 Å²	76	139.4 Å²	139.4	78%	0.784	79%	0.786	S	S	*	*			trans	81.2	156.7	159.9	0	0	0	0	0	117.1
729	S	33.1	Very low	33	Very low	112 Å²	112	137 Å²	137	78%	0.783	79%	0.792	S	S	*	*			cis	-161	172.9	-6.3	-158.5	0	0	0	0	111.5
730	M	38.6	Very low	33.4	Very low	174 Å²	174	138.2 Å²	138.2	86%	0.857	80%	0.797	S	S	*	*			trans	65.8	81.2	175.3	-57.6	-178.9	179	0	0	113.6
731	D	33.8	Very low	33.6	Very low	138 Å²	138	133.5 Å²	133.5	74%	0.738	79%	0.789	S	S	*	*			cis	57.6	103	47.5	177.9	39.4	0	0	0	114.3
732	R	35.5	Very low	33.7	Very low	235 Å²	235	134.8 Å²	134.8	89%	0.887	78%	0.782	S	S	*	*				176.1	144.9	119.8	-93.2	171.4	-170.2	-155.5	3.1	112.9
733	G	34.3	Very low	33.8	Very low	71 Å²	71	135.9 Å²	135.9	73%	0.732	78%	0.775	S	S	*	*			trans	114.9	50.4	148.5	0	0	0	0	0	121
734	N	33.1	Very low	33.8	Very low	154 Å²	154	130.3 Å²	130.3	82%	0.824	76%	0.761	S	S	*	*				22.7	152.8	105.1	-161	60.5	0	0	0	119.7
735	P	42.4	Very low	33.8	Very low	110 Å²	110	135.9 Å²	135.9	71%	0.714	77%	0.765	S	S	*	*			cis	-128.6	-172.8	-15.5	38.1	-21.7	0	0	0	114.3
736	G	34.3	Very low	33.5	Very low	62 Å²	62	136.7 Å²	136.7	64%	0.639	76%	0.756	S	S	*	*			trans	155.8	99.3	139	0	0	0	0	0	118.9
737	Y	37.6	Very low	33.3	Very low	247 Å²	247	135.9 Å²	135.9	97%	0.969	75%	0.752	S	S	*	*			trans	41.2	136.3	151.9	-63.3	-90.1	0	0	0	121.1
738	G	34.7	Very low	33.2	Very low	71 Å²	71	133 Å²	133	73%	0.732	75%	0.746	S	S	*	*			cis	176.3	153.4	-1.4	0	0	0	0	0	111
739	G	33.8	Very low	33.1	Very low	77 Å²	77	135.8 Å²	135.8	79%	0.794	74%	0.742	S	S	*	*			trans	-86	-145.6	178.5	0	0	0	0	0	113.3
740	P	40.2	Very low	33	Very low	116 Å²	116	133.6 Å²	133.6	75%	0.753	74%	0.737	S	S	*	*			cis	-102.9	171.1	2.8	41.3	-32.6	0	0	0	111.9
741	N	32.1	Very low	32.7	Very low	134 Å²	134	132.8 Å²	132.8	72%	0.717	74%	0.737	S	S	*	*			cis	75.1	149.8	33	-143.5	69.7	0	0	0	114.2
742	D	30.8	Very low	32.8	Very low	126 Å²	126	130.2 Å²	130.2	67%	0.674	74%	0.735	S	S	*	*			trans	69.9	152.2	171.1	-68.5	-65.4	0	0	0	119.2
743	T	30	Very low	32.7	Very low	98 Å²	98	122.2 Å²	122.2	60%	0.601	73%	0.725	S	S	*	*			cis	-173	162.8	-30.2	-101.9	0	0	0	0	108
744	M	27.3	Very low	32.8	Very low	144 Å²	144	125.8 Å²	125.8	71%	0.709	73%	0.728	S	S	*	*			trans	75.9	152	158.2	-92.4	164.1	-163.2	0	0	122.2
745	Y	27.7	Very low	32.8	Very low	178 Å²	178	122.8 Å²	122.8	70%	0.698	72%	0.724	S	S	*	*			trans	70.6	115.4	147.3	-69.1	-45.3	0	0	0	123.4
746	N	28.5	Very low	32.4	Very low	112 Å²	112	125.1 Å²	125.1	60%	0.599	73%	0.726	S	S	*	*				79.7	115.5	122.7	-73.8	-29.9	0	0	0	121.3
747	R	27.4	Very low	32.9	Very low	190 Å²	190	127 Å²	127	72%	0.717	73%	0.727	S	S	*	*				79.5	137.4	118.7	-72.1	-177.6	-172.4	-166.7	-0.4	120.3
748	F	28.2	Very low	32.8	Very low	168 Å²	168	122.7 Å²	122.7	74%	0.737	72%	0.719	S	S	*	*			trans	73.1	142.5	135.8	-77	-142.6	0	0	0	115.8
749	D	31.4	Very low	32.8	Very low	134 Å²	134	122.1 Å²	122.1	72%	0.717	71%	0.713	S	S	*	*			cis	-162.3	-176	-12.2	-140.1	-38.5	0	0	0	109.6
750	G	31.6	Very low	32.8	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	71%	0.713	S	S	*	*			trans	81.8	100.7	153.4	0	0	0	0	0	116.3
751	N	32.6	Very low	32.5	Very low	158 Å²	158	123 Å²	123	85%	0.845	70%	0.702	S	S	*	*			cis	95.3	155.2	27.9	-161.3	34.8	0	0	0	114.9
752	A	34.8	Very low	32.5	Very low	84 Å²	84	126.2 Å²	126.2	69%	0.694	71%	0.705	S	S	*	*			trans	69.7	131.7	-178.4	0	0	0	0	0	115.7
753	G	34.3	Very low	32.7	Very low	67 Å²	67	127.5 Å²	127.5	69%	0.691	71%	0.712	S	S	*	*			cis	179.5	169.6	-0.4	0	0	0	0	0	111.3
754	D	36.7	Very low	32.9	Very low	145 Å²	145	130.6 Å²	130.6	78%	0.775	72%	0.722	S	S	*	*			cis	-160.3	163.7	-5.7	-81.6	-47.6	0	0	0	110.2
755	A	33.4	Very low	33.2	Very low	91 Å²	91	129 Å²	129	75%	0.752	73%	0.725	S	S	*	*			trans	60.4	146.6	150.7	0	0	0	0	0	121.1
756	E	33.5	Very low	33.4	Very low	159 Å²	159	129.7 Å²	129.7	74%	0.743	73%	0.734	S	S	*	*			cis	-157.1	154.9	-15.5	-107.8	-63.3	97.8	0	0	107.9
757	P	44.9	Very low	33.8	Very low	102 Å²	102	128.3 Å²	128.3	66%	0.662	74%	0.739	S	S	*	*			trans	-108.4	-133.7	-177.3	41.8	-32.4	0	0	0	113.4
758	I	35.4	Very low	34.2	Very low	157 Å²	157	124.4 Å²	124.4	81%	0.805	74%	0.741	S	S	*	*			trans	94.8	129.8	-177.8	-54.1	160.4	0	0	0	114.1
759	G	33.4	Very low	34.4	Very low	59 Å²	59	124.4 Å²	124.4	61%	0.608	75%	0.747	S	S	*	*			cis	160	146.6	-13.4	0	0	0	0	0	115.5
760	N	33.7	Very low	34.6	Very low	148 Å²	148	123.8 Å²	123.8	79%	0.791	75%	0.753	S	S	*	*			trans	67.5	159.3	158.3	-55.4	-24.9	0	0	0	120.1
761	A	34.8	Very low	34.9	Very low	63 Å²	63	129.3 Å²	129.3	52%	0.521	76%	0.762	S	S	.	*			cis	-176.4	-173.3	-38.9	0	0	0	0	0	109.5
762	Y	32.6	Very low	35.6	Very low	201 Å²	201	127.2 Å²	127.2	79%	0.788	76%	0.757	S	S	*	*			trans	58.2	149.8	161.7	31.3	-107.3	0	0	0	119.7
763	D	34.7	Very low	35.8	Very low	153 Å²	153	129.1 Å²	129.1	82%	0.818	76%	0.762	S	S	*	*			cis	-147.8	-158.5	3.9	-147.5	-19.2	0	0	0	114.1
764	M	33.9	Very low	36.1	Very low	164 Å²	164	136.6 Å²	136.6	81%	0.808	77%	0.77	S	S	*	*			trans	-101.1	169	-153.1	-72.4	-99.4	-157.6	0	0	120.1
765	S	33.9	Very low	35.9	Very low	110 Å²	110	139 Å²	139	77%	0.769	78%	0.777	S	S	*	*			trans	108.3	118.3	133.9	70.6	0	0	0	0	124.5
766	E	32.7	Very low	36	Very low	192 Å²	192	138 Å²	138	90%	0.897	78%	0.775	S	S	*	*			trans	64.2	124.9	133.2	-67	-152	118.8	0	0	128.3
767	A	35.2	Very low	35.9	Very low	84 Å²	84	134 Å²	134	69%	0.694	78%	0.777	S	S	*	*				92.5	109.3	125.8	0	0	0	0	0	125.1
768	S	35.6	Very low	35.5	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	78%	0.784	S	S	*	*				96.4	108.9	126.3	72.8	0	0	0	0	124.3
769	L	33.9	Very low	35.3	Very low	168 Å²	168	137 Å²	137	88%	0.88	79%	0.792	S	S	*	*			trans	73.2	136.4	131.7	-76.1	163.2	0	0	0	125
770	S	35.8	Very low	35.2	Very low	120 Å²	120	140 Å²	140	84%	0.839	80%	0.803	S	S	*	*			trans	102.2	156.8	159.8	76.6	0	0	0	0	119.7
771	Q	37.8	Very low	35.1	Very low	183 Å²	183	136.5 Å²	136.5	86%	0.855	80%	0.802	S	S	*	*			trans	-118.3	-172.1	-163.9	-56.8	178.8	-10.2	0	0	110.3
772	P	45.8	Very low	35.1	Very low	114 Å²	114	137 Å²	137	74%	0.74	81%	0.813	S	S	*	*			cis	-119.9	-159.5	-9.2	21.7	5.4	0	0	0	111
773	P	39.1	Very low	35.1	Very low	123 Å²	123	138 Å²	138	80%	0.799	82%	0.823	S	S	*	*			cis	-120	-142.4	-2.7	43.9	-27.3	0	0	0	112.9
774	Y	41.2	Very low	34.9	Very low	224 Å²	224	142.7 Å²	142.7	88%	0.878	83%	0.829	S	S	*	*			trans	-148.6	126.6	-173.1	-120	-97.7	0	0	0	115.3
775	E	33.1	Very low	34.9	Very low	197 Å²	197	138.7 Å²	138.7	92%	0.921	83%	0.83	S	S	*	*			trans	-156.5	126.2	163.1	-172.7	172	-126.4	0	0	109.5
776	G	35.7	Very low	34.8	Very low	69 Å²	69	136 Å²	136	71%	0.711	82%	0.819	S	S	*	*			trans	76.9	161.4	173.3	0	0	0	0	0	118.1
777	G	30.6	Very low	34.9	Very low	75 Å²	75	138.3 Å²	138.3	77%	0.773	82%	0.821	S	S	*	*			trans	104.1	131.5	166.4	0	0	0	0	0	116.8
778	P	37.3	Very low	34.7	Very low	126 Å²	126	138.3 Å²	138.3	82%	0.818	83%	0.829	S	S	*	*			trans	-93.2	138.3	173.4	35.2	-31.7	0	0	0	112.5
779	M	30	Very low	34.6	Very low	196 Å²	196	136.4 Å²	136.4	97%	0.966	83%	0.827	S	S	*	*			trans	-155.9	167.9	166.9	-104.9	-58.3	156.4	0	0	112.7
780	S	31.9	Very low	34.6	Very low	121 Å²	121	134.8 Å²	134.8	85%	0.846	83%	0.83	S	S	*	*			trans	-118.5	157.9	-173.9	-177.3	0	0	0	0	113
781	G	31.3	Very low	34.5	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	83%	0.825	S	S	*	*			trans	97.3	147.9	174.3	0	0	0	0	0	114.4
782	G	34.1	Very low	34.2	Very low	73 Å²	73	135.7 Å²	135.7	75%	0.753	83%	0.829	S	S	*	*			cis	149.2	99.8	-4.3	0	0	0	0	0	112
783	F	33.1	Very low	33.5	Very low	224 Å²	224	133.9 Å²	133.9	98%	0.982	83%	0.831	S	S	*	*			trans	-83.5	151.4	173.9	-92.8	-85.1	0	0	0	112.4
784	R	31.5	Very low	33.1	Very low	251 Å²	251	134.6 Å²	134.6	95%	0.947	83%	0.833	S	S	*	*			trans	-119.3	134.2	-150.2	-163.5	-170.4	-159.6	-152.6	10.7	112.6
785	G	33.6	Very low	32.7	Very low	80 Å²	80	132 Å²	132	83%	0.825	83%	0.829	S	S	*	*			trans	153	118.9	166.7	0	0	0	0	0	112.5
786	G	31.8	Very low	32.6	Very low	53 Å²	53	131.4 Å²	131.4	55%	0.546	83%	0.829	S	S	.	*			cis	176.6	173.1	-5.7	0	0	0	0	0	111.9
787	Y	34.1	Very low	32.6	Very low	240 Å²	240	137.4 Å²	137.4	94%	0.941	84%	0.838	S	S	*	*			trans	71.2	134.7	171.7	-38	-70.8	0	0	0	115.5
788	G	32.3	Very low	32.7	Very low	84 Å²	84	137.4 Å²	137.4	87%	0.866	84%	0.838	S	S	*	*			trans	-100.7	-160.4	-167.4	0	0	0	0	0	114.9
789	G	33.3	Very low	32.6	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	83%	0.832	S	S	*	*			cis	168.7	-177.6	-0.8	0	0	0	0	0	112
790	S	33.4	Very low	32.8	Very low	135 Å²	135	135.3 Å²	135.3	94%	0.944	82%	0.818	S	S	*	*			trans	54.4	122.2	165.3	-58.5	0	0	0	0	118.9
791	G	33.6	Very low	32.7	Very low	72 Å²	72	133.2 Å²	133.2	74%	0.742	82%	0.816	S	S	*	*			cis	167.7	-179	-2.2	0	0	0	0	0	112.9
792	R	30.8	Very low	33.4	Very low	249 Å²	249	133.2 Å²	133.2	94%	0.94	81%	0.808	S	S	*	*			trans	18.2	127.5	159.7	-52.3	-177.3	-175.2	-164.4	0.6	117.8
793	G	31.1	Very low	33.8	Very low	76 Å²	76	136.1 Å²	136.1	78%	0.784	81%	0.814	S	S	*	*				98	156.2	64.3	0	0	0	0	0	109.8
794	V	31.7	Very low	34	Very low	139 Å²	139	128.7 Å²	128.7	84%	0.842	80%	0.8	S	S	*	*			cis	-148.7	169.6	7.8	179.2	0	0	0	0	108.7
795	Q	33.4	Very low	34.4	Very low	170 Å²	170	129 Å²	129	79%	0.794	80%	0.802	S	S	*	*			trans	-69.2	163.9	173.8	-57.5	154.9	-69.5	0	0	113.6
796	M	30.5	Very low	34.6	Very low	184 Å²	184	129.2 Å²	129.2	91%	0.906	80%	0.803	S	S	*	*				-170.6	-176.2	122.6	-101.2	-55	170.4	0	0	113.2
797	Q	35	Very low	34.9	Very low	194 Å²	194	129.7 Å²	129.7	91%	0.907	81%	0.809	S	S	*	*			trans	-136.6	143.4	-154.7	177.8	-171.9	77.1	0	0	112.4
798	G	33.2	Very low	35.2	Very low	75 Å²	75	125.2 Å²	125.2	77%	0.773	81%	0.807	S	S	*	*			trans	178.4	74.1	-179.5	0	0	0	0	0	121.9
799	S	36.1	Very low	35.5	Very low	100 Å²	100	125.9 Å²	125.9	70%	0.699	80%	0.798	S	S	*	*			trans	21.2	131.8	143	-81.1	0	0	0	0	126
800	R	32.5	Very low	35.6	Very low	179 Å²	179	131.4 Å²	131.4	68%	0.675	81%	0.808	S	S	*	*			trans	88.6	136.6	136	-66.8	163.7	-174.3	-131.7	-0	122.5	S1047	R800-S1047 VanDerWaalsContact CZ-OG 3.31Å; R800-S1047 PolarHBondContact NH1-OG 2.95Å; R800-S1047 PolarHBondContact NH2-OG 2.71Å
801	G	31	Very low	35.7	Very low	77 Å²	77	128 Å²	128	79%	0.794	80%	0.795	S	S	*	*			trans	158.8	132.9	158.9	0	0	0	0	0	113.5
802	A	45.5	Very low	35.7	Very low	74 Å²	74	137.3 Å²	137.3	61%	0.612	81%	0.807	S	S	*	*			trans	-167.3	141.8	176.6	0	0	0	0	0	116
803	P	42.9	Very low	35.8	Very low	134 Å²	134	128.7 Å²	128.7	87%	0.87	80%	0.796	S	S	*	*			trans	-128.6	-179.6	149.6	38	-24.4	0	0	0	111.9
804	G	37.7	Very low	36	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	80%	0.797	S	S	*	*			cis	157.1	137	-12.9	0	0	0	0	0	114.1
805	R	38.7	Very low	36.2	Very low	259 Å²	259	130.1 Å²	130.1	98%	0.977	80%	0.8	S	S	*	*			trans	72.8	149.3	177.5	-60.7	-178.3	166.4	-159.9	-3.5	117.8
806	G	38.1	Very low	36.3	Very low	83 Å²	83	126.1 Å²	126.1	86%	0.856	80%	0.796	S	S	*	*			cis	163.8	153.4	-12.5	0	0	0	0	0	115.9
807	G	38.9	Very low	37	Very low	64 Å²	64	123.4 Å²	123.4	66%	0.66	79%	0.792	S	S	*	*			trans	121.8	109.2	171.2	0	0	0	0	0	114.4
808	T	39.4	Very low	37	Very low	146 Å²	146	117.8 Å²	117.8	90%	0.896	79%	0.786	S	S	*	*				77	134.7	67.5	59.3	0	0	0	0	114.7
809	S	38.9	Very low	36.9	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	79%	0.793	S	S	*	*			cis	-160.1	162.4	7	90.6	0	0	0	0	114.2
810	M	36.1	Very low	36.8	Very low	183 Å²	183	125.8 Å²	125.8	90%	0.901	80%	0.798	S	S	*	*			trans	44.3	143.5	150.1	-50.4	-57.2	-174.3	0	0	122.1
811	G	34.9	Very low	36.8	Very low	65 Å²	65	121.1 Å²	121.1	67%	0.67	80%	0.798	S	S	*	*			cis	152.3	144.1	-11.5	0	0	0	0	0	115.6
812	R	34	Very low	36.9	Very low	266 Å²	266	124.6 Å²	124.6	100%	1.004	80%	0.799	S	S	*	*			trans	65.1	156.4	170.4	-54.3	-177.7	-179.4	-163.8	-0.4	116.4
813	G	33.2	Very low	36.4	Very low	69 Å²	69	127.5 Å²	127.5	71%	0.711	81%	0.809	S	S	*	*			cis	169.3	124	-8.8	0	0	0	0	0	109.5
814	A	33.5	Very low	36	Very low	98 Å²	98	126.5 Å²	126.5	81%	0.81	80%	0.796	S	S	*	*				100.8	164.4	92.8	0	0	0	0	0	113.6
815	V	36.4	Very low	35.7	Very low	147 Å²	147	133.9 Å²	133.9	89%	0.891	80%	0.803	S	S	*	*			trans	79.4	119.4	171.3	-167.8	0	0	0	0	118.3
816	A	35.3	Very low	35.5	Very low	86 Å²	86	125 Å²	125	71%	0.711	79%	0.792	S	S	*	*			trans	-125	-166.5	158.6	0	0	0	0	0	106.4
817	P	46.4	Very low	35.4	Very low	127 Å²	127	127 Å²	127	83%	0.825	79%	0.788	S	S	*	*			cis	-139.3	-174.7	-3.1	43.7	-25.9	0	0	0	115.5
818	G	34.3	Very low	35.2	Very low	76 Å²	76	129.3 Å²	129.3	78%	0.784	79%	0.785	S	S	*	*			trans	92.6	170.1	157	0	0	0	0	0	116.6
819	R	31.1	Very low	34.9	Very low	244 Å²	244	133 Å²	133	92%	0.921	78%	0.782	S	S	*	*			cis	-166.2	145.6	-11.6	-168.2	-175.2	-168	-165.5	4.8	108.3
820	A	33.5	Very low	34.7	Very low	98 Å²	98	131.7 Å²	131.7	81%	0.81	78%	0.784	S	S	*	*			trans	63.3	165.5	170.4	0	0	0	0	0	115.8
821	A	33.5	Very low	34.7	Very low	82 Å²	82	131.4 Å²	131.4	68%	0.678	78%	0.78	S	S	*	*			cis	-161.4	171.3	-29.4	0	0	0	0	0	110.2
822	N	32.6	Very low	34.7	Very low	150 Å²	150	135.8 Å²	135.8	80%	0.802	79%	0.788	S	S	*	*			trans	12.6	123.9	157	-54.8	-0.9	0	0	0	120.3
823	T	35.8	Very low	34.6	Very low	135 Å²	135	126.9 Å²	126.9	83%	0.828	78%	0.778	S	S	*	*				174.4	138	121.7	26.2	0	0	0	0	107.3
824	D	33.6	Very low	34.7	Very low	112 Å²	112	135.7 Å²	135.7	60%	0.599	79%	0.79	S	S	*	*			cis	116.2	143.6	32.5	175.9	41.7	0	0	0	108.7
825	R	32.4	Very low	34.7	Very low	223 Å²	223	139 Å²	139	84%	0.842	79%	0.794	S	S	*	*			trans	66.2	141.7	-174.1	-51.8	148.4	-149.1	-168	4.3	112.7
826	G	32.9	Very low	34.6	Very low	73 Å²	73	136.3 Å²	136.3	75%	0.753	79%	0.788	S	S	*	*			cis	150.8	-177	17.9	0	0	0	0	0	106.6
827	V	36.8	Very low	34.6	Very low	126 Å²	126	138.3 Å²	138.3	76%	0.764	79%	0.793	S	S	*	*			cis	-155.6	146.2	-2.4	-172.6	0	0	0	0	107.4
828	D	34.8	Very low	34.2	Very low	112 Å²	112	139.2 Å²	139.2	60%	0.599	80%	0.796	S	S	*	*			trans	45.5	137.9	157.9	-87.4	-62.6	0	0	0	125.4
829	R	33.4	Very low	34.2	Very low	224 Å²	224	141 Å²	141	85%	0.845	80%	0.796	S	S	*	*			trans	72.2	154.9	134.5	-71.5	164.4	-150.7	-164.1	8.3	123.9
830	G	34.8	Very low	34.3	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	79%	0.791	S	S	*	*			trans	88.3	80.4	163.6	0	0	0	0	0	113.6
831	Q	34.7	Very low	34.3	Very low	177 Å²	177	140.6 Å²	140.6	83%	0.827	80%	0.799	S	S	*	*				54.8	133.9	63	-140.7	-161.2	101.2	0	0	114.3
832	L	34.8	Very low	34.2	Very low	158 Å²	158	140.4 Å²	140.4	83%	0.827	81%	0.805	S	S	*	*			trans	70.6	88.6	177.8	-51.3	177.8	0	0	0	116.3
833	G	33.1	Very low	34.3	Very low	78 Å²	78	136.9 Å²	136.9	80%	0.804	80%	0.804	S	S	*	*			trans	-87.8	176.6	167.9	0	0	0	0	0	114
834	R	35.9	Very low	34.4	Very low	255 Å²	255	135.5 Å²	135.5	96%	0.962	81%	0.806	S	S	*	*			trans	-146.7	148.7	165.2	-95.9	-178.1	-174.4	-168.3	1.7	112.1
835	N	32.3	Very low	34.5	Very low	166 Å²	166	139.6 Å²	139.6	89%	0.888	82%	0.821	S	S	*	*			trans	-76.9	143	176.3	-61.9	-52.8	0	0	0	112
836	A	33.6	Very low	34.8	Very low	92 Å²	92	134 Å²	134	76%	0.76	81%	0.814	S	S	*	*			trans	-154.8	106.5	157.9	0	0	0	0	0	111.2
837	P	36.1	Very low	35.1	Very low	127 Å²	127	136.4 Å²	136.4	83%	0.825	81%	0.81	S	S	*	*			trans	-85.9	139.6	167.1	33.7	-31	0	0	0	110.5
838	V	39	Very low	35	Very low	147 Å²	147	139.4 Å²	139.4	89%	0.891	81%	0.807	S	S	*	*			trans	-129.6	137.3	173.4	178.9	0	0	0	0	110.2
839	S	33	Very low	35	Very low	113 Å²	113	139.8 Å²	139.8	79%	0.79	81%	0.809	S	S	*	*			trans	-118.2	140.6	-171.9	57.4	0	0	0	0	113.3
840	G	32.7	Very low	34.9	Very low	79 Å²	79	136.1 Å²	136.1	81%	0.814	80%	0.804	S	S	*	*			trans	100	115.4	137.5	0	0	0	0	0	119.1
841	R	34.4	Very low	34.9	Very low	255 Å²	255	140.3 Å²	140.3	96%	0.962	81%	0.808	S	S	*	*			trans	-161.6	145.9	142.2	-103.3	-178.5	-178	-164	0.2	107.8
842	G	31.5	Very low	34.6	Very low	78 Å²	78	135.7 Å²	135.7	80%	0.804	81%	0.808	S	S	*	*			cis	132.8	101.6	-8.9	0	0	0	0	0	113
843	G	35.6	Very low	34.5	Very low	76 Å²	76	131.9 Å²	131.9	78%	0.784	81%	0.806	S	S	*	*			trans	124	112.5	-176.4	0	0	0	0	0	111.1
844	A	36	Very low	34.5	Very low	106 Å²	106	138.2 Å²	138.2	88%	0.876	81%	0.812	S	S	*	*			cis	93.7	103.9	8.9	0	0	0	0	0	117.4
845	Q	37.1	Very low	34.6	Very low	197 Å²	197	131.5 Å²	131.5	92%	0.921	80%	0.802	S	S	*	*			trans	-155	138.6	146.6	-126.6	173.2	-20.3	0	0	110.2
846	P	38.8	Very low	34.6	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	80%	0.8	S	S	*	*			trans	-118.4	-164.6	-175.5	44.3	-34.7	0	0	0	113.9
847	D	38.2	Very low	34.8	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	81%	0.805	S	S	*	*			trans	73.5	143.1	167.8	-69.9	1.8	0	0	0	116.4
848	R	35.7	Very low	34.5	Very low	190 Å²	190	132.6 Å²	132.6	72%	0.717	80%	0.795	S	S	*	*			cis	-163.5	162	-5.7	-117.6	175.2	-155.2	-159.1	1.8	111.3
849	D	34.6	Very low	34.2	Very low	120 Å²	120	133.7 Å²	133.7	64%	0.642	79%	0.79	S	S	*	*			trans	43.1	144.4	138.4	-58.8	-15.7	0	0	0	121.7
850	M	31.7	Very low	34.1	Very low	147 Å²	147	136 Å²	136	72%	0.724	79%	0.788	S	S	*	*			cis	-168.7	161.1	3.7	-106.7	-102.6	-165.2	0	0	109.7
851	I	34.1	Very low	34	Very low	157 Å²	157	142.9 Å²	142.9	81%	0.805	79%	0.792	S	S	*	*			trans	54.6	111.6	157.4	-57.6	156.4	0	0	0	116.4
852	G	29.4	Very low	33.8	Very low	79 Å²	79	138.3 Å²	138.3	81%	0.814	79%	0.786	S	S	*	*				112.1	114.8	50.5	0	0	0	0	0	111.2
853	G	31.8	Very low	33.9	Very low	78 Å²	78	141 Å²	141	80%	0.804	78%	0.779	S	S	*	*			trans	160.9	125.7	173.2	0	0	0	0	0	114.3
854	F	33.1	Very low	34	Very low	211 Å²	211	147.7 Å²	147.7	93%	0.925	78%	0.782	S	S	*	*			trans	-86.3	153.5	165.9	-79.8	-93.4	0	0	0	109.8
855	P	37.9	Very low	33.7	Very low	115 Å²	115	146.7 Å²	146.7	75%	0.747	78%	0.782	S	S	*	*				-134.7	-176.2	100.7	38.5	-28.7	0	0	0	113.7
856	D	32.9	Very low	33.5	Very low	159 Å²	159	140.8 Å²	140.8	85%	0.85	78%	0.775	S	S	*	*			trans	-54	150.9	157.6	-75.3	-68.2	0	0	0	110.5
857	D	36.4	Very low	33.3	Very low	161 Å²	161	140 Å²	140	86%	0.861	78%	0.777	S	S	*	*			trans	-143.9	152.6	151.1	-135.4	-27	0	0	0	112.8
858	S	30.9	Very low	33.1	Very low	88 Å²	88	143.6 Å²	143.6	62%	0.615	79%	0.79	S	S	*	*			trans	-129.8	158.5	-175.6	67.9	0	0	0	0	110.6
859	Q	31.5	Very low	32.9	Very low	169 Å²	169	137.6 Å²	137.6	79%	0.79	79%	0.788	S	S	*	*			trans	82.4	162.5	176.2	-44.4	-171	17.3	0	0	117.7
860	Q	31.6	Very low	33	Very low	161 Å²	161	141.2 Å²	141.2	75%	0.752	79%	0.794	S	S	*	*			trans	63.7	93.3	165.6	-57.6	-172	28.2	0	0	117.9
861	Y	31.2	Very low	33	Very low	225 Å²	225	143.2 Å²	143.2	88%	0.882	80%	0.801	S	S	*	*				-129.8	98.3	119.8	-114.8	-84.2	0	0	0	109.9
862	N	30.3	Very low	33.1	Very low	158 Å²	158	143.2 Å²	143.2	85%	0.845	80%	0.803	S	S	*	*			trans	-100.1	111.6	165.9	-103.4	-6.8	0	0	0	107.3
863	M	33.8	Very low	33.6	Very low	135 Å²	135	145.4 Å²	145.4	67%	0.665	80%	0.803	S	S	*	*			trans	-157.1	143	161.5	-117.6	172.9	76.9	0	0	112.4
864	Y	37.8	Very low	33.8	Very low	216 Å²	216	146.5 Å²	146.5	85%	0.847	80%	0.804	S	S	*	*			trans	73.7	110.4	-176.2	-59.3	-71	0	0	0	117.4
865	G	30	Very low	33.8	Very low	85 Å²	85	144.7 Å²	144.7	88%	0.876	80%	0.799	S	S	*	*			trans	-139.5	172.2	158.9	0	0	0	0	0	109.6
866	G	31.1	Very low	33.6	Very low	74 Å²	74	148.1 Å²	148.1	76%	0.763	81%	0.805	S	S	*	*			trans	169.1	144.2	176.1	0	0	0	0	0	112.3
867	A	35.6	Very low	33.5	Very low	90 Å²	90	148.5 Å²	148.5	74%	0.744	80%	0.801	S	S	*	*			trans	61.2	112.4	-174.9	0	0	0	0	0	114.8
868	E	34	Very low	33.6	Very low	197 Å²	197	151.4 Å²	151.4	92%	0.921	80%	0.802	S	S	*	*				69.1	125	69.9	-67.4	173.6	-162.1	0	0	113.3
869	G	30.7	Very low	33.8	Very low	65 Å²	65	153 Å²	153	67%	0.67	81%	0.81	S	S	*	*			cis	154.5	125.5	-8.8	0	0	0	0	0	112.6
870	Y	36.8	Very low	34.1	Very low	196 Å²	196	148.1 Å²	148.1	77%	0.769	81%	0.805	S	S	*	*			trans	-148.9	158.9	168.8	-91.6	-75.7	0	0	0	111	Q1272	Y870-Q1272 PolarHBondContact OH-NE2 2.91Å; Y870-Q1272 PolarHBondContact OH-OE1 3.26Å
871	Q	33.3	Very low	35.1	Very low	188 Å²	188	146 Å²	146	88%	0.879	81%	0.805	S	S	*	*			trans	-113.7	161.8	-168.1	-68.5	154.5	-82	0	0	112.6
872	N	36	Very low	35.4	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	80%	0.797	S	S	*	*			trans	-66.9	171.9	-178.5	-53.8	-35.2	0	0	0	113
873	P	39.6	Very low	35.5	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	80%	0.799	S	S	*	*				-142.7	-177.5	95	40.8	-28.1	0	0	0	115.3
874	A	36.2	Very low	35.6	Very low	101 Å²	101	141 Å²	141	84%	0.835	80%	0.803	S	S	*	*			trans	76.7	103.4	169.6	0	0	0	0	0	117.7
875	E	31.9	Very low	35.7	Very low	173 Å²	173	137.3 Å²	137.3	81%	0.808	80%	0.797	S	S	*	*			trans	-88.8	147.8	158.9	-62.1	163.4	92.9	0	0	109.5
876	E	35	Very low	35.7	Very low	188 Å²	188	144.7 Å²	144.7	88%	0.879	80%	0.8	S	S	*	*			trans	-140.2	134.8	154.6	-131.2	174.5	-151.2	0	0	109.2
877	Q	30.9	Very low	35.8	Very low	167 Å²	167	151.2 Å²	151.2	78%	0.78	80%	0.802	S	S	*	*			trans	-103.5	128.8	-166	-66.1	174.4	-9.6	0	0	111.2
878	Y	37.9	Very low	35.8	Very low	222 Å²	222	154.4 Å²	154.4	87%	0.871	81%	0.806	S	S	*	*			trans	-119	132.1	163.2	-93.5	-88.9	0	0	0	110.3
879	P	35.7	Very low	35.7	Very low	122 Å²	122	153.7 Å²	153.7	79%	0.792	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78.9	129.2	-172.4	30.5	-34.5	0	0	0	112.1
880	G	36.8	Very low	35.7	Very low	66 Å²	66	157.2 Å²	157.2	68%	0.68	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-78	146.3	164	0	0	0	0	0	111.2
881	P	53.4	Low	35.6	Very low	116 Å²	116	156.2 Å²	156.2	75%	0.753	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.2	146.3	173.7	29.9	-34.6	0	0	0	111.2	N883	P881-N883 PolarHBondContact O-N 3.18Å
882	P	36.8	Very low	35.5	Very low	109 Å²	109	151.1 Å²	151.1	71%	0.708	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-71.9	127.7	178.5	28.9	-33.6	0	0	0	111.6
883	N	32	Very low	35.4	Very low	165 Å²	165	147.3 Å²	147.3	88%	0.882	78%	0.784	S	S	*	*			trans	-96.4	97.7	163	-86	-57.1	0	0	0	108.4	P881	P881-N883 PolarHBondContact O-N 3.18Å
884	D	36.8	Very low	35.5	Very low	140 Å²	140	148 Å²	148	75%	0.749	79%	0.789	S	S	*	*			trans	-108.4	132.5	176.5	-79.3	-46.1	0	0	0	113.6
885	D	38.9	Very low	35.4	Very low	137 Å²	137	146.6 Å²	146.6	73%	0.733	79%	0.785	S	S	*	*			trans	55.2	72.2	155.2	-75	-31.6	0	0	0	121.6	R887	D885-R887 VanDerWaalsContact C-N 3.33Å; D885-R887 PolarHBondContact O-N 3.26Å
886	Y	30.5	Very low	36	Very low	241 Å²	241	143 Å²	143	95%	0.945	78%	0.776	S	S	*	*			trans	-75.1	80.1	138.8	-124.5	-79.4	0	0	0	111
887	R	33.4	Very low	36	Very low	211 Å²	211	144.1 Å²	144.1	80%	0.796	77%	0.774	S	S	*	*			trans	-149.9	142.2	171.3	-115.1	161.6	-164	179.2	5.6	117.4	D885	D885-R887 VanDerWaalsContact C-N 3.33Å; D885-R887 PolarHBondContact O-N 3.26Å
888	N	34.9	Very low	36.4	Very low	156 Å²	156	142.9 Å²	142.9	83%	0.834	77%	0.773	S	S	*	*			trans	71.8	110	165.9	-63.3	-23.5	0	0	0	120
889	R	31.9	Very low	36.4	Very low	182 Å²	182	135.5 Å²	135.5	69%	0.687	76%	0.757	S	S	*	*			trans	-68.3	150.1	158.1	-41.1	167.6	-159.1	170.4	8.3	109.4	D696	D696-R889 IonicContact OD1-CZ 2.71Å; D696-R889 IonicContact OD1-NH1 2.75Å; D696-R889 PolarHBondContact OD1-NH1 3.11Å
890	R	31.6	Very low	36.6	Very low	139 Å²	139	136.6 Å²	136.6	53%	0.525	76%	0.757	S	S	.	*				169.6	136.4	110.2	-92.6	-169.8	-174	-169.3	7.9	114	N697 S698	N697-R890 VanDerWaalsContact CG-NE 3.31Å; N697-R890 PolarHBondContact ND2-NE 2.99Å; N697-R890 PolarHBondContact OD1-NE 3.47Å; N697-R890 VanDerWaalsContact OD1-NE 3.15Å; N697-R890 PolarHBondContact OD1-NH2 2.88Å; S698-R890 PolarHBondContact OG-NH2 3.47Å
891	F	34.1	Very low	36.8	Very low	175 Å²	175	137.7 Å²	137.7	77%	0.768	76%	0.759	S	S	*	*			trans	33.7	136	150.6	-66.3	-88.5	0	0	0	121.8
892	G	31.2	Very low	36.2	Very low	82 Å²	82	139 Å²	139	85%	0.845	76%	0.759	S	S	*	*			trans	169.2	19.5	141.4	0	0	0	0	0	125.4
893	G	33.4	Very low	36.3	Very low	77 Å²	77	141 Å²	141	79%	0.794	76%	0.759	S	S	*	*			trans	80.6	-177.4	158.4	0	0	0	0	0	119
894	P	42.7	Very low	36.5	Very low	138 Å²	138	142.2 Å²	142.2	90%	0.896	76%	0.756	S	S	*	*			trans	-123.8	157.9	-156.4	40.5	-27.3	0	0	0	116.3
895	G	33.2	Very low	36.7	Very low	73 Å²	73	141.1 Å²	141.1	75%	0.753	76%	0.757	S	S	*	*			trans	-173.7	150	166.4	0	0	0	0	0	113.6
896	P	44.7	Very low	36.5	Very low	96 Å²	96	139.9 Å²	139.9	62%	0.623	76%	0.759	S	S	*	*			trans	-120.2	-170.6	-164.2	14.3	12.4	0	0	0	114.5
897	Y	35.9	Very low	36.7	Very low	212 Å²	212	132.4 Å²	132.4	83%	0.831	76%	0.755	S	S	*	*			trans	83.6	148.3	164.2	-47.7	-56.7	0	0	0	116.7
898	N	38.9	Very low	36.5	Very low	142 Å²	142	126 Å²	126	76%	0.759	75%	0.754	S	S	*	*			cis	-172.8	165.2	-16.6	172.2	42.1	0	0	0	109.6
899	A	38.2	Very low	36.3	Very low	66 Å²	66	124.1 Å²	124.1	55%	0.545	75%	0.754	S	S	.	*			trans	67.5	153.9	155.8	0	0	0	0	0	118.4
900	N	39.5	Very low	36.2	Very low	146 Å²	146	126.2 Å²	126.2	78%	0.781	76%	0.763	S	S	*	*			cis	-154.7	155.6	-16.5	-97.9	-22.6	0	0	0	104.9
901	A	40.5	Very low	36.1	Very low	89 Å²	89	125 Å²	125	74%	0.736	78%	0.776	S	S	*	*				177.7	165.4	57	0	0	0	0	0	106
902	L	40.5	Very low	35.9	Very low	144 Å²	144	120.1 Å²	120.1	75%	0.754	77%	0.768	S	S	*	*			cis	-162.9	164.7	-9.9	-133.5	64.6	0	0	0	104
903	Q	39.8	Very low	35.7	Very low	151 Å²	151	125.8 Å²	125.8	71%	0.706	77%	0.765	S	S	*	*			cis	-152.9	160.4	-2.9	-146.7	167	-16.8	0	0	103.8
904	K	36.5	Very low	35.7	Very low	190 Å²	190	129.7 Å²	129.7	83%	0.826	76%	0.763	S	S	*	*			cis	66	148.8	33.7	-68.1	-177.4	-179.7	-179.5	0	112.6
905	P	39.7	Very low	35.1	Very low	116 Å²	116	134.8 Å²	134.8	75%	0.753	76%	0.764	S	S	*	*			cis	-114.2	-170.3	16.9	46.7	-35.4	0	0	0	112.3
906	S	35.1	Very low	35.2	Very low	112 Å²	112	135.3 Å²	135.3	78%	0.783	77%	0.77	S	S	*	*			cis	-162.6	145.9	-5.1	15.6	0	0	0	0	110.5
907	G	34.2	Very low	34.7	Very low	83 Å²	83	138.2 Å²	138.2	86%	0.856	78%	0.78	S	S	*	*			trans	76.3	155.5	155.4	0	0	0	0	0	117.6
908	G	29.7	Very low	35.5	Very low	76 Å²	76	133.1 Å²	133.1	78%	0.784	77%	0.773	S	S	*	*			cis	167.4	130.7	-10.5	0	0	0	0	0	115
909	S	32	Very low	36.1	Very low	118 Å²	118	130.8 Å²	130.8	83%	0.825	77%	0.765	S	S	*	*			trans	74.2	137.6	165.1	-156.2	0	0	0	0	120.1
910	Y	27.8	Very low	36.2	Very low	225 Å²	225	136.9 Å²	136.9	88%	0.882	78%	0.78	S	S	*	*			trans	-46.2	148.1	147.3	-60.6	-110.7	0	0	0	112.2
911	S	29.9	Very low	36.3	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	78%	0.781	S	S	*	*				-162.9	158.4	128.4	-170.5	0	0	0	0	110.9
912	A	29.4	Very low	36.3	Very low	71 Å²	71	134.8 Å²	134.8	59%	0.587	78%	0.783	S	S	*	*			trans	-77.7	178.9	155.5	0	0	0	0	0	110.8
913	Y	29.1	Very low	36.2	Very low	201 Å²	201	131.2 Å²	131.2	79%	0.788	78%	0.781	S	S	*	*			trans	83.5	103.7	173.3	-58.8	-81.7	0	0	0	118.6
914	Q	31.9	Very low	36.8	Very low	160 Å²	160	130.4 Å²	130.4	75%	0.748	79%	0.789	S	S	*	*				65.8	120.6	128.8	-64.4	-179.7	-4.2	0	0	121.9
915	R	30.9	Very low	37.2	Very low	245 Å²	245	125.9 Å²	125.9	93%	0.925	79%	0.787	S	S	*	*			trans	62.7	123.2	144.4	-61.4	179.4	175.4	-160.3	-1.2	118.9
916	G	33.9	Very low	37.5	Very low	84 Å²	84	122.9 Å²	122.9	87%	0.866	78%	0.778	S	S	*	*			trans	159.6	75.3	162.5	0	0	0	0	0	117.1
917	N	35.7	Very low	37.7	Very low	156 Å²	156	128.3 Å²	128.3	83%	0.834	78%	0.782	S	S	*	*			trans	-98.4	178.7	159.3	-134.3	8.6	0	0	0	107.3
918	P	52	Low	38.4	Very low	105 Å²	105	129.4 Å²	129.4	68%	0.682	77%	0.774	S	S	*	*			cis	-139.7	-119.3	6.1	31.1	-2	0	0	0	115.4
919	P	50.7	Low	38.9	Very low	94 Å²	94	133.4 Å²	133.4	61%	0.61	78%	0.778	S	S	*	*				-135.7	-153.3	-98.5	42.8	-22	0	0	0	117.1
920	F	41.4	Very low	39.4	Very low	194 Å²	194	132.2 Å²	132.2	85%	0.851	78%	0.775	S	S	*	*			trans	98.5	141.2	163	-72.3	-63.2	0	0	0	117.8
921	S	41.6	Very low	40.1	Very low	114 Å²	114	127.5 Å²	127.5	80%	0.797	77%	0.772	S	S	*	*			cis	-149	177.3	-4.9	59.6	0	0	0	0	109.3
922	G	41.1	Very low	40.6	Very low	76 Å²	76	125.4 Å²	125.4	78%	0.784	77%	0.769	S	S	*	*			cis	-168.1	-160.8	4.9	0	0	0	0	0	108.8
923	G	38.2	Very low	40.9	Very low	69 Å²	69	124.4 Å²	124.4	71%	0.711	77%	0.765	S	S	*	*			cis	132.4	146.7	-2.9	0	0	0	0	0	112.6
924	P	51	Low	41.2	Very low	134 Å²	134	116.2 Å²	116.2	87%	0.87	74%	0.742	S	S	*	*			cis	-77.1	-155.3	-12.9	38.7	-38.6	0	0	0	110.5
925	A	46.2	Very low	41.3	Very low	95 Å²	95	116.2 Å²	116.2	79%	0.785	74%	0.736	S	S	*	*			cis	-147.8	-176.7	2.7	0	0	0	0	0	108.8
926	G	46.5	Very low	41.4	Very low	54 Å²	54	107 Å²	107	56%	0.557	71%	0.705	S	S	*	*			cis	-167.9	177.6	4.9	0	0	0	0	0	111.2
927	Y	38.3	Very low	41.4	Very low	226 Å²	226	112.6 Å²	112.6	89%	0.886	70%	0.7	S	S	*	*			trans	-151.1	168.9	-157.7	-77.9	-70.8	0	0	0	112.6
928	P	48.9	Very low	41.1	Very low	105 Å²	105	108.2 Å²	108.2	68%	0.682	69%	0.692	S	S	*	*			cis	-145.4	172.6	24.5	44.7	-25.7	0	0	0	121.1
929	N	41.3	Very low	40	Very low	160 Å²	160	108.1 Å²	108.1	86%	0.856	69%	0.694	S	S	*	*			trans	87.7	146.9	150.3	-67.2	-14.6	0	0	0	122.9
930	A	41.4	Very low	39.3	Very low	94 Å²	94	109.9 Å²	109.9	78%	0.777	70%	0.697	S	S	*	*			trans	-142.1	-152.4	-171.4	0	0	0	0	0	107.9
931	P	43.9	Very low	39	Very low	125 Å²	125	105.9 Å²	105.9	81%	0.812	69%	0.691	S	S	*	*			cis	-142.8	169.4	3.6	43.2	-24	0	0	0	119.3
932	G	39	Very low	38.7	Very low	71 Å²	71	105.9 Å²	105.9	73%	0.732	69%	0.691	S	S	*	*			trans	83.4	140.5	144.9	0	0	0	0	0	119.6
933	G	37.2	Very low	38	Very low	50 Å²	50	111.9 Å²	111.9	52%	0.515	69%	0.691	S	S	.	*			cis	159.9	123.3	3.5	0	0	0	0	0	114.1	P60	P60-G933 WeakPolarHBondContact O-CA 3.07Å
934	G	34.1	Very low	37.6	Very low	29 Å²	29	111.6 Å²	111.6	30%	0.299	69%	0.688	S	S	.	*	S	Bend	trans	174.1	85.5	166.5	0	0	0	0	0	116.8	P60 H61	P60-G934 VanDerWaalsContact CG-N 3.33Å; H61-G934 WeakPolarHBondContact CE1-CA 3.44Å; H61-G934 PolarHBondContact CE1-N 2.99Å; H61-G934 PolarHBondContact CE1-O 3.06Å; H61-G934 PolarHBondContact ND1-O 2.93Å; H61-G934 PolarHBondContact NE2-N 2.87Å; H61-G934 VanDerWaalsContact NE2-N 3.12Å
935	Y	35	Very low	36.6	Very low	161 Å²	161	112.7 Å²	112.7	63%	0.631	69%	0.687	S	S	*	*			trans	47.7	135.4	176.8	-58.7	-92	0	0	0	121.7	E58 Q59 P60	E58-Y935 HydrophobicContact CB-CD1 4.02Å; Q59-Y935 HydrophobicContact CB-CD1 4.16Å; Q59-Y935 HydrophobicContact CB-CE1 4.1Å; Q59-Y935 HydrophobicContact CG-CD1 2.82Å; Q59-Y935 HydrophobicContact CG-CD2 3.92Å; Q59-Y935 HydrophobicContact CG-CE1 2.52Å; Q59-Y935 HydrophobicContact CG-CE2 3.65Å; Q59-Y935 HydrophobicContact CG-CG 3.52Å; Q59-Y935 PolarHBondContact NE2-OH 2.9Å; Q59-Y935 VanDerWaalsContact OE1-CD1 3.31Å; P60-Y935 VanDerWaalsContact CG-C 3.47Å; P60-Y935 WeakPolarHBondContact CG-O 3.43Å
936	N	31.3	Very low	36.1	Very low	52 Å²	52	112 Å²	112	28%	0.278	67%	0.674	S	S	.	*			trans	-102.8	178.2	-141.9	-147.6	-13.1	0	0	0	114.9	E58 Q59 P60 G938	E58-N936 HydrophobicContact CB-CB 3.8Å; E58-N936 PolarHBondContact OE2-N 3.26Å; Q59-N936 PolarHBondContact O-ND2 3.1Å; P60-N936 HydrophobicContact CB-CB 3.62Å; P60-N936 VanDerWaalsContact CB-OD1 3.3Å; P60-N936 WeakPolarHBondContact CB-OD1 3.16Å; P60-N936 HydrophobicContact CG-CB 4.49Å; N936-G938 PolarHBondContact O-N 3.03Å
937	R	35.1	Very low	35.5	Very low	201 Å²	201	118 Å²	118	76%	0.758	69%	0.693	S	S	*	*			trans	14	96	155.5	-71.6	155	-168.4	-153.6	2.8	115
938	G	28.8	Very low	35.1	Very low	63 Å²	63	111.8 Å²	111.8	65%	0.649	68%	0.683	S	S	*	*			cis	60.3	156.2	22.6	0	0	0	0	0	112.1	N936	N936-G938 PolarHBondContact O-N 3.03Å
939	S	29.8	Very low	34.2	Very low	104 Å²	104	110.9 Å²	110.9	73%	0.727	68%	0.684	S	S	*	*			trans	47	100.8	157	-49.5	0	0	0	0	117.3
940	L	36.5	Very low	33.8	Very low	131 Å²	131	108.7 Å²	108.7	69%	0.686	68%	0.682	S	S	*	*			cis	44.9	87.7	38.7	-118.1	-179.2	0	0	0	110.8	Y943	L940-Y943 HydrophobicContact CD2-CD2 3.77Å
941	P	34	Very low	33.4	Very low	110 Å²	110	109.7 Å²	109.7	71%	0.714	67%	0.674	S	S	*	*				-141.8	101.8	117.6	32.3	-16.5	0	0	0	112.6	Y943	P941-Y943 CarbonylContact C-O 3.36Å
942	S	34.9	Very low	32.7	Very low	113 Å²	113	114 Å²	114	79%	0.79	68%	0.675	S	S	*	*			trans	-170.8	79.7	155.8	-164.1	0	0	0	0	109.1
943	Y	27.3	Very low	32.7	Very low	202 Å²	202	115.2 Å²	115.2	79%	0.792	67%	0.67	S	S	*	*			cis	19.5	90.5	7.1	-68.9	-68.3	0	0	0	116.4	L940 P941	L940-Y943 HydrophobicContact CD2-CD2 3.77Å; P941-Y943 CarbonylContact C-O 3.36Å
944	G	30.1	Very low	32.8	Very low	63 Å²	63	120.1 Å²	120.1	65%	0.649	69%	0.685	S	S	*	*			cis	97	146.6	1.3	0	0	0	0	0	114.3
945	N	29.7	Very low	32.5	Very low	158 Å²	158	123.9 Å²	123.9	85%	0.845	71%	0.707	S	S	*	*			trans	-163	155.2	-179.1	-141.1	13.1	0	0	0	107.7
946	P	36	Very low	32.4	Very low	79 Å²	79	126.6 Å²	126.6	51%	0.513	72%	0.717	S	S	.	*				-127.5	118.4	-62.4	31.1	-17.7	0	0	0	112.8	S948	P946-S948 PolarHBondContact O-N 2.92Å
947	N	32.8	Very low	32.4	Very low	181 Å²	181	130.1 Å²	130.1	97%	0.968	74%	0.741	S	S	*	*	S	Bend	trans	-77.8	73.9	151.8	-83.2	8.8	0	0	0	108
948	S	30.9	Very low	32.1	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	74%	0.741	S	S	*	*			trans	-150.9	148.2	-179.2	-61.3	0	0	0	0	111.2	P946	P946-S948 PolarHBondContact O-N 2.92Å
949	A	28.9	Very low	32.3	Very low	85 Å²	85	128 Å²	128	70%	0.702	75%	0.747	S	S	*	*			trans	66.8	65.9	169.9	0	0	0	0	0	118.4
950	S	32.6	Very low	32.3	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	76%	0.758	S	S	*	*				-148.1	96.4	122.5	57.6	0	0	0	0	109.1
951	N	32.9	Very low	32	Very low	114 Å²	114	128.8 Å²	128.8	61%	0.61	75%	0.749	S	S	*	*				67.2	101.1	72.9	-58.6	-19	0	0	0	110.4
952	Y	30.5	Very low	31.8	Very low	216 Å²	216	130.4 Å²	130.4	85%	0.847	75%	0.752	S	S	*	*				77.4	140.6	89.9	-82.3	-66.2	0	0	0	113.2
953	P	38.1	Very low	31.7	Very low	96 Å²	96	133.5 Å²	133.5	62%	0.623	75%	0.751	S	S	*	*			cis	-126.9	159.7	-17.9	39.8	-26.2	0	0	0	113.6
954	N	38.9	Very low	32.2	Very low	154 Å²	154	129.4 Å²	129.4	82%	0.824	75%	0.747	S	S	*	*				-174.1	60.3	127.5	-97.5	-20.5	0	0	0	113
955	S	27.8	Very low	32.4	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	76%	0.756	S	S	*	*			trans	-111	79.9	151.9	60.6	0	0	0	0	108	T957	S955-T957 PolarHBondContact O-N 2.89Å
956	Y	33.8	Very low	33.1	Very low	217 Å²	217	131.3 Å²	131.3	85%	0.851	75%	0.749	S	S	*	*			trans	-78.8	101.3	167.7	-126.8	-78	0	0	0	108.4
957	T	32	Very low	33.2	Very low	126 Å²	126	132.9 Å²	132.9	77%	0.773	76%	0.761	S	S	*	*			trans	-76.9	151.8	165.5	43.7	0	0	0	0	109.6	S955	S955-T957 PolarHBondContact O-N 2.89Å
958	G	28.6	Very low	33.6	Very low	75 Å²	75	128.7 Å²	128.7	77%	0.773	75%	0.746	S	S	*	*			trans	120.7	124.9	-172.3	0	0	0	0	0	111
959	D	32.7	Very low	34.3	Very low	145 Å²	145	131.5 Å²	131.5	78%	0.775	75%	0.754	S	S	*	*			cis	-150.8	154.4	-3.3	-169.9	21.3	0	0	0	111.6	G961	D959-G961 PolarHBondContact O-N 2.85Å
960	Q	28.6	Very low	35	Very low	203 Å²	203	131.8 Å²	131.8	95%	0.949	75%	0.749	S	S	*	*			trans	-91.2	61.5	161.2	-72.2	-164.7	7	0	0	109.1
961	G	30	Very low	35.2	Very low	49 Å²	49	136 Å²	136	51%	0.505	75%	0.748	S	S	.	*			trans	-117.5	133	-176.9	0	0	0	0	0	112.1	D959	D959-G961 PolarHBondContact O-N 2.85Å
962	N	30.4	Very low	35.2	Very low	143 Å²	143	136 Å²	136	77%	0.765	76%	0.757	S	S	*	*			trans	-62.9	173	-177.9	-81.9	-39.7	0	0	0	115
963	F	34.1	Very low	35.4	Very low	178 Å²	178	129.5 Å²	129.5	78%	0.781	76%	0.756	S	S	*	*			trans	110.2	88.6	152.3	-59	-70.8	0	0	0	119.3
964	T	36	Very low	35.1	Very low	116 Å²	116	128.8 Å²	128.8	71%	0.712	77%	0.766	S	S	*	*				62.2	109.6	128.5	55.5	0	0	0	0	122
965	N	36.1	Very low	34.8	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	77%	0.774	S	S	*	*				52	158.1	119	-80.2	1.1	0	0	0	122.5
966	P	42.8	Very low	35.2	Very low	108 Å²	108	131 Å²	131	70%	0.701	78%	0.78	S	S	*	*			cis	-143.9	154.2	-36.3	38.9	-21.8	0	0	0	115.7
967	S	38.5	Very low	35.2	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	78%	0.776	S	S	*	*			trans	173.3	116	148.9	-85.8	0	0	0	0	109
968	S	41.6	Very low	35.3	Very low	93 Å²	93	125.9 Å²	125.9	65%	0.65	77%	0.771	S	S	*	*				68	126.2	79.7	70.7	0	0	0	0	113.8
969	D	44.8	Very low	35.4	Very low	155 Å²	155	131.7 Å²	131.7	83%	0.829	77%	0.77	S	S	*	*			cis	-150.2	168.7	3.7	-100	-19.4	0	0	0	114
970	P	44.2	Very low	35.3	Very low	92 Å²	92	130.2 Å²	130.2	60%	0.597	77%	0.771	S	S	*	*			trans	-135.8	-144	-157	37.7	-14.1	0	0	0	114.5
971	Y	37.3	Very low	35.6	Very low	203 Å²	203	124.3 Å²	124.3	80%	0.796	76%	0.764	S	S	*	*			trans	75.9	143.4	174	-61.3	-71.5	0	0	0	117.7
972	S	32.9	Very low	35.6	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	78%	0.781	S	S	*	*	S	Bend	cis	75.1	52.4	10.2	-164.3	0	0	0	0	118.2
973	G	33.2	Very low	36.2	Very low	80 Å²	80	131.9 Å²	131.9	83%	0.825	78%	0.783	S	S	*	*			trans	90.6	137.6	149.5	0	0	0	0	0	117.1
974	G	33	Very low	36.2	Very low	81 Å²	81	126.5 Å²	126.5	84%	0.835	78%	0.778	S	S	*	*			trans	-176.9	127.7	173.3	0	0	0	0	0	111
975	M	33.3	Very low	36.1	Very low	202 Å²	202	128.4 Å²	128.4	100%	0.995	78%	0.78	S	S	*	*			trans	-94.6	128.5	170	-68.5	-175.7	179.1	0	0	109.4
976	A	34.9	Very low	36.1	Very low	106 Å²	106	125.6 Å²	125.6	88%	0.876	76%	0.762	S	S	*	*			trans	-143.5	123.3	163.6	0	0	0	0	0	109.5
977	S	34.9	Very low	35.7	Very low	109 Å²	109	125.6 Å²	125.6	76%	0.762	75%	0.753	S	S	*	*			trans	-123.2	97.9	177.9	60.2	0	0	0	0	109.9
978	D	33.6	Very low	35.5	Very low	126 Å²	126	124.1 Å²	124.1	67%	0.674	74%	0.736	S	S	*	*			trans	-180	154.6	170.6	-101.7	-20.6	0	0	0	108.6
979	R	30.4	Very low	35.1	Very low	198 Å²	198	124.4 Å²	124.4	75%	0.747	74%	0.738	S	S	*	*			cis	-157.8	172.1	-16.4	-155.3	174.4	-81.5	179.5	4.6	107.7
980	S	30.9	Very low	34.6	Very low	113 Å²	113	120.9 Å²	120.9	79%	0.79	74%	0.738	S	S	*	*			trans	31.7	122.6	151.1	55.3	0	0	0	0	121.4
981	G	33.9	Very low	34	Very low	79 Å²	79	120 Å²	120	81%	0.814	75%	0.746	S	S	*	*			trans	167.2	76.7	161.5	0	0	0	0	0	116
982	R	31.5	Very low	34.2	Very low	229 Å²	229	115.4 Å²	115.4	86%	0.864	74%	0.742	S	S	*	*			trans	-137.6	96.9	168.2	-170.1	-165	-169.7	-143.7	2.9	112.6
983	P	43	Very low	34.4	Very low	122 Å²	122	120 Å²	120	79%	0.792	75%	0.747	S	S	*	*			trans	-91.2	163.6	145.7	35.6	-28.7	0	0	0	110.7
984	G	33.1	Very low	34.5	Very low	65 Å²	65	119.6 Å²	119.6	67%	0.67	74%	0.744	S	S	*	*			cis	161	80.2	-13.6	0	0	0	0	0	115.7
985	M	33.6	Very low	34.6	Very low	156 Å²	156	119.7 Å²	119.7	77%	0.768	75%	0.745	S	S	*	*			trans	70.9	162.4	165.2	-50.4	175.3	68.9	0	0	114.4
986	Q	35.8	Very low	35	Very low	96 Å²	96	115 Å²	115	45%	0.449	73%	0.731	S	S	.	*			cis	-118.2	-124.3	10.1	-60.8	168.5	30.2	0	0	114.2	D106	D106-Q986 HydrophobicContact CB-CB 4.4Å; D106-Q986 WeakPolarHBondContact O-CB 3.42Å; D106-Q986 PolarHBondContact O-OE1 3.15Å; D106-Q986 VanDerWaalsContact OD1-CA 3.23Å; D106-Q986 WeakPolarHBondContact OD1-CA 3.05Å; D106-Q986 PolarHBondContact OD1-N 3.37Å; D106-Q986 VanDerWaalsContact OD1-N 3.09Å; D106-Q986 WeakPolarHBondContact OD2-CB 3.47Å; D106-Q986 PolarHBondContact OD2-N 2.83Å; D106-Q986 VanDerWaalsContact OD2-N 3.09Å
987	Q	34.3	Very low	35.3	Very low	107 Å²	107	116.9 Å²	116.9	50%	0.5	72%	0.722	S	S	.	*			trans	-123.7	-69.6	-151.5	163	-160.5	116.6	0	0	125.5	D106 Q107 H108	D106-Q987 PolarHBondContact O-N 3.15Å; D106-Q987 PolarHBondContact OD1-N 3.35Å; Q107-Q987 CarbonylContact O-C 3.59Å; Q107-Q987 WeakPolarHBondContact O-CA 3.49Å; Q107-Q987 WeakPolarHBondContact O-CG 3.46Å; H108-Q987 VanDerWaalsContact ND1-CD 3.33Å; H108-Q987 PolarHBondContact ND1-OE1 2.87Å
988	N	35.1	Very low	35.5	Very low	80 Å²	80	115.2 Å²	115.2	43%	0.428	72%	0.715	S	S	.	*			trans	-64	166.6	-138.3	-111.2	13.8	0	0	0	117.7	G105 D106 Q107	G105-N988 VanDerWaalsContact O-CB 3.25Å; G105-N988 WeakPolarHBondContact O-CB 3.42Å; D106-N988 VanDerWaalsContact C-N 3.28Å; Q107-N988 VanDerWaalsContact C-OD1 3.28Å; Q107-N988 WeakPolarHBondContact O-CA 3.28Å; Q107-N988 PolarHBondContact O-N 3Å; Q107-N988 PolarHBondContact O-OD1 2.91Å
989	S	33.4	Very low	35.7	Very low	99 Å²	99	119 Å²	119	69%	0.692	72%	0.721	S	S	*	*			cis	93.2	116.4	9.5	131.3	0	0	0	0	120
990	G	33.5	Very low	35.9	Very low	81 Å²	81	112.8 Å²	112.8	84%	0.835	72%	0.719	S	S	*	*			trans	144.4	123	179.2	0	0	0	0	0	113
991	G	32.3	Very low	36.2	Very low	74 Å²	74	114 Å²	114	76%	0.763	72%	0.722	S	S	*	*			trans	-110.3	-148.7	169.9	0	0	0	0	0	111
992	P	42.2	Very low	36.3	Very low	107 Å²	107	114.6 Å²	114.6	70%	0.695	71%	0.713	S	S	*	*			cis	-140.7	-160.1	-1.2	30.6	-4.3	0	0	0	114.4
993	F	36.3	Very low	36.6	Very low	209 Å²	209	110.7 Å²	110.7	92%	0.917	71%	0.709	S	S	*	*			trans	70.3	148.9	173.6	-55.8	-75.9	0	0	0	117.3
994	G	35.8	Very low	36.7	Very low	73 Å²	73	110.2 Å²	110.2	75%	0.753	71%	0.706	S	S	*	*			cis	-156.6	153.4	-10	0	0	0	0	0	108.2
995	G	35.3	Very low	37	Very low	83 Å²	83	114.9 Å²	114.9	86%	0.856	72%	0.716	S	S	*	*				87.7	133.8	67.6	0	0	0	0	0	110.5
996	S	41.7	Very low	37.2	Very low	102 Å²	102	115.8 Å²	115.8	71%	0.713	72%	0.715	S	S	*	*			cis	-152.1	176.1	-6.7	43.2	0	0	0	0	107.1
997	H	40.1	Very low	37.1	Very low	147 Å²	147	117.6 Å²	117.6	68%	0.681	73%	0.733	S	S	*	*			cis	-132.3	178.5	19.5	-81.2	-88.5	0	0	0	109.9
998	A	39.5	Very low	37.1	Very low	74 Å²	74	117.1 Å²	117.1	61%	0.612	75%	0.748	S	S	*	*			cis	81.3	141.1	27.3	0	0	0	0	0	114.9
999	Y	37.6	Very low	37.2	Very low	206 Å²	206	122.1 Å²	122.1	81%	0.808	77%	0.771	S	S	*	*			cis	-122.6	170	6.7	-73.7	-94.9	0	0	0	110.2
1000	G	34.6	Very low	37.3	Very low	67 Å²	67	121.6 Å²	121.6	69%	0.691	77%	0.767	S	S	*	*			cis	93.6	137.8	33.8	0	0	0	0	0	109.8
1001	T	37.4	Very low	37.4	Very low	139 Å²	139	125.8 Å²	125.8	85%	0.853	77%	0.765	S	S	*	*			cis	-146.3	175.4	12.7	54.4	0	0	0	0	112.5
1002	S	35.4	Very low	37.4	Very low	90 Å²	90	127.8 Å²	127.8	63%	0.629	76%	0.758	S	S	*	*			trans	-84.6	165.4	163.9	51.3	0	0	0	0	111.8
1003	D	39.5	Very low	37.1	Very low	147 Å²	147	129.2 Å²	129.2	79%	0.786	76%	0.755	S	S	*	*				177.3	159.6	107.9	-86.8	-9.5	0	0	0	113
1004	P	43.4	Very low	37.2	Very low	113 Å²	113	126.9 Å²	126.9	73%	0.734	75%	0.747	S	S	*	*			trans	-106.5	153.7	177.2	38.6	-30.7	0	0	0	113.1
1005	D	40.6	Very low	37.1	Very low	163 Å²	163	128.8 Å²	128.8	87%	0.872	75%	0.749	S	S	*	*			trans	-154.8	176.3	147.4	-136.8	-28.4	0	0	0	114.6
1006	K	36.7	Very low	37.1	Very low	174 Å²	174	129.5 Å²	129.5	76%	0.757	74%	0.741	S	S	*	*			trans	-110.1	156.8	-165.1	-64.6	173.6	179.5	166.3	0	114.4
1007	T	33.5	Very low	36.8	Very low	135 Å²	135	130.5 Å²	130.5	83%	0.828	74%	0.743	S	S	*	*			trans	50.7	111.7	145.1	50.4	0	0	0	0	119.4
1008	A	35.9	Very low	36.3	Very low	97 Å²	97	130.5 Å²	130.5	80%	0.802	75%	0.748	S	S	*	*				-153.2	150.8	114.7	0	0	0	0	0	113.1
1009	M	35.6	Very low	35.8	Very low	185 Å²	185	131.2 Å²	131.2	91%	0.911	75%	0.748	S	S	*	*			trans	-11.5	152.1	143.6	-70.9	169.6	-173.3	0	0	117.6
1010	S	35.9	Very low	35.4	Very low	87 Å²	87	126.2 Å²	126.2	61%	0.608	74%	0.743	S	S	*	*			cis	-170.6	147.9	8.5	149.7	0	0	0	0	113.2
1011	Q	35.1	Very low	35.2	Very low	170 Å²	170	127.9 Å²	127.9	79%	0.794	75%	0.745	S	S	*	*			trans	67.1	132.7	149.5	-74.8	170	12.9	0	0	122.7
1012	N	34	Very low	34.9	Very low	115 Å²	115	129.1 Å²	129.1	62%	0.615	75%	0.745	S	S	*	*			trans	98.3	104.9	137.7	-77.8	31.9	0	0	0	122.9
1013	E	35.2	Very low	34.6	Very low	137 Å²	137	135.6 Å²	135.6	64%	0.64	76%	0.757	S	S	*	*				88	83.8	122.5	-68	171.3	-178.4	0	0	120.5
1014	H	37.5	Very low	34.2	Very low	160 Å²	160	132.9 Å²	132.9	74%	0.741	76%	0.755	S	S	*	*				113	126.1	108.4	-76	-11.2	0	0	0	119.2
1015	S	35.4	Very low	33.6	Very low	114 Å²	114	133 Å²	133	80%	0.797	76%	0.759	S	S	*	*			trans	60.1	137.8	157.1	52.8	0	0	0	0	119.8
1016	S	35.2	Very low	33.2	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	75%	0.751	S	S	*	*			cis	-168	128.1	-16	46	0	0	0	0	110.6
1017	T	34.1	Very low	32.9	Very low	123 Å²	123	125.2 Å²	125.2	76%	0.755	76%	0.756	S	S	*	*			trans	41.5	119.9	149.3	57.8	0	0	0	0	119.2
1018	D	30.1	Very low	32.7	Very low	146 Å²	146	122.6 Å²	122.6	78%	0.781	75%	0.748	S	S	*	*				50.5	156.2	64.3	-77.5	-47.5	0	0	0	115.4
1019	S	29.1	Very low	32.5	Very low	90 Å²	90	129.2 Å²	129.2	63%	0.629	75%	0.752	S	S	*	*			cis	-179.8	162.8	-32.6	-95.9	0	0	0	0	106.9
1020	S	28.4	Very low	32.1	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	75%	0.752	S	S	*	*			trans	17.7	124.4	154.1	63.5	0	0	0	0	122
1021	S	30.7	Very low	31.8	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	75%	0.754	S	S	*	*			trans	57.3	104.7	135	66	0	0	0	0	121.8
1022	L	31	Very low	31.6	Very low	165 Å²	165	129.9 Å²	129.9	86%	0.864	75%	0.75	S	S	*	*			trans	-143.1	134.5	146.9	-65.3	174.2	0	0	0	106.1
1023	Y	29.6	Very low	31.5	Very low	226 Å²	226	131.5 Å²	131.5	89%	0.886	76%	0.759	S	S	*	*			cis	71.2	61.5	11.5	-112.2	-57.9	0	0	0	117.1
1024	A	30.3	Very low	31.4	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	77%	0.767	S	S	*	*			trans	-168.9	156.4	163.6	0	0	0	0	0	108.8
1025	S	31.4	Very low	31.4	Very low	117 Å²	117	131 Å²	131	82%	0.818	77%	0.766	S	S	*	*			cis	-174.9	159.5	-18.5	54.5	0	0	0	0	109.5
1026	G	31.7	Very low	31.2	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	76%	0.757	S	S	*	*			trans	101.9	137.8	168.9	0	0	0	0	0	113.7
1027	A	30.7	Very low	31.1	Very low	103 Å²	103	128.9 Å²	128.9	85%	0.851	76%	0.756	S	S	*	*			cis	65.1	133	19.5	0	0	0	0	0	114.3
1028	A	30.6	Very low	31.1	Very low	81 Å²	81	129.5 Å²	129.5	67%	0.669	76%	0.76	S	S	*	*			cis	-168.4	177.4	-10.6	0	0	0	0	0	109.9
1029	R	30.8	Very low	31.2	Very low	235 Å²	235	129.7 Å²	129.7	89%	0.887	76%	0.761	S	S	*	*			trans	80.1	136.4	170.1	-54.3	169	-168.4	-167	2.3	112.6
1030	Y	28.3	Very low	31.4	Very low	231 Å²	231	133.2 Å²	133.2	91%	0.906	77%	0.771	S	S	*	*				66.3	141.9	59.7	-101.2	-81	0	0	0	113.5
1031	S	28.6	Very low	31.6	Very low	93 Å²	93	134 Å²	134	65%	0.65	77%	0.774	S	S	*	*			trans	83.2	85	169.7	-154.8	0	0	0	0	116.7
1032	D	30.1	Very low	31.8	Very low	133 Å²	133	135.3 Å²	135.3	71%	0.711	78%	0.78	S	S	*	*				76.1	157	121.7	-47.2	-40.5	0	0	0	122.8
1033	N	33.7	Very low	31.9	Very low	149 Å²	149	131 Å²	131	80%	0.797	78%	0.775	S	S	*	*			trans	71.7	82.3	156.5	-60.5	-24.7	0	0	0	119
1034	H	32.9	Very low	32.1	Very low	175 Å²	175	126.1 Å²	126.1	81%	0.81	77%	0.771	S	S	*	*				-0.9	137.4	102.8	-97.1	-62.1	0	0	0	115.3
1035	P	37	Very low	32.3	Very low	111 Å²	111	132.2 Å²	132.2	72%	0.721	78%	0.775	S	S	*	*				-140	133.7	86.3	41.3	-28.8	0	0	0	113.6
1036	S	31.5	Very low	32.3	Very low	86 Å²	86	134.4 Å²	134.4	60%	0.601	77%	0.772	S	S	*	*				76.4	103.8	109.1	75.6	0	0	0	0	113.8
1037	A	33.2	Very low	32.5	Very low	81 Å²	81	133.7 Å²	133.7	67%	0.669	76%	0.756	S	S	*	*				73.4	117.6	58.8	0	0	0	0	0	114.8
1038	T	34.1	Very low	32.6	Very low	137 Å²	137	140.2 Å²	140.2	84%	0.84	76%	0.759	S	S	*	*			trans	-166.2	90.6	151.1	4.5	0	0	0	0	106.4
1039	N	31.9	Very low	32.6	Very low	149 Å²	149	144 Å²	144	80%	0.797	76%	0.761	S	S	*	*				49.9	95.3	82.9	-70.3	-15.1	0	0	0	113.6
1040	I	33.1	Very low	32.6	Very low	164 Å²	164	138.7 Å²	138.7	84%	0.841	75%	0.75	S	S	*	*			trans	-127.6	139	154.7	-68.1	-176	0	0	0	106.8
1041	P	33.5	Very low	33.1	Very low	117 Å²	117	134.3 Å²	134.3	76%	0.76	75%	0.747	S	S	*	*			trans	-103.2	173.7	-146.1	-1	24	0	0	0	115.4
1042	P	34.5	Very low	33.2	Very low	131 Å²	131	137.6 Å²	137.6	85%	0.851	75%	0.75	S	S	*	*			trans	-86.8	142.4	-177.2	33.7	-35	0	0	0	115.3
1043	G	32.7	Very low	33.9	Very low	73 Å²	73	137.4 Å²	137.4	75%	0.753	76%	0.756	S	S	*	*			trans	83.1	174.2	164.4	0	0	0	0	0	116.6
1044	P	34.9	Very low	33.7	Very low	124 Å²	124	136.9 Å²	136.9	81%	0.805	75%	0.749	S	S	*	*			cis	-121.9	-173.1	2.4	42.2	-29	0	0	0	114.5
1045	R	33	Very low	33.8	Very low	217 Å²	217	134.3 Å²	134.3	82%	0.819	75%	0.746	S	S	*	*			trans	-63.2	147.1	174.8	-59.7	171.9	172.4	-176.8	-4	113.2
1046	Q	31.1	Very low	33.5	Very low	163 Å²	163	135.8 Å²	135.8	76%	0.762	75%	0.747	S	S	*	*				-167.7	160.9	121.3	-107.8	171.1	60.6	0	0	112.8
1047	S	37.6	Very low	33.5	Very low	55 Å²	55	137.3 Å²	137.3	39%	0.385	75%	0.753	S	S	.	*			trans	-100.9	143	-174.6	66.4	0	0	0	0	113.4	R800	R800-S1047 VanDerWaalsContact CZ-OG 3.31Å; R800-S1047 PolarHBondContact NH1-OG 2.95Å; R800-S1047 PolarHBondContact NH2-OG 2.71Å
1048	R	31.2	Very low	33.4	Very low	239 Å²	239	138.9 Å²	138.9	90%	0.902	76%	0.755	S	S	*	*			trans	-147.1	152.5	150.8	-88.5	-171.2	170.4	166.7	-3.1	108.6
1049	F	31.4	Very low	33.3	Very low	161 Å²	161	137.1 Å²	137.1	71%	0.706	75%	0.748	S	S	*	*			cis	-166.8	161	-30.7	-139.8	-96.6	0	0	0	104.5
1050	D	30.7	Very low	33.4	Very low	124 Å²	124	138.2 Å²	138.2	66%	0.663	75%	0.748	S	S	*	*			trans	-16.3	136.1	177.3	-44.3	-27.4	0	0	0	119.3
1051	T	38.5	Very low	33.4	Very low	139 Å²	139	135.8 Å²	135.8	85%	0.853	74%	0.741	S	S	*	*				-172.7	142.1	99.6	22.5	0	0	0	0	112.5
1052	K	31.4	Very low	33.5	Very low	161 Å²	161	135.5 Å²	135.5	70%	0.7	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-74.7	155.9	161	-72.3	165	157.4	-176.8	0	109.5	E1054	K1052-E1054 HydrophobicContact CB-CG 4.41Å; K1052-E1054 HydrophobicContact CD-CG 3.95Å; K1052-E1054 WeakPolarHBondContact CD-OE1 3.2Å; K1052-E1054 WeakPolarHBondContact CE-OE1 3.35Å; K1052-E1054 IonicContact NZ-OE1 2.64Å; K1052-E1054 PolarHBondContact NZ-OE1 2.95Å
1053	P	43.9	Very low	33.4	Very low	129 Å²	129	133.2 Å²	133.2	84%	0.838	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-103.4	118.4	132.9	31	-29.1	0	0	0	109.9
1054	E	29.8	Very low	33.3	Very low	139 Å²	139	139.6 Å²	139.6	65%	0.65	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-90.1	143.4	161.8	-69.9	168	166.1	0	0	109	K1052	K1052-E1054 HydrophobicContact CB-CG 4.41Å; K1052-E1054 HydrophobicContact CD-CG 3.95Å; K1052-E1054 WeakPolarHBondContact CD-OE1 3.2Å; K1052-E1054 WeakPolarHBondContact CE-OE1 3.35Å; K1052-E1054 IonicContact NZ-OE1 2.64Å; K1052-E1054 PolarHBondContact NZ-OE1 2.95Å
1055	T	36	Very low	33.2	Very low	121 Å²	121	138.9 Å²	138.9	74%	0.742	73%	0.726	S	S	*	*			trans	179.4	118.3	153	16.7	0	0	0	0	106.3
1056	N	30.3	Very low	33.1	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	72%	0.72	S	S	*	*				69.6	130.3	83.9	-68.5	-11.7	0	0	0	112.3
1057	T	30	Very low	33	Very low	119 Å²	119	135.1 Å²	135.1	73%	0.73	72%	0.722	S	S	*	*			cis	-160.5	174.4	11.2	-14.7	0	0	0	0	111.7
1058	T	32.8	Very low	32.6	Very low	114 Å²	114	136.7 Å²	136.7	70%	0.699	74%	0.738	S	S	*	*			trans	64.4	98.6	151.2	-55.5	0	0	0	0	116.7
1059	S	31	Very low	32.5	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	74%	0.739	S	S	*	*			cis	96.2	167.2	43.1	83.3	0	0	0	0	114.3
1060	Q	34.9	Very low	32.4	Very low	172 Å²	172	129.5 Å²	129.5	80%	0.804	74%	0.741	S	S	*	*			trans	76.5	133	-176.9	-62.3	-171	37.6	0	0	117.2
1061	T	33.1	Very low	32.3	Very low	113 Å²	113	129 Å²	129	69%	0.693	75%	0.747	S	S	*	*			cis	-164.8	151.8	-29.8	-4.3	0	0	0	0	109.8
1062	S	33.8	Very low	31.8	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	74%	0.74	S	S	*	*			trans	67.1	145.3	153.9	-61	0	0	0	0	118
1063	A	34	Very low	32	Very low	82 Å²	82	130.5 Å²	130.5	68%	0.678	75%	0.75	S	S	*	*			cis	-148.8	144	-3.6	0	0	0	0	0	111.2
1064	Y	29.8	Very low	31.7	Very low	208 Å²	208	130.3 Å²	130.3	82%	0.816	75%	0.748	S	S	*	*			trans	29.5	148.4	130.6	-61.6	-78	0	0	0	121.1
1065	N	32.1	Very low	31.8	Very low	108 Å²	108	127.1 Å²	127.1	58%	0.578	75%	0.753	S	S	*	*			cis	-153	159.2	27	-134	-24.3	0	0	0	114.1	Y1067	N1065-Y1067 HydrophobicContact CB-CE2 4.47Å; N1065-Y1067 VanDerWaalsContact CG-CE2 3.49Å; N1065-Y1067 WeakPolarHBondContact ND2-CE2 3.46Å; N1065-Y1067 WeakPolarHBondContact OD1-CE2 3.26Å
1066	S	31.1	Very low	31.7	Very low	100 Å²	100	124.8 Å²	124.8	70%	0.699	75%	0.753	S	S	*	*			trans	-127.2	113.1	177.7	59.3	0	0	0	0	111.7
1067	Y	28.9	Very low	31.8	Very low	202 Å²	202	127.3 Å²	127.3	79%	0.792	76%	0.758	S	S	*	*			trans	-153.8	159.2	171.7	-64.3	-63.2	0	0	0	108.4	N1065	N1065-Y1067 HydrophobicContact CB-CE2 4.47Å; N1065-Y1067 VanDerWaalsContact CG-CE2 3.49Å; N1065-Y1067 WeakPolarHBondContact ND2-CE2 3.46Å; N1065-Y1067 WeakPolarHBondContact OD1-CE2 3.26Å
1068	A	29.1	Very low	32.1	Very low	88 Å²	88	127.2 Å²	127.2	73%	0.727	76%	0.757	S	S	*	*			cis	-172.2	179	-25.5	0	0	0	0	0	106.1
1069	L	30.4	Very low	32.3	Very low	178 Å²	178	126 Å²	126	93%	0.932	75%	0.753	S	S	*	*	S	Bend	trans	-75.8	143.1	163.6	-73	89	0	0	0	110.5
1070	G	28.7	Very low	32.5	Very low	71 Å²	71	129.2 Å²	129.2	73%	0.732	76%	0.763	S	S	*	*			trans	109.7	129	147.5	0	0	0	0	0	117.8
1071	S	27.7	Very low	32.5	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	76%	0.76	S	S	*	*			trans	62.8	151.2	135.3	-154.9	0	0	0	0	122.2
1072	S	28.9	Very low	32.6	Very low	102 Å²	102	125.8 Å²	125.8	71%	0.713	76%	0.763	S	S	*	*			trans	82.2	109.1	150.8	-53.5	0	0	0	0	119.1
1073	Y	35.1	Very low	32.7	Very low	229 Å²	229	127.4 Å²	127.4	90%	0.898	76%	0.758	S	S	*	*			trans	-51.7	151.1	145.3	-76	-97.6	0	0	0	110.9
1074	P	38.5	Very low	32.7	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	77%	0.765	S	S	*	*				-133.3	167.9	98.9	38.1	-29.8	0	0	0	112.6
1075	G	32	Very low	33	Very low	73 Å²	73	126.4 Å²	126.4	75%	0.753	76%	0.757	S	S	*	*			cis	134.7	128.6	-1.3	0	0	0	0	0	112.3
1076	G	33.2	Very low	33	Very low	72 Å²	72	127 Å²	127	74%	0.742	77%	0.765	S	S	*	*			trans	110.8	137.7	-176.7	0	0	0	0	0	112.1
1077	F	32.8	Very low	33.1	Very low	193 Å²	193	129.9 Å²	129.9	85%	0.846	77%	0.771	S	S	*	*			cis	-137.7	135.5	14.4	-103.7	-103.5	0	0	0	112.9
1078	T	37	Very low	33.2	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.724	77%	0.772	S	S	*	*			trans	49.7	143.3	143.4	54.9	0	0	0	0	122.2
1079	S	36.9	Very low	33.7	Very low	87 Å²	87	129.3 Å²	129.3	61%	0.608	77%	0.77	S	S	*	*			cis	-176.4	147.1	-11.7	51.5	0	0	0	0	111.5
1080	N	34.4	Very low	33.6	Very low	167 Å²	167	125.1 Å²	125.1	89%	0.893	76%	0.755	S	S	*	*			trans	61	151.6	150.7	-56.9	-16.6	0	0	0	119.1
1081	G	35	Very low	33.6	Very low	73 Å²	73	129.1 Å²	129.1	75%	0.753	76%	0.76	S	S	*	*			trans	-174.9	-57.3	173.8	0	0	0	0	0	113.9
1082	N	35.4	Very low	34.4	Very low	141 Å²	141	129 Å²	129	75%	0.754	76%	0.756	S	S	*	*			trans	72.5	144.3	164.7	-132.7	-0.6	0	0	0	118.6
1083	Q	36.4	Very low	35	Very low	146 Å²	146	130.2 Å²	130.2	68%	0.682	76%	0.762	S	S	*	*			trans	70.6	99.1	150.9	-73.2	177.9	76	0	0	123.6
1084	K	34.1	Very low	34.9	Very low	189 Å²	189	123.1 Å²	123.1	82%	0.822	76%	0.759	S	S	*	*				85.4	143.3	102.5	-145.1	-178.4	-171.2	178.5	0	119.8
1085	A	34.3	Very low	34.7	Very low	79 Å²	79	120.5 Å²	120.5	65%	0.653	75%	0.754	S	S	*	*			trans	92.2	102.3	145.8	0	0	0	0	0	121.4
1086	T	32.3	Very low	35.4	Very low	121 Å²	121	122.9 Å²	122.9	74%	0.742	76%	0.756	S	S	*	*				82.8	120.3	105.8	-59.1	0	0	0	0	121.6
1087	I	34.6	Very low	35.3	Very low	160 Å²	160	130.9 Å²	130.9	82%	0.821	76%	0.764	S	S	*	*			trans	83.8	148.4	147.8	-80.3	169.1	0	0	0	120.5
1088	Q	31.4	Very low	35.6	Very low	173 Å²	173	127.4 Å²	127.4	81%	0.808	76%	0.764	S	S	*	*			trans	-88.4	-164	174.3	-47.1	169.1	-22	0	0	110
1089	P	38.2	Very low	35.5	Very low	105 Å²	105	125.4 Å²	125.4	68%	0.682	77%	0.767	S	S	*	*			cis	-121.4	-168.4	-29.8	27.5	-4.9	0	0	0	111.3
1090	S	28	Very low	35.3	Very low	90 Å²	90	133.3 Å²	133.3	63%	0.629	78%	0.783	S	S	*	*			trans	42.1	120.1	145.5	60.7	0	0	0	0	121.9
1091	N	28.7	Very low	35.4	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	78%	0.777	S	S	*	*				-176.9	159.6	121.2	-95.2	-36	0	0	0	115.2
1092	P	44.8	Very low	35.2	Very low	111 Å²	111	136.5 Å²	136.5	72%	0.721	78%	0.777	S	S	*	*			trans	-88.9	-161.4	169	41.2	-37.9	0	0	0	110.9
1093	P	42.8	Very low	35.3	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	77%	0.773	S	S	*	*			cis	-127.6	-168	-2.9	44.3	-27.3	0	0	0	113.6
1094	G	33.2	Very low	35.2	Very low	81 Å²	81	136.4 Å²	136.4	84%	0.835	77%	0.774	S	S	*	*			cis	132.2	84.1	-10.7	0	0	0	0	0	116.2
1095	G	33.7	Very low	35.4	Very low	70 Å²	70	133.4 Å²	133.4	72%	0.722	77%	0.771	S	S	*	*			trans	158	171.1	175.3	0	0	0	0	0	112
1096	P	45.4	Very low	35.2	Very low	122 Å²	122	132.5 Å²	132.5	79%	0.792	77%	0.769	S	S	*	*			cis	-93.6	163.9	2.3	41.6	-37.5	0	0	0	112.5
1097	R	32.6	Very low	35.8	Very low	240 Å²	240	132.9 Å²	132.9	91%	0.906	77%	0.774	S	S	*	*			cis	63.9	130.7	49.6	-70.1	-175.8	172.9	-167.9	-0.5	112.2
1098	S	38.1	Very low	36.5	Very low	121 Å²	121	130.8 Å²	130.8	85%	0.846	77%	0.77	S	S	*	*			cis	-166.9	176.3	25.5	49.1	0	0	0	0	112.6
1099	G	36.2	Very low	36.7	Very low	76 Å²	76	126.9 Å²	126.9	78%	0.784	77%	0.768	S	S	*	*			trans	90.1	115.1	170.5	0	0	0	0	0	115
1100	R	31.3	Very low	36.8	Very low	253 Å²	253	126.7 Å²	126.7	96%	0.955	77%	0.769	S	S	*	*			cis	89.2	64.7	-0.6	-145.4	-170.5	-157.2	-149.1	7.6	119.3
1101	S	36.4	Very low	37.5	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	77%	0.774	S	S	*	*			trans	-161.7	129.2	147.9	-166.3	0	0	0	0	107.5
1102	R	31.3	Very low	38.3	Very low	200 Å²	200	127.7 Å²	127.7	76%	0.755	77%	0.768	S	S	*	*			cis	91.7	130.2	34.9	-167	-167.1	-163.9	-174.9	6.3	111.7
1103	F	37.2	Very low	38.5	Very low	154 Å²	154	128.7 Å²	128.7	68%	0.675	77%	0.766	S	S	*	*			trans	72.7	146.9	-176.6	-51.5	-64.8	0	0	0	114.4
1104	D	34.5	Very low	38.7	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	76%	0.764	S	S	*	*			cis	-159.3	174.3	-17.1	-130.3	-33.3	0	0	0	112
1105	V	38.2	Very low	39.3	Very low	125 Å²	125	130.2 Å²	130.2	76%	0.758	76%	0.761	S	S	*	*			trans	52.6	129.5	147.2	171.2	0	0	0	0	120.7
1106	G	30.8	Very low	39.6	Very low	60 Å²	60	131.8 Å²	131.8	62%	0.619	77%	0.768	S	S	*	*			trans	-99.5	-142.4	162.5	0	0	0	0	0	112.4
1107	P	43.9	Very low	39.4	Very low	130 Å²	130	130 Å²	130	84%	0.844	76%	0.763	S	S	*	*			cis	-122.6	-100.4	-11.1	21.3	5.1	0	0	0	114.3
1108	P	49	Very low	39.7	Very low	115 Å²	115	124.8 Å²	124.8	75%	0.747	76%	0.761	S	S	*	*			trans	-129.1	-149.8	-141.3	42.7	-20.8	0	0	0	114.4
1109	A	36.6	Very low	39.8	Very low	92 Å²	92	125.8 Å²	125.8	76%	0.76	76%	0.761	S	S	*	*			trans	86.1	149.3	167.3	0	0	0	0	0	116.8
1110	S	40.4	Very low	39.8	Very low	101 Å²	101	130.8 Å²	130.8	71%	0.706	76%	0.764	S	S	*	*			cis	-176.8	145.7	-15.9	49.3	0	0	0	0	113.9
1111	Q	42.9	Very low	39.8	Very low	156 Å²	156	123.8 Å²	123.8	73%	0.729	75%	0.754	S	S	*	*			trans	63.4	-179.3	150.1	-65.3	-65.6	-9.4	0	0	116.4
1112	P	45.6	Very low	39.7	Very low	109 Å²	109	125.8 Å²	125.8	71%	0.708	76%	0.762	S	S	*	*			cis	-112.7	150.1	-9.2	1.8	24.5	0	0	0	115.1
1113	I	48.9	Very low	39.8	Very low	132 Å²	132	122.2 Å²	122.2	68%	0.677	76%	0.763	S	S	*	*				71.7	139.6	87.4	-63.2	174.9	0	0	0	113.2
1114	P	47	Very low	39.6	Very low	120 Å²	120	125.9 Å²	125.9	78%	0.779	77%	0.774	S	S	*	*			cis	-128.3	166	21.4	22.4	1.8	0	0	0	119.2
1115	P	45.6	Very low	39.6	Very low	120 Å²	120	126.6 Å²	126.6	78%	0.779	78%	0.777	S	S	*	*			trans	-116.3	164.4	171.7	41.8	-32.3	0	0	0	115.1
1116	A	40.6	Very low	39.9	Very low	103 Å²	103	126.3 Å²	126.3	85%	0.851	78%	0.778	S	S	*	*			trans	-172.9	158.6	153.4	0	0	0	0	0	110.6
1117	A	40.1	Very low	40.4	Very low	85 Å²	85	129.1 Å²	129.1	70%	0.702	79%	0.785	S	S	*	*			cis	-165.8	138.9	-36.1	0	0	0	0	0	107.8
1118	P	39.6	Very low	39.9	Very low	131 Å²	131	128.2 Å²	128.2	85%	0.851	78%	0.782	S	S	*	*			trans	-90.6	146.5	179.3	34.9	-33.5	0	0	0	112.8
1119	V	40.2	Very low	39.4	Very low	141 Å²	141	132.3 Å²	132.3	86%	0.855	79%	0.791	S	S	*	*			trans	-135.4	141.9	172.8	-177.7	0	0	0	0	110.1
1120	Q	36.1	Very low	39.2	Very low	181 Å²	181	133.3 Å²	133.3	85%	0.846	79%	0.792	S	S	*	*			trans	-98.5	164	-177.9	-67	177.1	-15.1	0	0	112.6
1121	S	31	Very low	39.3	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	80%	0.799	S	S	*	*			trans	-22.6	137.1	167.8	54.1	0	0	0	0	118.7
1122	T	35.3	Very low	39	Very low	149 Å²	149	135 Å²	135	91%	0.914	80%	0.803	S	S	*	*				-158.9	153.9	128.4	1.5	0	0	0	0	112.6
1123	T	32.3	Very low	38.4	Very low	125 Å²	125	139 Å²	139	77%	0.767	80%	0.804	S	S	*	*			trans	-85	144.1	-176.6	-49.7	0	0	0	0	112.4
1124	Y	33.7	Very low	37.8	Very low	231 Å²	231	138.7 Å²	138.7	91%	0.906	81%	0.811	S	S	*	*			trans	-165.6	132.8	139.2	-106.7	-71.1	0	0	0	112.8
1125	N	33.4	Very low	36.9	Very low	145 Å²	145	138.6 Å²	138.6	78%	0.775	80%	0.8	S	S	*	*			trans	-90.2	-174.8	156.4	-81.2	-29.2	0	0	0	108.2
1126	P	43.9	Very low	37.1	Very low	119 Å²	119	139.2 Å²	139.2	77%	0.773	80%	0.804	S	S	*	*			cis	-121.8	-144.9	-4.7	38.9	-16.4	0	0	0	108.6
1127	P	42.1	Very low	36.8	Very low	119 Å²	119	142.3 Å²	142.3	77%	0.773	80%	0.801	S	S	*	*			cis	-132.3	-179.7	-7.3	41.7	-22.9	0	0	0	116.7
1128	S	32.8	Very low	36.4	Very low	111 Å²	111	143.8 Å²	143.8	78%	0.776	80%	0.801	S	S	*	*			trans	-90.4	157.3	-179.9	45.8	0	0	0	0	114.2
1129	Q	39.6	Very low	36.2	Very low	202 Å²	202	146.6 Å²	146.6	94%	0.944	80%	0.803	S	S	*	*			trans	-155.2	159.1	155.7	-119	167.1	86.3	0	0	110.2
1130	S	33.1	Very low	35.9	Very low	112 Å²	112	148.5 Å²	148.5	78%	0.783	80%	0.803	S	S	*	*			trans	-129.9	140.2	-160.8	48.4	0	0	0	0	113.7
1131	V	41.7	Very low	35.9	Very low	139 Å²	139	146.4 Å²	146.4	84%	0.842	80%	0.802	S	S	*	*			trans	-141	111.1	169.6	-172.2	0	0	0	0	112.6
1132	N	36.4	Very low	36	Very low	153 Å²	153	146.2 Å²	146.2	82%	0.818	81%	0.807	S	S	*	*			trans	11.6	124.6	153.4	-59.1	-31.6	0	0	0	123.5
1133	R	32.6	Very low	36.1	Very low	193 Å²	193	145.9 Å²	145.9	73%	0.728	81%	0.805	S	S	*	*			trans	-2.6	149.4	130.2	-108.9	176	-177.1	-121.9	-5.4	118.7
1134	P	36.8	Very low	36.2	Very low	127 Å²	127	144.8 Å²	144.8	83%	0.825	80%	0.802	S	S	*	*				-138	167.7	81.9	39.3	-27.5	0	0	0	116.7
1135	Q	28.8	Very low	36.4	Very low	118 Å²	118	139.3 Å²	139.3	55%	0.551	79%	0.793	S	S	*	*			trans	-107.3	146.1	165.6	-62.5	179.3	-77.6	0	0	109.7
1136	P	48.3	Very low	36.5	Very low	132 Å²	132	141.2 Å²	141.2	86%	0.857	80%	0.797	S	S	*	*			trans	-85.7	132.8	155.9	32.8	-28.6	0	0	0	110.4
1137	Q	34.3	Very low	36	Very low	168 Å²	168	144.8 Å²	144.8	79%	0.785	80%	0.804	S	S	*	*			trans	-108.4	147.5	170.4	-91.7	-174.2	-28.3	0	0	110.7
1138	V	32.4	Very low	35.7	Very low	116 Å²	116	144 Å²	144	70%	0.703	81%	0.807	S	S	*	*			trans	37.6	113.8	146.3	-174.2	0	0	0	0	117.6
1139	Q	36.3	Very low	35.7	Very low	191 Å²	191	147.5 Å²	147.5	89%	0.893	81%	0.811	S	S	*	*			trans	-141	131.2	135.2	-127.2	160.8	22.9	0	0	111.3
1140	Q	33	Very low	35.5	Very low	181 Å²	181	143.9 Å²	143.9	85%	0.846	81%	0.805	S	S	*	*			trans	-95.3	128.7	173.6	-63.7	174.8	0.1	0	0	108.3
1141	T	36	Very low	35.5	Very low	136 Å²	136	147.7 Å²	147.7	83%	0.834	81%	0.811	S	S	*	*			trans	-139.1	119.9	164.1	43.4	0	0	0	0	108.3
1142	A	32.9	Very low	35.2	Very low	104 Å²	104	146.6 Å²	146.6	86%	0.86	81%	0.809	S	S	*	*			trans	-102.8	128.4	179.1	0	0	0	0	0	110.5
1143	T	38.7	Very low	35	Very low	141 Å²	141	148.4 Å²	148.4	87%	0.865	81%	0.806	S	S	*	*			trans	-138.7	138.6	163.5	43	0	0	0	0	109.2
1144	S	33.5	Very low	35	Very low	102 Å²	102	142.7 Å²	142.7	71%	0.713	81%	0.807	S	S	*	*			trans	-71.8	179.4	166.4	64.7	0	0	0	0	109.4
1145	T	37.4	Very low	34.9	Very low	116 Å²	116	147.3 Å²	147.3	71%	0.712	81%	0.809	S	S	*	*			cis	-161.8	171.4	29	-23.4	0	0	0	0	111.8
1146	Q	35.4	Very low	34.9	Very low	185 Å²	185	144.6 Å²	144.6	86%	0.864	81%	0.813	S	S	*	*			trans	84.3	135.2	157.1	-67.9	-179.5	55.8	0	0	120.5
1147	Q	33.8	Very low	34.2	Very low	195 Å²	195	149.7 Å²	149.7	91%	0.911	82%	0.817	S	S	*	*			trans	-71.4	153.8	-170.1	-62.4	149.6	-16.9	0	0	114.6
1148	A	35.2	Very low	34.2	Very low	101 Å²	101	146.6 Å²	146.6	84%	0.835	81%	0.814	S	S	*	*			trans	-146.9	149.3	149.4	0	0	0	0	0	109.9
1149	Q	33.1	Very low	34.3	Very low	186 Å²	186	147.4 Å²	147.4	87%	0.869	82%	0.819	S	S	*	*			trans	-105.9	158.4	179.5	-88.3	-163.9	3.7	0	0	112.3
1150	P	35.1	Very low	34.2	Very low	125 Å²	125	147.3 Å²	147.3	81%	0.812	82%	0.819	S	S	*	*			trans	-73.3	149.4	-179.2	31.4	-36.3	0	0	0	112.3
1151	Q	33.2	Very low	34.2	Very low	192 Å²	192	146.5 Å²	146.5	90%	0.897	82%	0.82	S	S	*	*			trans	-109.9	139.8	169.5	-69.9	-162.9	-16.6	0	0	111.5
1152	S	35.5	Very low	34.2	Very low	117 Å²	117	147 Å²	147	82%	0.818	82%	0.823	S	S	*	*			trans	-91.5	157.7	166.4	54.1	0	0	0	0	110.6
1153	Y	33.4	Very low	34.1	Very low	191 Å²	191	151.2 Å²	151.2	75%	0.749	82%	0.822	S	S	*	*			trans	-98.8	118.7	166.5	-85.8	-79.2	0	0	0	110.3
1154	G	32.3	Very low	33.9	Very low	72 Å²	72	152.2 Å²	152.2	74%	0.742	82%	0.821	S	S	*	*			trans	-136.7	137.8	164.3	0	0	0	0	0	108.5
1155	Y	33.3	Very low	34	Very low	225 Å²	225	154.3 Å²	154.3	88%	0.882	83%	0.825	S	S	*	*			trans	-109.3	123.7	-179.5	-94.8	-81.6	0	0	0	111.3
1156	G	30.4	Very low	33.8	Very low	61 Å²	61	152 Å²	152	63%	0.629	82%	0.824	S	S	*	*			trans	179.8	121.8	169.9	0	0	0	0	0	109.3
1157	Y	33.6	Very low	33.8	Very low	239 Å²	239	148.3 Å²	148.3	94%	0.937	82%	0.818	S	S	*	*			trans	-140.6	154.4	172	-94.1	-72.1	0	0	0	110.9
1158	S	33.5	Very low	33.9	Very low	103 Å²	103	144 Å²	144	72%	0.72	81%	0.81	S	S	*	*			trans	-109.6	162.3	-154.6	52	0	0	0	0	114.2
1159	T	34.3	Very low	33.8	Very low	133 Å²	133	145.3 Å²	145.3	82%	0.816	80%	0.803	S	S	*	*			trans	-68.1	150.9	166.7	42.4	0	0	0	0	112.1
1160	Q	34.5	Very low	33.9	Very low	189 Å²	189	143.2 Å²	143.2	88%	0.883	79%	0.793	S	S	*	*			trans	-136.1	137.3	153.5	-74.4	-166.3	-6.9	0	0	109
1161	N	32.5	Very low	33.9	Very low	163 Å²	163	144 Å²	144	87%	0.872	79%	0.79	S	S	*	*			trans	-106.8	138.1	169.5	-85.7	-26.3	0	0	0	108.8
1162	T	36.8	Very low	34	Very low	147 Å²	147	139.5 Å²	139.5	90%	0.902	79%	0.786	S	S	*	*			trans	-134.1	146.5	154.3	28.1	0	0	0	0	109.3
1163	K	30.2	Very low	34.1	Very low	193 Å²	193	139.5 Å²	139.5	84%	0.839	78%	0.784	S	S	*	*			trans	-79.3	158	-178.8	-57.8	174.6	179.8	178	0	110.4
1164	L	35.2	Very low	34.3	Very low	161 Å²	161	136.5 Å²	136.5	84%	0.843	79%	0.788	S	S	*	*				-157.8	154.8	122.9	-106.3	164.5	0	0	0	111.1
1165	D	34.4	Very low	34.5	Very low	147 Å²	147	139.5 Å²	139.5	79%	0.786	79%	0.791	S	S	*	*			trans	-67.5	176.8	-167.1	-45.3	-53.8	0	0	0	114.4
1166	G	33.8	Very low	34.6	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	78%	0.784	S	S	*	*			trans	172.3	0.8	170.2	0	0	0	0	0	123.3
1167	S	34.9	Very low	34.8	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	80%	0.796	S	S	*	*			trans	40.4	123.6	160.7	61.4	0	0	0	0	121.9
1168	S	35.9	Very low	34.8	Very low	106 Å²	106	132 Å²	132	74%	0.741	78%	0.776	S	S	*	*			trans	77.1	155.8	141.5	93	0	0	0	0	118.2
1169	N	33.3	Very low	34.7	Very low	127 Å²	127	138 Å²	138	68%	0.679	79%	0.785	S	S	*	*			cis	-159.2	157.7	-9.9	-130.3	-16.1	0	0	0	113.7
1170	Q	36.7	Very low	34.6	Very low	142 Å²	142	134.8 Å²	134.8	66%	0.664	78%	0.778	S	S	*	*			trans	70.8	128.7	142.6	-79.8	174.7	58.1	0	0	124.3
1171	N	34.4	Very low	34.4	Very low	141 Å²	141	129.6 Å²	129.6	75%	0.754	77%	0.767	S	S	*	*			trans	74.6	101	134.3	-55.9	-12.9	0	0	0	122.3
1172	A	34.8	Very low	34.4	Very low	99 Å²	99	132.1 Å²	132.1	82%	0.818	77%	0.766	S	S	*	*				-162.5	156.1	125.7	0	0	0	0	0	110.7
1173	P	38.1	Very low	34	Very low	117 Å²	117	131.8 Å²	131.8	76%	0.76	76%	0.759	S	S	*	*			trans	-100.7	165.2	-159.4	1.2	20.8	0	0	0	115.8
1174	P	37.2	Very low	34	Very low	128 Å²	128	133.6 Å²	133.6	83%	0.831	76%	0.762	S	S	*	*			trans	-82.9	146	176	34.2	-34.8	0	0	0	113.1
1175	V	37.1	Very low	33.9	Very low	135 Å²	135	129.6 Å²	129.6	82%	0.818	76%	0.76	S	S	*	*			trans	-137	131.3	167.2	179.5	0	0	0	0	109.9
1176	S	34.7	Very low	33.7	Very low	106 Å²	106	131 Å²	131	74%	0.741	76%	0.755	S	S	*	*			trans	-105.2	134.8	179.2	56.7	0	0	0	0	112.6
1177	Q	35.8	Very low	33.6	Very low	186 Å²	186	131.5 Å²	131.5	87%	0.869	76%	0.761	S	S	*	*			trans	-174.5	149.4	161.6	-104	157.8	84.1	0	0	108.2
1178	S	31.8	Very low	33.4	Very low	74 Å²	74	137.6 Å²	137.6	52%	0.517	77%	0.769	S	S	.	*			cis	-168.4	161.5	-23.7	-176.5	0	0	0	0	108.4
1179	Y	33.1	Very low	33.2	Very low	230 Å²	230	135.6 Å²	135.6	90%	0.902	77%	0.765	S	S	*	*			trans	66.1	137	175.5	-45.1	-79.9	0	0	0	115.7
1180	G	32.5	Very low	33.2	Very low	66 Å²	66	135.3 Å²	135.3	68%	0.68	77%	0.768	S	S	*	*			cis	-158.6	154.9	-9.9	0	0	0	0	0	107.8
1181	A	29.9	Very low	33	Very low	79 Å²	79	139.7 Å²	139.7	65%	0.653	78%	0.78	S	S	*	*				48.2	130.2	68.1	0	0	0	0	0	112.3
1182	Y	31.2	Very low	33	Very low	217 Å²	217	136.1 Å²	136.1	85%	0.851	78%	0.776	S	S	*	*			cis	-139.7	155.5	23.1	-59.5	-97.7	0	0	0	109.2
1183	N	30	Very low	33.1	Very low	139 Å²	139	136.2 Å²	136.2	74%	0.743	77%	0.771	S	S	*	*			cis	79.2	145.6	35.6	-155.4	23.5	0	0	0	115.7
1184	Y	30.1	Very low	33	Very low	231 Å²	231	138.8 Å²	138.8	91%	0.906	77%	0.773	S	S	*	*			trans	-58.1	154.9	-171.9	-75.4	-120.1	0	0	0	115.1
1185	G	33	Very low	32.9	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	77%	0.771	S	S	*	*			trans	172.1	124.5	155.7	0	0	0	0	0	116
1186	Y	28.5	Very low	32.9	Very low	176 Å²	176	136.9 Å²	136.9	69%	0.69	77%	0.77	S	S	*	*			trans	-81.7	144.1	153.9	-88.3	-98.5	0	0	0	108.7	G1273 A1274	Y1186-G1273 VanDerWaalsContact OH-C 3.29Å; Y1186-G1273 WeakPolarHBondContact OH-CA 3.31Å; Y1186-A1274 VanDerWaalsContact OH-C 3.23Å; Y1186-A1274 PolarHBondContact OH-N 3.29Å; Y1186-A1274 PolarHBondContact OH-O 3.09Å
1187	G	32.5	Very low	32.7	Very low	78 Å²	78	140.4 Å²	140.4	80%	0.804	77%	0.774	S	S	*	*			trans	-170.9	133.3	173.1	0	0	0	0	0	112.1
1188	Y	29.9	Very low	33	Very low	235 Å²	235	136.4 Å²	136.4	92%	0.922	76%	0.764	S	S	*	*			trans	-101.9	135.7	-173.6	-113.5	-100.6	0	0	0	112.5
1189	G	33.5	Very low	33.1	Very low	64 Å²	64	138 Å²	138	66%	0.66	78%	0.775	S	S	*	*			trans	74.5	172.6	155.4	0	0	0	0	0	117.9
1190	T	32.1	Very low	33.3	Very low	120 Å²	120	131.5 Å²	131.5	74%	0.736	77%	0.77	S	S	*	*			cis	-163.6	149.9	-8.5	-9.8	0	0	0	0	111.7
1191	Y	32.4	Very low	33.4	Very low	234 Å²	234	134.3 Å²	134.3	92%	0.918	77%	0.773	S	S	*	*			trans	62.3	153.7	166.9	-66.2	-70.2	0	0	0	118.5
1192	G	34.1	Very low	33.8	Very low	66 Å²	66	136.1 Å²	136.1	68%	0.68	78%	0.776	S	S	*	*			trans	-172.5	-35.6	-179.6	0	0	0	0	0	120.1
1193	S	37.5	Very low	33.7	Very low	101 Å²	101	132.6 Å²	132.6	71%	0.706	77%	0.772	S	S	*	*			trans	72	132.3	-178.3	87.4	0	0	0	0	115.8
1194	Q	36.5	Very low	33.8	Very low	172 Å²	172	136.9 Å²	136.9	80%	0.804	78%	0.778	S	S	*	*				83	139.5	106.7	-75.3	-174.9	54	0	0	114.6
1195	T	35.5	Very low	33.9	Very low	127 Å²	127	131.7 Å²	131.7	78%	0.779	77%	0.774	S	S	*	*			cis	-159.6	-177.4	0.2	0.7	0	0	0	0	112
1196	A	35.3	Very low	33.7	Very low	96 Å²	96	132.4 Å²	132.4	79%	0.793	77%	0.772	S	S	*	*			trans	82.3	85.5	153.6	0	0	0	0	0	120.3
1197	Q	30.8	Very low	34.2	Very low	180 Å²	180	129.1 Å²	129.1	84%	0.841	77%	0.773	S	S	*	*			trans	-71.2	-174.2	143.6	-78.5	-135.9	-15.4	0	0	111.9
1198	P	42.1	Very low	34.3	Very low	101 Å²	101	131 Å²	131	66%	0.656	77%	0.768	S	S	*	*				-133.7	-162.3	-50.4	38	-20.9	0	0	0	110.7
1199	S	34.5	Very low	34.5	Very low	107 Å²	107	126.6 Å²	126.6	75%	0.748	77%	0.766	S	S	*	*				147.5	149.1	126.7	-66.6	0	0	0	0	115.4
1200	A	37	Very low	34.7	Very low	95 Å²	95	127 Å²	127	79%	0.785	77%	0.77	S	S	*	*			trans	68.3	155.1	145.1	0	0	0	0	0	121.4
1201	T	35.5	Very low	34.9	Very low	124 Å²	124	128.2 Å²	128.2	76%	0.761	78%	0.778	S	S	*	*			cis	-162.5	170.2	-37.4	-55.2	0	0	0	0	106.9
1202	V	37	Very low	35	Very low	117 Å²	117	123 Å²	123	71%	0.709	77%	0.77	S	S	*	*			trans	78.8	93.1	159.1	-166.6	0	0	0	0	118.7
1203	N	30.4	Very low	35	Very low	143 Å²	143	128 Å²	128	77%	0.765	78%	0.776	S	S	*	*				36.1	144.2	114	-64.6	-34.6	0	0	0	123.6
1204	R	30.6	Very low	34.7	Very low	229 Å²	229	131.6 Å²	131.6	86%	0.864	78%	0.782	S	S	*	*			trans	106.2	120.3	144.1	-77.4	179.5	-155.7	175.4	8	120.8
1205	C	32.3	Very low	34.5	Very low	123 Å²	123	128.8 Å²	128.8	83%	0.831	78%	0.781	S	S	*	*			trans	77	130.2	135	-63	0	0	0	0	121.3
1206	A	29.8	Very low	34.3	Very low	93 Å²	93	129.7 Å²	129.7	77%	0.769	78%	0.78	S	S	*	*			trans	-85.3	-176.5	160.4	0	0	0	0	0	110.2
1207	P	39.4	Very low	34.2	Very low	107 Å²	107	135.1 Å²	135.1	70%	0.695	78%	0.782	S	S	*	*				-155.9	168.8	63.4	43.2	-21.6	0	0	0	119.6
1208	T	34.1	Very low	34.4	Very low	116 Å²	116	130.8 Å²	130.8	71%	0.712	78%	0.777	S	S	*	*			trans	56	122.7	142.1	51.4	0	0	0	0	125.4
1209	T	33.6	Very low	34.2	Very low	143 Å²	143	131.1 Å²	131.1	88%	0.877	78%	0.782	S	S	*	*			trans	75.3	117	132.6	56.3	0	0	0	0	123.5
1210	G	37.7	Very low	34.5	Very low	72 Å²	72	130.2 Å²	130.2	74%	0.742	78%	0.78	S	S	*	*			trans	167.7	162.2	164.8	0	0	0	0	0	110.7
1211	T	37.8	Very low	34.7	Very low	147 Å²	147	132 Å²	132	90%	0.902	78%	0.781	S	S	*	*			cis	-157.2	171.7	-11	-55.6	0	0	0	0	108.8
1212	T	32.7	Very low	34.9	Very low	124 Å²	124	129.9 Å²	129.9	76%	0.761	78%	0.776	S	S	*	*			trans	-94.7	168.5	-177	-35	0	0	0	0	114.5
1213	Q	35.7	Very low	35	Very low	170 Å²	170	129.7 Å²	129.7	79%	0.794	77%	0.772	S	S	*	*			trans	79.5	128.3	168.1	-59.2	-171.9	9.9	0	0	115.4
1214	Q	30.4	Very low	35.4	Very low	177 Å²	177	130.6 Å²	130.6	83%	0.827	77%	0.769	S	S	*	*				91.6	136.2	52.1	-88.2	-164.2	2.6	0	0	114.5
1215	S	32.7	Very low	35.9	Very low	113 Å²	113	124.2 Å²	124.2	79%	0.79	76%	0.757	S	S	*	*			trans	71	158	170.4	87.3	0	0	0	0	116.2
1216	L	30.8	Very low	36.1	Very low	146 Å²	146	126 Å²	126	76%	0.764	75%	0.753	S	S	*	*			cis	-164.1	-169.3	-18.6	-116.1	174.7	0	0	0	109.4
1217	Y	33.3	Very low	36.5	Very low	210 Å²	210	128 Å²	128	82%	0.824	75%	0.75	S	S	*	*			trans	76.7	122.1	173.4	-60.5	-89.3	0	0	0	115.4
1218	A	35.7	Very low	36.2	Very low	89 Å²	89	128.3 Å²	128.3	74%	0.736	75%	0.75	S	S	*	*				88.4	146.8	50.9	0	0	0	0	0	112.2
1219	S	38.3	Very low	36.4	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	75%	0.753	S	S	*	*			cis	-160.8	140.3	33.1	178.8	0	0	0	0	115.5
1220	A	40.1	Very low	36.4	Very low	87 Å²	87	131.5 Å²	131.5	72%	0.719	75%	0.747	S	S	*	*			trans	63.2	168.7	150.2	0	0	0	0	0	118.8
1221	V	41.1	Very low	36.3	Very low	132 Å²	132	134 Å²	134	80%	0.8	75%	0.748	S	S	*	*			cis	-138.8	126.4	12.9	179.5	0	0	0	0	111.7
1222	A	40.5	Very low	36.1	Very low	80 Å²	80	131.9 Å²	131.9	66%	0.661	75%	0.745	S	S	*	*			trans	37.3	158.6	136.2	0	0	0	0	0	122.5
1223	D	37.9	Very low	36.2	Very low	114 Å²	114	130.3 Å²	130.3	61%	0.61	75%	0.745	S	S	*	*			cis	-167.2	136.1	-13.1	-119	24.4	0	0	0	108.9
1224	K	38.1	Very low	36.5	Very low	162 Å²	162	128 Å²	128	70%	0.704	74%	0.744	S	S	*	*				76.9	163.1	94.2	-80.6	-157.6	-156.1	77.3	0	116.6
1225	P	43	Very low	36.6	Very low	94 Å²	94	123.5 Å²	123.5	61%	0.61	74%	0.738	S	S	*	*			cis	-154.8	-177.9	-38.1	45.6	-28.3	0	0	0	118.2
1226	Q	36.4	Very low	36.9	Very low	161 Å²	161	124.4 Å²	124.4	75%	0.752	74%	0.738	S	S	*	*			trans	60.9	166.5	152.8	-45	-153.2	5.3	0	0	119.7
1227	L	37	Very low	37.3	Very low	135 Å²	135	122.4 Å²	122.4	71%	0.707	74%	0.736	S	S	*	*			cis	-119.7	146.6	-16.8	-85.9	95.4	0	0	0	107.9
1228	T	34.5	Very low	37.5	Very low	113 Å²	113	117.5 Å²	117.5	69%	0.693	73%	0.733	S	S	*	*				77.5	132.6	62.2	-30.4	0	0	0	0	115.9
1229	Q	37.1	Very low	37.6	Very low	168 Å²	168	117.3 Å²	117.3	79%	0.785	73%	0.732	S	S	*	*			trans	75.7	152.3	170.4	-52.5	-167.4	36.6	0	0	117.9
1230	Q	34.7	Very low	37.5	Very low	158 Å²	158	118.7 Å²	118.7	74%	0.738	74%	0.735	S	S	*	*			cis	-163.5	164.9	-42.1	-138.1	176.7	16.4	0	0	110.4
1231	T	33.6	Very low	37.2	Very low	126 Å²	126	120 Å²	120	77%	0.773	74%	0.735	S	S	*	*			trans	64.8	138.4	157.7	52.5	0	0	0	0	123.4
1232	A	34.3	Very low	36.9	Very low	101 Å²	101	119.2 Å²	119.2	84%	0.835	73%	0.73	S	S	*	*			trans	73	96.6	141.4	0	0	0	0	0	123
1233	A	34.9	Very low	36.5	Very low	92 Å²	92	121.3 Å²	121.3	76%	0.76	74%	0.735	S	S	*	*			trans	-30.4	173.2	134.4	0	0	0	0	0	118.8
1234	P	42.2	Very low	36.2	Very low	120 Å²	120	120.1 Å²	120.1	78%	0.779	74%	0.741	S	S	*	*			cis	-142.2	-177.4	-11.2	34	-12.2	0	0	0	117.6
1235	A	33.6	Very low	36	Very low	84 Å²	84	119.4 Å²	119.4	69%	0.694	75%	0.75	S	S	*	*			trans	98.8	157.6	133.8	0	0	0	0	0	123.2
1236	V	39	Very low	35.5	Very low	132 Å²	132	119.6 Å²	119.6	80%	0.8	75%	0.754	S	S	*	*			trans	68.3	106.4	158.1	-75.2	0	0	0	0	123.5
1237	S	38.5	Very low	35.4	Very low	103 Å²	103	119.2 Å²	119.2	72%	0.72	76%	0.757	S	S	*	*				102.7	112.8	114.4	-67	0	0	0	0	123.3
1238	S	37.9	Very low	35.3	Very low	108 Å²	108	122 Å²	122	76%	0.755	77%	0.766	S	S	*	*				73.4	107.9	123.4	71.2	0	0	0	0	123.6
1239	A	36.7	Very low	35.3	Very low	85 Å²	85	122.3 Å²	122.3	70%	0.702	77%	0.773	S	S	*	*				91.4	146.9	110.8	0	0	0	0	0	122.6
1240	T	36.2	Very low	35.2	Very low	137 Å²	137	120.8 Å²	120.8	84%	0.84	78%	0.775	S	S	*	*			trans	64.5	150.1	161	40.5	0	0	0	0	119.5
1241	T	33.4	Very low	35.7	Very low	116 Å²	116	119.2 Å²	119.2	71%	0.712	78%	0.778	S	S	*	*			cis	179.6	176.4	-30.1	-94.6	0	0	0	0	106.8
1242	T	35.2	Very low	35.7	Very low	114 Å²	114	117.6 Å²	117.6	70%	0.699	78%	0.778	S	S	*	*			trans	82.1	101	158.3	19.8	0	0	0	0	120.7
1243	T	32	Very low	35.7	Very low	125 Å²	125	117.6 Å²	117.6	77%	0.767	78%	0.778	S	S	*	*				65.9	112.8	121.5	55	0	0	0	0	123.8
1244	A	31.5	Very low	35.6	Very low	88 Å²	88	117.9 Å²	117.9	73%	0.727	78%	0.781	S	S	*	*				92.5	176.1	109.4	0	0	0	0	0	121.6
1245	T	34.4	Very low	35.2	Very low	148 Å²	148	116.6 Å²	116.6	91%	0.908	78%	0.78	S	S	*	*			trans	75	143.7	-175.9	55.1	0	0	0	0	118.2
1246	S	33.1	Very low	35.3	Very low	97 Å²	97	123 Å²	123	68%	0.678	79%	0.787	S	S	*	*			trans	-91.1	172.3	-170.6	48.1	0	0	0	0	112.3
1247	D	33.8	Very low	35.1	Very low	154 Å²	154	120.4 Å²	120.4	82%	0.824	78%	0.78	S	S	*	*				-173.9	166.9	106.9	-89.6	-5.5	0	0	0	112.8
1248	H	34.5	Very low	34.9	Very low	193 Å²	193	119.6 Å²	119.6	89%	0.894	77%	0.774	S	S	*	*			trans	-94.3	139.5	-174.2	-72.9	-74.6	0	0	0	113.1
1249	S	35.4	Very low	34.7	Very low	119 Å²	119	123.5 Å²	123.5	83%	0.832	77%	0.774	S	S	*	*			trans	-154.6	120.1	151.2	63.9	0	0	0	0	112.7
1250	T	35.3	Very low	34.6	Very low	137 Å²	137	129 Å²	129	84%	0.84	78%	0.778	S	S	*	*			trans	-127.7	-174.6	169	51.9	0	0	0	0	108.1
1251	P	44.2	Very low	34.3	Very low	124 Å²	124	133.6 Å²	133.6	81%	0.805	78%	0.781	S	S	*	*				-127.4	172.1	-59.6	36.8	-22.9	0	0	0	113.3
1252	A	33	Very low	34.2	Very low	92 Å²	92	131.9 Å²	131.9	76%	0.76	79%	0.787	S	S	*	*			trans	-148.2	126.8	162.1	0	0	0	0	0	108
1253	A	34	Very low	34	Very low	102 Å²	102	131.1 Å²	131.1	84%	0.843	79%	0.793	S	S	*	*				73.4	133.6	65.4	0	0	0	0	0	112.7
1254	A	33.7	Very low	34.2	Very low	98 Å²	98	130.9 Å²	130.9	81%	0.81	79%	0.793	S	S	*	*			cis	-163.5	-158.1	-7.4	0	0	0	0	0	110.2
1255	A	34.6	Very low	34.3	Very low	92 Å²	92	135.2 Å²	135.2	76%	0.76	80%	0.798	S	S	*	*			trans	76.3	141.7	178.1	0	0	0	0	0	116.7
1256	Y	34.1	Very low	34.1	Very low	218 Å²	218	133.7 Å²	133.7	86%	0.855	79%	0.794	S	S	*	*			cis	-147.6	131.4	-5.8	-129.8	-134	0	0	0	106.3
1257	A	35.9	Very low	34.1	Very low	79 Å²	79	134.2 Å²	134.2	65%	0.653	80%	0.804	S	S	*	*				59.2	135.7	90.8	0	0	0	0	0	115.1
1258	S	34.3	Very low	33.9	Very low	85 Å²	85	134 Å²	134	59%	0.594	81%	0.808	S	S	*	*			cis	-177.3	170.2	2.3	39.4	0	0	0	0	112.8
1259	Y	33.2	Very low	33.8	Very low	190 Å²	190	128.6 Å²	128.6	75%	0.745	80%	0.804	S	S	*	*			trans	78.6	149.5	159.4	-55.1	-51.1	0	0	0	119.7
1260	Y	34.6	Very low	33.5	Very low	202 Å²	202	128.6 Å²	128.6	79%	0.792	81%	0.805	S	S	*	*			cis	-147.7	158.4	-10.6	-125.5	-58	0	0	0	111.3
1261	Y	30.4	Very low	33.6	Very low	232 Å²	232	129 Å²	129	91%	0.91	81%	0.807	S	S	*	*			trans	-68.2	153.9	169.4	-99.4	-109.3	0	0	0	113.9
1262	G	31.5	Very low	32.9	Very low	81 Å²	81	130 Å²	130	84%	0.835	80%	0.801	S	S	*	*			trans	166.1	126.5	156.7	0	0	0	0	0	116.2
1263	A	31.2	Very low	33	Very low	98 Å²	98	128.7 Å²	128.7	81%	0.81	80%	0.796	S	S	*	*			trans	-128.5	149.2	162.1	0	0	0	0	0	108.4
1264	P	36.2	Very low	33.1	Very low	120 Å²	120	127.5 Å²	127.5	78%	0.779	79%	0.787	S	S	*	*				-150.8	157.1	109.8	38.4	-22.2	0	0	0	117.1
1265	Q	32.1	Very low	33.4	Very low	179 Å²	179	124.5 Å²	124.5	84%	0.836	77%	0.765	S	S	*	*			trans	32.5	110.3	142.2	-62.4	-174.7	-4.5	0	0	121.9
1266	S	31.4	Very low	33.9	Very low	116 Å²	116	129.3 Å²	129.3	81%	0.811	77%	0.769	S	S	*	*			trans	51.3	112.3	130.7	64.7	0	0	0	0	121.9
1267	A	33.4	Very low	34.3	Very low	107 Å²	107	127.2 Å²	127.2	88%	0.884	76%	0.76	S	S	*	*			trans	-141	142	135.5	0	0	0	0	0	109.3
1268	T	29.7	Very low	35.1	Very low	150 Å²	150	128.1 Å²	128.1	92%	0.92	76%	0.755	S	S	*	*			trans	-98.1	132.9	-177.2	49	0	0	0	0	112.1
1269	G	30.9	Very low	36.2	Very low	79 Å²	79	127.2 Å²	127.2	81%	0.814	75%	0.752	S	S	*	*			trans	-162.1	106.6	171.4	0	0	0	0	0	111.5
1270	S	29.8	Very low	36.9	Very low	120 Å²	120	120.4 Å²	120.4	84%	0.839	74%	0.735	S	S	*	*			trans	-93	138.7	-177.6	47.4	0	0	0	0	112.6
1271	T	36.9	Very low	38.3	Very low	146 Å²	146	116.1 Å²	116.1	90%	0.896	72%	0.724	S	S	*	*			trans	-145.3	146.7	156.6	16.5	0	0	0	0	109.1
1272	Q	30.6	Very low	40	Very low	145 Å²	145	106.8 Å²	106.8	68%	0.678	70%	0.695	S	S	*	*			trans	-92.5	127.5	-165.5	-65	148.2	-53.3	0	0	112	Y870 A1274	Y870-Q1272 PolarHBondContact OH-NE2 2.91Å; Y870-Q1272 PolarHBondContact OH-OE1 3.26Å; Q1272-A1274 PolarHBondContact O-N 2.94Å
1273	G	35.7	Very low	41.6	Very low	63 Å²	63	105.5 Å²	105.5	65%	0.649	68%	0.676	S	S	*	*			trans	-81.8	67.2	179.3	0	0	0	0	0	114.3	Y1186 G1275	Y1186-G1273 VanDerWaalsContact OH-C 3.29Å; Y1186-G1273 WeakPolarHBondContact OH-CA 3.31Å; G1273-G1275 PolarHBondContact O-N 2.63Å
1274	A	35.2	Very low	43.3	Very low	78 Å²	78	103.2 Å²	103.2	65%	0.645	66%	0.657	S	S	*	*			trans	-69.3	112.9	166.2	0	0	0	0	0	109.3	Y1186 Q1272	Y1186-A1274 VanDerWaalsContact OH-C 3.23Å; Y1186-A1274 PolarHBondContact OH-N 3.29Å; Y1186-A1274 PolarHBondContact OH-O 3.09Å; Q1272-A1274 PolarHBondContact O-N 2.94Å
1275	G	40.1	Very low	44.8	Very low	35 Å²	35	103.2 Å²	103.2	36%	0.361	65%	0.647	S	S	.	*			trans	-174.1	-10	-177.6	0	0	0	0	0	116.8	G1273	G1273-G1275 PolarHBondContact O-N 2.63Å
1276	K	45.7	Very low	46.5	Very low	192 Å²	192	101.4 Å²	101.4	84%	0.835	64%	0.638	S	S	*	*	H	α-helix	trans	-83.5	-17	173.1	-69.6	-171.5	178.1	-177.3	0	114
1277	Y	41.2	Very low	48.1	Very low	174 Å²	174	101.3 Å²	101.3	68%	0.682	62%	0.623	S	S	*	*	H	α-helix	trans	-85.6	-37.7	176.4	-76.1	-86.5	0	0	0	111.8	A1279 A1280 M1281	Y1277-A1279 PolarHBondContact O-N 2.84Å; Y1277-A1280 PolarHBondContact O-N 3.44Å; Y1277-M1281 WeakPolarHBondContact O-CG 3.36Å; Y1277-M1281 PolarHBondContact O-N 3.31Å
1278	D	54.2	Low	49.7	Very low	99 Å²	99	100.5 Å²	100.5	53%	0.529	60%	0.604	S	S	.	*	H	α-helix	trans	-66.2	-37	-179.9	-54.5	-68.3	0	0	0	112.6	A1280 M1281 A1282	D1278-A1280 VanDerWaalsContact C-N 3.32Å; D1278-A1280 PolarHBondContact O-N 3.07Å; D1278-M1281 PolarHBondContact O-N 2.87Å; D1278-A1282 WeakPolarHBondContact O-CB 3.18Å; D1278-A1282 PolarHBondContact O-N 3.4Å
1279	A	55.3	Low	51.3	Low	65 Å²	65	95.4 Å²	95.4	54%	0.537	58%	0.577	S	S	.	*	H	α-helix	trans	-61.4	-39	173.2	0	0	0	0	0	112.6	Y1277 A1283	Y1277-A1279 PolarHBondContact O-N 2.84Å; A1279-A1283 WeakPolarHBondContact O-CB 3.31Å; A1279-A1283 PolarHBondContact O-N 3.02Å
1280	A	49.3	Very low	53.2	Low	48 Å²	48	98 Å²	98	40%	0.397	56%	0.563	S	S	.	*	H	α-helix	trans	-75.5	-36.4	177.5	0	0	0	0	0	112.5	Y1277 D1278 A1284	Y1277-A1280 PolarHBondContact O-N 3.44Å; D1278-A1280 VanDerWaalsContact C-N 3.32Å; D1278-A1280 PolarHBondContact O-N 3.07Å; A1280-A1284 WeakPolarHBondContact O-CB 3.26Å; A1280-A1284 PolarHBondContact O-N 2.68Å
1281	M	63.9	Low	54.6	Low	111 Å²	111	97.1 Å²	97.1	55%	0.547	55%	0.545	S	S	.	.	H	α-helix	trans	-65.1	-45	172	-75.9	-80.9	-79.7	0	0	111.1	Y1277 D1278 A1284 Q1285	Y1277-M1281 WeakPolarHBondContact O-CG 3.36Å; Y1277-M1281 PolarHBondContact O-N 3.31Å; D1278-M1281 PolarHBondContact O-N 2.87Å; M1281-A1284 PolarHBondContact O-N 3.28Å; M1281-Q1285 WeakPolarHBondContact O-CB 3.29Å; M1281-Q1285 VanDerWaalsContact O-CG 3.26Å; M1281-Q1285 WeakPolarHBondContact O-CG 3.33Å; M1281-Q1285 PolarHBondContact O-N 3.46Å
1282	A	64.9	Low	55.6	Low	37 Å²	37	97.1 Å²	97.1	31%	0.306	54%	0.535	S	S	.	.	H	α-helix	trans	-63.1	-43.3	176.6	0	0	0	0	0	111.6	D1278 A1284 Q1285 Q1286	D1278-A1282 WeakPolarHBondContact O-CB 3.18Å; D1278-A1282 PolarHBondContact O-N 3.4Å; A1282-A1284 PolarHBondContact O-N 2.91Å; A1282-Q1285 PolarHBondContact O-N 2.96Å; A1282-Q1286 VanDerWaalsContact O-CB 3.29Å; A1282-Q1286 WeakPolarHBondContact O-CB 3.34Å; A1282-Q1286 VanDerWaalsContact O-CG 3.23Å; A1282-Q1286 WeakPolarHBondContact O-CG 3.3Å; A1282-Q1286 PolarHBondContact O-N 2.94Å
1283	A	66.6	Low	56.8	Low	53 Å²	53	97.9 Å²	97.9	44%	0.438	54%	0.538	S	S	.	.	H	α-helix	trans	-62.4	-41.6	174.4	0	0	0	0	0	112.3	A1279 F1287	A1279-A1283 WeakPolarHBondContact O-CB 3.31Å; A1279-A1283 PolarHBondContact O-N 3.02Å; A1283-F1287 WeakPolarHBondContact O-CB 3.33Å; A1283-F1287 PolarHBondContact O-N 2.75Å
1284	A	66.3	Low	57.3	Low	50 Å²	50	100.8 Å²	100.8	41%	0.413	54%	0.535	S	S	.	.	H	α-helix	trans	-67.5	-39.5	175.6	0	0	0	0	0	112.6	A1280 M1281 A1282 F1287 N1288	A1280-A1284 WeakPolarHBondContact O-CB 3.26Å; A1280-A1284 PolarHBondContact O-N 2.68Å; M1281-A1284 PolarHBondContact O-N 3.28Å; A1282-A1284 PolarHBondContact O-N 2.91Å; A1284-F1287 PolarHBondContact O-N 2.76Å; A1284-N1288 WeakPolarHBondContact O-CB 3.34Å; A1284-N1288 VanDerWaalsContact O-CG 3.24Å; A1284-N1288 PolarHBondContact O-N 3.12Å; A1284-N1288 PolarHBondContact O-ND2 2.9Å
1285	Q	68	Low	57.6	Low	121 Å²	121	104.2 Å²	104.2	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-67.5	-40.9	175	-74.8	173.4	-2.4	0	0	111.7	M1281 A1282 N1288 A1289	M1281-Q1285 WeakPolarHBondContact O-CB 3.29Å; M1281-Q1285 VanDerWaalsContact O-CG 3.26Å; M1281-Q1285 WeakPolarHBondContact O-CG 3.33Å; M1281-Q1285 PolarHBondContact O-N 3.46Å; A1282-Q1285 PolarHBondContact O-N 2.96Å; Q1285-N1288 PolarHBondContact O-N 3.19Å; Q1285-A1289 VanDerWaalsContact O-CB 3.25Å; Q1285-A1289 WeakPolarHBondContact O-CB 3.48Å; Q1285-A1289 PolarHBondContact O-N 3.07Å
1286	Q	67.9	Low	57.8	Low	140 Å²	140	108.4 Å²	108.4	65%	0.654	56%	0.559	S	S	*	*	H	α-helix	trans	-63.1	-42.3	173.5	-76.3	173.5	-3.8	0	0	111.5	A1282 A1289 W1290	A1282-Q1286 VanDerWaalsContact O-CB 3.29Å; A1282-Q1286 WeakPolarHBondContact O-CB 3.34Å; A1282-Q1286 VanDerWaalsContact O-CG 3.23Å; A1282-Q1286 WeakPolarHBondContact O-CG 3.3Å; A1282-Q1286 PolarHBondContact O-N 2.94Å; Q1286-A1289 PolarHBondContact O-N 3.16Å; Q1286-W1290 VanDerWaalsContact O-CB 3.22Å; Q1286-W1290 WeakPolarHBondContact O-CB 3.41Å; Q1286-W1290 PolarHBondContact O-N 2.9Å
1287	F	64.4	Low	57.4	Low	114 Å²	114	104.7 Å²	104.7	50%	0.5	56%	0.557	S	S	.	*	H	α-helix	trans	-64.6	-41.5	175.2	-173.7	-103.6	0	0	0	112.3	A1283 A1284 W1290 Q1291	A1283-F1287 WeakPolarHBondContact O-CB 3.33Å; A1283-F1287 PolarHBondContact O-N 2.75Å; A1284-F1287 PolarHBondContact O-N 2.76Å; F1287-W1290 PolarHBondContact O-N 2.86Å; F1287-Q1291 HydrophobicContact CE1-CG 4.35Å; F1287-Q1291 PolarHBondContact O-N 2.91Å
1288	N	67.7	Low	57.3	Low	91 Å²	91	100.9 Å²	100.9	49%	0.487	56%	0.561	S	S	.	*	H	α-helix	trans	-68	-41.5	176.3	-72.2	-12.7	0	0	0	112.3	A1284 Q1285 W1290 Q1291 Q1292	A1284-N1288 WeakPolarHBondContact O-CB 3.34Å; A1284-N1288 VanDerWaalsContact O-CG 3.24Å; A1284-N1288 PolarHBondContact O-N 3.12Å; A1284-N1288 PolarHBondContact O-ND2 2.9Å; Q1285-N1288 PolarHBondContact O-N 3.19Å; N1288-W1290 VanDerWaalsContact C-N 3.35Å; N1288-Q1291 PolarHBondContact O-N 3.4Å; N1288-Q1292 WeakPolarHBondContact O-CG 3.43Å; N1288-Q1292 PolarHBondContact O-N 2.68Å
1289	A	63.4	Low	56.5	Low	42 Å²	42	102.8 Å²	102.8	35%	0.347	58%	0.576	S	S	.	*	H	α-helix	trans	-64.5	-39.5	174.5	0	0	0	0	0	111.6	Q1285 Q1286 Q1292 Q1293	Q1285-A1289 VanDerWaalsContact O-CB 3.25Å; Q1285-A1289 WeakPolarHBondContact O-CB 3.48Å; Q1285-A1289 PolarHBondContact O-N 3.07Å; Q1286-A1289 PolarHBondContact O-N 3.16Å; A1289-Q1292 PolarHBondContact O-N 2.98Å; A1289-Q1293 WeakPolarHBondContact O-CG 3.5Å; A1289-Q1293 PolarHBondContact O-N 3.47Å
1290	W	69.3	Low	55.6	Low	134 Å²	134	105.6 Å²	105.6	51%	0.508	59%	0.592	S	S	.	*	H	α-helix	trans	-63.9	-41.1	173	-177.3	83.4	0	0	0	111.7	Q1286 F1287 N1288 Q1292 Q1293 Q1294	Q1286-W1290 VanDerWaalsContact O-CB 3.22Å; Q1286-W1290 WeakPolarHBondContact O-CB 3.41Å; Q1286-W1290 PolarHBondContact O-N 2.9Å; F1287-W1290 PolarHBondContact O-N 2.86Å; N1288-W1290 VanDerWaalsContact C-N 3.35Å; W1290-Q1292 VanDerWaalsContact C-N 3.33Å; W1290-Q1292 PolarHBondContact O-N 2.87Å; W1290-Q1293 PolarHBondContact O-N 3.07Å; W1290-Q1294 HydrophobicContact CD2-CG 4.16Å; W1290-Q1294 HydrophobicContact CE3-CG 4.39Å; W1290-Q1294 HydrophobicContact CH2-CG 4.33Å; W1290-Q1294 HydrophobicContact CZ2-CG 4.07Å; W1290-Q1294 HydrophobicContact CZ3-CG 4.48Å; W1290-Q1294 VanDerWaalsContact O-CG 3.24Å; W1290-Q1294 WeakPolarHBondContact O-CG 3.35Å; W1290-Q1294 PolarHBondContact O-N 2.85Å; W1290-Q1294 VanDerWaalsContact O-N 3.08Å
1291	Q	60	Low	54.9	Low	101 Å²	101	106.4 Å²	106.4	47%	0.472	61%	0.605	S	S	.	*	H	α-helix	trans	-62.8	-37.1	172.2	-74.8	-153	18.5	0	0	113.1	F1287 N1288 Q1294	F1287-Q1291 HydrophobicContact CE1-CG 4.35Å; F1287-Q1291 PolarHBondContact O-N 2.91Å; N1288-Q1291 PolarHBondContact O-N 3.4Å; Q1291-Q1294 PolarHBondContact O-N 2.92Å
1292	Q	58.9	Low	53.5	Low	146 Å²	146	106.9 Å²	106.9	68%	0.682	62%	0.62	S	S	*	*	H	α-helix	trans	-67.2	-36.7	174.9	-71.4	175.5	4.6	0	0	112	N1288 A1289 W1290 Q1294 Q1295	N1288-Q1292 WeakPolarHBondContact O-CG 3.43Å; N1288-Q1292 PolarHBondContact O-N 2.68Å; A1289-Q1292 PolarHBondContact O-N 2.98Å; W1290-Q1292 VanDerWaalsContact C-N 3.33Å; W1290-Q1292 PolarHBondContact O-N 2.87Å; Q1292-Q1294 VanDerWaalsContact C-N 3.25Å; Q1292-Q1294 PolarHBondContact O-N 3.42Å; Q1292-Q1295 PolarHBondContact O-N 3.47Å
1293	Q	55.7	Low	52.2	Low	161 Å²	161	111.5 Å²	111.5	75%	0.752	64%	0.643	S	S	*	*	H	α-helix	trans	-71.2	-16	173.8	-71.6	177.7	-2.4	0	0	114	A1289 W1290	A1289-Q1293 WeakPolarHBondContact O-CG 3.5Å; A1289-Q1293 PolarHBondContact O-N 3.47Å; W1290-Q1293 PolarHBondContact O-N 3.07Å
1294	Q	46.1	Very low	50.8	Low	124 Å²	124	115 Å²	115	58%	0.579	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	6.1	175.9	-67.7	-71.7	-21.9	0	0	113.4	W1290 Q1291 Q1292	W1290-Q1294 HydrophobicContact CD2-CG 4.16Å; W1290-Q1294 HydrophobicContact CE3-CG 4.39Å; W1290-Q1294 HydrophobicContact CH2-CG 4.33Å; W1290-Q1294 HydrophobicContact CZ2-CG 4.07Å; W1290-Q1294 HydrophobicContact CZ3-CG 4.48Å; W1290-Q1294 VanDerWaalsContact O-CG 3.24Å; W1290-Q1294 WeakPolarHBondContact O-CG 3.35Å; W1290-Q1294 PolarHBondContact O-N 2.85Å; W1290-Q1294 VanDerWaalsContact O-N 3.08Å; Q1291-Q1294 PolarHBondContact O-N 2.92Å; Q1292-Q1294 VanDerWaalsContact C-N 3.25Å; Q1292-Q1294 PolarHBondContact O-N 3.42Å
1295	Q	40.4	Very low	49.5	Very low	150 Å²	150	118.1 Å²	118.1	70%	0.701	68%	0.684	S	S	*	*	S	Bend	trans	-92.4	120.4	169.4	-64.7	-166.3	8.6	0	0	110.6	Q1292 S1297	Q1292-Q1295 PolarHBondContact O-N 3.47Å; Q1295-S1297 PolarHBondContact O-N 3.21Å
1296	P	44.5	Very low	48	Very low	124 Å²	124	118 Å²	118	81%	0.805	70%	0.696	S	S	*	*			trans	-68.5	119.4	170.4	28.2	-32.3	0	0	0	109.5	A1298	P1296-A1298 PolarHBondContact O-N 2.92Å
1297	S	38	Very low	46.6	Very low	113 Å²	113	117.9 Å²	117.9	79%	0.79	71%	0.705	S	S	*	*			trans	-70.6	87.5	178.2	39.4	0	0	0	0	111.2	Q1295 V1299	Q1295-S1297 PolarHBondContact O-N 3.21Å; S1297-V1299 PolarHBondContact O-N 3.32Å; S1297-V1299 VanDerWaalsContact O-N 3.09Å
1298	A	39.2	Very low	45.3	Very low	94 Å²	94	117.5 Å²	117.5	78%	0.777	71%	0.714	S	S	*	*			trans	-61.7	110.3	176.3	0	0	0	0	0	110.9	P1296 S1300	P1296-A1298 PolarHBondContact O-N 2.92Å; A1298-S1300 PolarHBondContact O-N 2.77Å
1299	V	37.1	Very low	44	Very low	140 Å²	140	119 Å²	119	85%	0.848	73%	0.731	S	S	*	*			trans	-73.7	119.5	177.5	176.7	0	0	0	0	109.5	S1297 G1301	S1297-V1299 PolarHBondContact O-N 3.32Å; S1297-V1299 VanDerWaalsContact O-N 3.09Å; V1299-G1301 VanDerWaalsContact C-N 3.35Å; V1299-G1301 PolarHBondContact O-N 3.15Å
1300	S	35	Very low	42.8	Very low	123 Å²	123	121.4 Å²	121.4	86%	0.86	75%	0.751	S	S	*	*			trans	-69.4	80.8	-179.6	-55.8	0	0	0	0	112.9	A1298	A1298-S1300 PolarHBondContact O-N 2.77Å
1301	G	35.8	Very low	41.4	Very low	66 Å²	66	121.1 Å²	121.1	68%	0.68	77%	0.767	S	S	*	*			trans	-91.1	100.8	171.9	0	0	0	0	0	112.2	V1299 V1303	V1299-G1301 VanDerWaalsContact C-N 3.35Å; V1299-G1301 PolarHBondContact O-N 3.15Å; G1301-V1303 PolarHBondContact O-N 2.64Å
1302	S	34.7	Very low	40.3	Very low	121 Å²	121	122.7 Å²	122.7	85%	0.846	78%	0.783	S	S	*	*			trans	-79.4	110.7	176.7	46.2	0	0	0	0	112.1
1303	V	38	Very low	39.3	Very low	133 Å²	133	120.2 Å²	120.2	81%	0.806	79%	0.788	S	S	*	*			trans	-133.6	113.2	169	-175	0	0	0	0	110	G1301	G1301-V1303 PolarHBondContact O-N 2.64Å
1304	S	36.1	Very low	38.3	Very low	126 Å²	126	118.1 Å²	118.1	88%	0.881	79%	0.786	S	S	*	*			trans	-72.9	133.8	171.8	-53.5	0	0	0	0	110.2
1305	S	38.5	Very low	37.8	Very low	117 Å²	117	118.2 Å²	118.2	82%	0.818	80%	0.795	S	S	*	*			trans	-117.7	121	174.6	51.7	0	0	0	0	111.5
1306	S	38.2	Very low	37.5	Very low	117 Å²	117	117.1 Å²	117.1	82%	0.818	80%	0.799	S	S	*	*			trans	-108.6	134.8	166.3	46.8	0	0	0	0	109.3
1307	V	38	Very low	37.1	Very low	139 Å²	139	116.6 Å²	116.6	84%	0.842	80%	0.795	S	S	*	*			trans	-85	134.8	-175.8	177.5	0	0	0	0	109.8
1308	P	37.3	Very low	36.8	Very low	106 Å²	106	120.7 Å²	120.7	69%	0.688	80%	0.802	S	S	*	*				-148.7	136.4	117.9	34.2	-16.3	0	0	0	116.9
1309	S	40	Very low	36.8	Very low	122 Å²	122	122.6 Å²	122.6	85%	0.853	80%	0.804	S	S	*	*			trans	68.5	142.1	140.8	-56.1	0	0	0	0	122.3
1310	A	37.5	Very low	37.2	Very low	93 Å²	93	121.7 Å²	121.7	77%	0.769	80%	0.801	S	S	*	*			trans	-97.6	176	175.4	0	0	0	0	0	112.6
1311	P	41.4	Very low	37.1	Very low	128 Å²	128	120.9 Å²	120.9	83%	0.831	80%	0.802	S	S	*	*				-149.2	161.3	91	39.2	-21.7	0	0	0	118.8
1312	T	35.9	Very low	37.1	Very low	133 Å²	133	122.1 Å²	122.1	82%	0.816	81%	0.806	S	S	*	*			trans	-25.4	129	167.3	-46	0	0	0	0	122.3
1313	A	37	Very low	37.2	Very low	95 Å²	95	123.7 Å²	123.7	79%	0.785	80%	0.804	S	S	*	*			trans	-171.2	119.9	137.3	0	0	0	0	0	109.3
1314	T	35.9	Very low	37.3	Very low	117 Å²	117	122.3 Å²	122.3	72%	0.718	80%	0.798	S	S	*	*				93.9	95.9	59.9	-61.9	0	0	0	0	114.9
1315	V	35.5	Very low	37.3	Very low	126 Å²	126	127.5 Å²	127.5	76%	0.764	80%	0.8	S	S	*	*			trans	63.1	126.4	151.3	-172.3	0	0	0	0	117.1
1316	T	33.8	Very low	37.2	Very low	127 Å²	127	125.8 Å²	125.8	78%	0.779	79%	0.793	S	S	*	*				-169.2	153.8	65.4	-32.9	0	0	0	0	110.5
1317	P	35.8	Very low	37	Very low	113 Å²	113	125.2 Å²	125.2	73%	0.734	79%	0.789	S	S	*	*			trans	-104.1	154.9	-173.1	38.1	-35	0	0	0	116.8
1318	Q	32.9	Very low	36.8	Very low	198 Å²	198	129.1 Å²	129.1	93%	0.925	79%	0.79	S	S	*	*			trans	-142.9	165.8	158.1	-71.5	-164.4	-8.4	0	0	110.8
1319	T	39.4	Very low	36.7	Very low	135 Å²	135	134.1 Å²	134.1	83%	0.828	80%	0.797	S	S	*	*			trans	-137	-170.1	-161.1	-21.1	0	0	0	0	112.2
1320	P	44.5	Very low	36.7	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	79%	0.789	S	S	*	*				-118.5	173.7	-116	42.6	-27.6	0	0	0	116.7
1321	A	32.4	Very low	36.5	Very low	105 Å²	105	131.3 Å²	131.3	87%	0.868	78%	0.777	S	S	*	*			trans	-150.3	166.7	161.9	0	0	0	0	0	111.4
1322	A	36.6	Very low	36.4	Very low	92 Å²	92	135.5 Å²	135.5	76%	0.76	78%	0.778	S	S	*	*			trans	-149.5	-176	-150.8	0	0	0	0	0	116.1
1323	N	37.5	Very low	36.3	Very low	154 Å²	154	134.2 Å²	134.2	82%	0.824	77%	0.774	S	S	*	*			trans	72.9	167.5	164.3	-78.8	-3.1	0	0	0	118.1
1324	P	40.1	Very low	36.2	Very low	104 Å²	104	136 Å²	136	68%	0.675	78%	0.776	S	S	*	*			cis	-139.7	175.6	-40.7	38.7	-23.6	0	0	0	113.8
1325	Y	36	Very low	36.2	Very low	235 Å²	235	141.6 Å²	141.6	92%	0.922	79%	0.785	S	S	*	*			trans	-163.8	154.8	137.2	-120.2	-80.7	0	0	0	111.3
1326	A	34.6	Very low	36.3	Very low	82 Å²	82	141.3 Å²	141.3	68%	0.678	79%	0.786	S	S	*	*			trans	-156.1	-174	-169.5	0	0	0	0	0	114.2
1327	S	35.2	Very low	36.5	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	79%	0.79	S	S	*	*			trans	80.1	151	175	78.9	0	0	0	0	116.2
1328	Y	34	Very low	36.4	Very low	221 Å²	221	138.9 Å²	138.9	87%	0.867	79%	0.787	S	S	*	*			cis	-131.3	167.8	20.2	-115.9	-87.1	0	0	0	116.2
1329	Y	35.6	Very low	36.6	Very low	212 Å²	212	140.9 Å²	140.9	83%	0.831	79%	0.788	S	S	*	*			trans	-134.9	-167.5	-176.9	-121.6	-31.6	0	0	0	109.2
1330	P	39.2	Very low	36.5	Very low	104 Å²	104	137.4 Å²	137.4	68%	0.675	78%	0.779	S	S	*	*			cis	-138.9	-173.9	17.3	45.2	-26.6	0	0	0	116.9
1331	G	34.2	Very low	36.1	Very low	51 Å²	51	138.7 Å²	138.7	53%	0.526	79%	0.785	S	S	.	*			trans	108.1	136.1	151.9	0	0	0	0	0	116.6
1332	Y	37.3	Very low	36.5	Very low	217 Å²	217	141.5 Å²	141.5	85%	0.851	78%	0.784	S	S	*	*			cis	-162.9	155	-0.6	-74.7	-70.3	0	0	0	108.2
1333	S	35.4	Very low	36.6	Very low	105 Å²	105	142.7 Å²	142.7	73%	0.734	78%	0.783	S	S	*	*			cis	-162.8	178.2	-17.4	-163.9	0	0	0	0	108.4
1334	T	34.3	Very low	36.8	Very low	133 Å²	133	142.3 Å²	142.3	82%	0.816	79%	0.786	S	S	*	*			trans	-136.7	156.4	179.4	43	0	0	0	0	113.6
1335	Y	36.1	Very low	36.8	Very low	235 Å²	235	141 Å²	141	92%	0.922	79%	0.792	S	S	*	*			trans	-114.2	140.9	170.5	-98	-86.6	0	0	0	110.7
1336	P	38	Very low	36.9	Very low	120 Å²	120	133.8 Å²	133.8	78%	0.779	79%	0.789	S	S	*	*			trans	-103.7	162.2	-173.6	39.1	-35.2	0	0	0	114.4
1337	S	37.5	Very low	37.4	Very low	124 Å²	124	134.5 Å²	134.5	87%	0.867	80%	0.795	S	S	*	*			trans	-145.5	146.7	153.3	-175.5	0	0	0	0	108.6
1338	G	34.5	Very low	37.9	Very low	65 Å²	65	135.3 Å²	135.3	67%	0.67	80%	0.798	S	S	*	*			trans	-165	138.9	-177.4	0	0	0	0	0	114.2
1339	Y	36.7	Very low	38.5	Very low	239 Å²	239	130.9 Å²	130.9	94%	0.937	80%	0.796	S	S	*	*			trans	-141.7	146.5	163.4	-79.4	-93.8	0	0	0	106.7
1340	G	36.9	Very low	38.8	Very low	63 Å²	63	124.9 Å²	124.9	65%	0.649	80%	0.799	S	S	*	*			cis	147.7	48.1	2.1	0	0	0	0	0	112.4
1341	T	37	Very low	38.8	Very low	147 Å²	147	123.7 Å²	123.7	90%	0.902	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-85.2	132.2	-177.5	25	0	0	0	0	112.4
1342	I	40.8	Very low	39.3	Very low	164 Å²	164	128.1 Å²	128.1	84%	0.841	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-100.8	136.2	-176.2	-62.3	176.3	0	0	0	110.2
1343	P	37.7	Very low	39.5	Very low	117 Å²	117	123.2 Å²	123.2	76%	0.76	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-101.9	140.2	-174.5	37	-33.7	0	0	0	115.2
1344	V	42.4	Very low	39.8	Very low	146 Å²	146	125.3 Å²	125.3	89%	0.885	83%	0.825	S	S	*	*			trans	-150.1	141.9	157.2	-172.2	0	0	0	0	106.3
1345	G	39.3	Very low	40	Very low	76 Å²	76	124.1 Å²	124.1	78%	0.784	83%	0.829	S	S	*	*			cis	136.2	80	-2.3	0	0	0	0	0	112.2
1346	G	38.4	Very low	40.1	Very low	84 Å²	84	117.6 Å²	117.6	87%	0.866	82%	0.824	S	S	*	*			trans	154.8	138.4	174.5	0	0	0	0	0	115.1
1347	A	44.4	Very low	40.2	Very low	97 Å²	97	116.5 Å²	116.5	80%	0.802	82%	0.824	S	S	*	*			trans	-117.5	-175.8	169.2	0	0	0	0	0	107.6
1348	P	45.4	Very low	40.2	Very low	122 Å²	122	116.3 Å²	116.3	79%	0.792	82%	0.82	S	S	*	*			cis	-139	-138.7	20.1	45.5	-21.3	0	0	0	112.9
1349	P	46.7	Very low	40.8	Very low	127 Å²	127	119.5 Å²	119.5	83%	0.825	83%	0.829	S	S	*	*				-130.9	170.9	-127.3	35.8	-12.3	0	0	0	118.1
1350	G	42.2	Very low	40.9	Very low	86 Å²	86	113 Å²	113	89%	0.887	83%	0.825	S	S	*	*			trans	119.3	124.6	154.6	0	0	0	0	0	116.5
1351	G	38.8	Very low	40.7	Very low	79 Å²	79	119 Å²	119	81%	0.814	84%	0.838	S	S	*	*			trans	167.8	119.6	174.7	0	0	0	0	0	113.3
1352	V	45.1	Very low	40.7	Very low	144 Å²	144	116.8 Å²	116.8	87%	0.873	83%	0.829	S	S	*	*			trans	-75	146.2	-174	-177.8	0	0	0	0	111.7
1353	P	41.7	Very low	40.5	Very low	115 Å²	115	116.7 Å²	116.7	75%	0.747	83%	0.825	S	S	*	*			trans	-92.2	157.6	-170.2	35.8	-37.2	0	0	0	116
1354	T	42.4	Very low	40.4	Very low	149 Å²	149	121.4 Å²	121.4	91%	0.914	83%	0.829	S	S	*	*			trans	-143.4	149.9	163.1	29.4	0	0	0	0	110
1355	A	37.2	Very low	40.2	Very low	107 Å²	107	124.1 Å²	124.1	88%	0.884	83%	0.825	S	S	*	*			trans	-105.9	143	-166.8	0	0	0	0	0	114.7
1356	A	39.3	Very low	40.2	Very low	99 Å²	99	126.7 Å²	126.7	82%	0.818	83%	0.825	S	S	*	*			trans	-160.9	133	163.2	0	0	0	0	0	113.3
1357	A	39.4	Very low	40.3	Very low	96 Å²	96	125.9 Å²	125.9	79%	0.793	82%	0.817	S	S	*	*			trans	50.5	145.2	151.8	0	0	0	0	0	122.8
1358	P	38.2	Very low	39.8	Very low	121 Å²	121	132.5 Å²	132.5	79%	0.786	82%	0.823	S	S	*	*			trans	-95.5	154.4	176.2	37.7	-34.7	0	0	0	114.4
1359	P	46.6	Very low	39.1	Very low	131 Å²	131	140.3 Å²	140.3	85%	0.851	84%	0.837	S	S	*	*			trans	-86.4	165.2	169.3	35.7	-34.6	0	0	0	113.2
1360	A	39.5	Very low	38.7	Very low	103 Å²	103	141 Å²	141	85%	0.851	84%	0.837	S	S	*	*			trans	-121	-178.9	-175.2	0	0	0	0	0	114.1
1361	M	32.6	Very low	38.5	Very low	189 Å²	189	143.8 Å²	143.8	93%	0.931	84%	0.835	S	S	*	*			trans	-50.5	141.6	-170.6	-62.6	172	164.1	0	0	118.5
1362	S	37.2	Very low	38.5	Very low	100 Å²	100	147.4 Å²	147.4	70%	0.699	84%	0.836	S	S	*	*			trans	-162.7	134.4	137	56.3	0	0	0	0	108.5
1363	Q	35.4	Very low	38.1	Very low	163 Å²	163	147.6 Å²	147.6	76%	0.762	83%	0.834	S	S	*	*			cis	69.8	64.9	34.6	-76.2	-77.2	8.2	0	0	116.1
1364	Y	37	Very low	37.9	Very low	215 Å²	215	149.7 Å²	149.7	84%	0.843	84%	0.839	S	S	*	*			trans	-151.5	130.9	149	-77.1	-71.4	0	0	0	106.9
1365	Y	37.4	Very low	37.6	Very low	203 Å²	203	149.7 Å²	149.7	80%	0.796	83%	0.834	S	S	*	*			cis	79.4	137.8	39.5	-116.2	-70.4	0	0	0	115.7
1366	T	39.4	Very low	37.6	Very low	130 Å²	130	152.8 Å²	152.8	80%	0.798	83%	0.831	S	S	*	*			trans	60	122.2	169.9	51.4	0	0	0	0	120.7
1367	G	41.1	Very low	37.5	Very low	68 Å²	68	156.9 Å²	156.9	70%	0.701	83%	0.832	S	S	*	*				115.5	97.3	101.2	0	0	0	0	0	119.5
1368	Y	33.1	Very low	37.4	Very low	235 Å²	235	162 Å²	162	92%	0.922	84%	0.835	S	S	*	*			trans	33.9	117.2	147.1	-74.4	-85.9	0	0	0	120.8
1369	R	31	Very low	37.3	Very low	286 Å²	286	165.7 Å²	165.7	100%	1.079	84%	0.839	S	S	*	*				-136.9	0	109.7	-154.7	177.8	-166.7	-155.2	2.9	110.6

Retrieved 1,369 of 1,369 residues in 311.6 ms (Link to these results)

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