G4VNF5_SCHMA Loading...

Serine/threonine kinase

AlphaFold DB , UniProt , Accession G4VNF5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,196 aa.

						>G4VNF5_SCHMA|G4VNF5
MSTSSDIVPVGTIIKERWRFCTKIGGGGFGEIYEAVDMINQQKVAVKVESAQQPKQVLKMEVAVLKRLQGRAHTCRFIGCGRNEQFNFIVMSLQGKNLADLRRSTRRGCFTISTTVRLARQMLVAIENVHNVGFLHRDIKPSNFALGTGIGPGAVNPRQIVLLDFGLARQFTTANGDIRAPRQVAGFRGTVRYASVNAHLNKELGRHDDLWSLYYMLGEFIVGELPWRKIKDKEQVGLMKQTFDHNQLLKFMPREFRPFLEHIQNLTYFDRPDYMYLHSLLNAYMERRRINESDPFDWEITTESTPVSGANETNQHHTTQTPIVTQQAAQVTVAGAQGTLDVSKLRKGIPSGVDQNRPNVGAGGTAGTSGYISGTRLAGSSSNLAFAGPVATTSMANVGKSFDAIPCHGGSNGSALNSRSGVVSHHRNTVDEILSNHNSQQQQGNNTPRKSFSNAGARSHRPATTPRLVKEAGAARAREAASKDVTKIDHFYSPHSQANRVSPSAKVGNTDSVCQPTDNSIPISCGHRNNDPNRLQPGMGTTNSNSSNRRPISAGAAHLRSSGGTIGSTASVVGAGSGTRCDTSCTHAVIVMVDQGENSNYHDMTKAVPLTLASHWIAGGEDEEGSVLSENEDAVVKVKGPVSSVASASGGVGDEYDASNHFNKLNGTNNQLPECGSGEGNEVFPRMPSENGNNDNNYFCNCDPNMLNSQRVFQPSGDVNKDVGSGSYQEPESDENSGERSSVNVPYITPGRLSISSQHTYGEVESGSCRHNNINSFGNRGVARKLSQGFRRQRALPQYLTSESKLLPSYGIPTAKESCLVNSPTCLKSFKSDNDNNWITRSGSDLMPQFPIPFSRSTSPYHPHGLEIVDENASIPVSKHSPYITQEMVDRRGRIQYKDLHDRDYRESGNLINEFHFDPNVNLNNNHNDNNNTNINNNHNYSSTWKFNQNSNCFPNSQQLNSSNSMYHHLQPVENQSNHMSRSMILSQTSSADPSSAYNLLMHPLRINNENNEINLKPPNSAYLADSPIVYKSPFQYSSASPSVTKPLTTTIISRDYFRSRPDISSASRQYYVSQSNNHFNTTTRRPTLSIAQNNSYLKAPFSKSEHNLLHAVDSLPELENRRFQPTVEDDSYLIEYSTNPIVSKSLKNTNPSIEIMNKFSYQSNLSKSSIDHLLEHSSKPNSLYFIRPTQHAIDM
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.7	Very low	71.9	Confident	181 Å²	181	87.5 Å²	87.5	89%	0.892	55%	0.552	S	S	*	*				0	153.3	0	-70	162.8	164.9	0	0	108.3	T611 A613	M1-T611 HydrophobicContact CE-CG2 3.4Å; M1-T611 VanDerWaalsContact CE-CG2 3.4Å; M1-A613 HydrophobicContact CE-CB 4.37Å
2	S	34.7	Very low	73.9	Confident	112 Å²	112	84.3 Å²	84.3	78%	0.783	53%	0.532	S	S	*	.			trans	-123.8	92.8	161.5	55.5	0	0	0	0	107.6	S4	S2-S4 PolarHBondContact O-N 2.88Å
3	T	39.1	Very low	75.7	Confident	134 Å²	134	83.9 Å²	83.9	82%	0.822	52%	0.522	S	S	*	.			trans	-70	86.2	164.7	44	0	0	0	0	107	S5	T3-S5 PolarHBondContact O-N 2.81Å
4	S	58	Low	77	Confident	95 Å²	95	78.7 Å²	78.7	66%	0.664	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-60	119.7	173.4	50.5	0	0	0	0	108.3	S2	S2-S4 PolarHBondContact O-N 2.88Å
5	S	77.2	Confident	78.2	Confident	107 Å²	107	78.7 Å²	78.7	75%	0.748	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-54.6	137.4	164.9	50.8	0	0	0	0	109.4	T3	T3-S5 PolarHBondContact O-N 2.81Å
6	D	86.6	Confident	79.1	Confident	67 Å²	67	84.9 Å²	84.9	36%	0.358	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-50.4	142.1	169.6	-75.9	8.2	0	0	0	110.8	V8 K23 Y33	D6-V8 PolarHBondContact O-N 3.47Å; D6-K23 VanDerWaalsContact CG-NZ 3.33Å; D6-K23 IonicContact OD1-NZ 3.59Å; D6-K23 PolarHBondContact OD1-NZ 3.38Å; D6-K23 WeakPolarHBondContact OD2-CD 3.44Å; D6-K23 IonicContact OD2-NZ 3.39Å; D6-Y33 WeakPolarHBondContact CB-OH 3.41Å
7	I	89.8	Confident	80.2	Confident	46 Å²	46	83.4 Å²	83.4	24%	0.236	48%	0.484	C	S	.	.	S	Bend	trans	-65.2	-33.1	-177.5	-61	168.4	0	0	0	110.4	E31 V48 F86	I7-E31 VanDerWaalsContact CB-OE2 3.23Å; I7-E31 WeakPolarHBondContact CB-OE2 3.41Å; I7-E31 HydrophobicContact CD1-CB 4.49Å; I7-E31 HydrophobicContact CD1-CG 3.91Å; I7-E31 HydrophobicContact CG1-CG 4.37Å; I7-E31 VanDerWaalsContact CG1-OE2 3.25Å; I7-E31 WeakPolarHBondContact CG1-OE2 3.32Å; I7-E31 PolarHBondContact N-OE2 2.62Å; I7-V48 HydrophobicContact CB-CG2 4.25Å; I7-V48 HydrophobicContact CD1-CG2 4.47Å; I7-V48 HydrophobicContact CG2-CG2 4.3Å; I7-F86 HydrophobicContact CG2-CB 4.01Å
8	V	92.7	Very high	81.1	Confident	2 Å²	2	79.1 Å²	79.1	1%	0.012	46%	0.459	C	S	.	.	S	Bend	trans	-132.8	122.6	176	-175.5	0	0	0	0	109.2	D6 T12 F20 Y33 V48 F86	D6-V8 PolarHBondContact O-N 3.47Å; V8-T12 HydrophobicContact CG1-CG2 3.79Å; V8-F20 HydrophobicContact CB-CD1 3.83Å; V8-F20 HydrophobicContact CB-CE1 3.58Å; V8-F20 HydrophobicContact CB-CZ 4.2Å; V8-F20 HydrophobicContact CG1-CD1 3.55Å; V8-F20 HydrophobicContact CG1-CD2 4.2Å; V8-F20 HydrophobicContact CG1-CE1 3.57Å; V8-F20 HydrophobicContact CG1-CE2 4.21Å; V8-F20 HydrophobicContact CG1-CG 3.9Å; V8-F20 HydrophobicContact CG1-CZ 3.91Å; V8-F20 HydrophobicContact CG2-CE1 3.92Å; V8-F20 HydrophobicContact CG2-CZ 4.18Å; V8-Y33 WeakPolarHBondContact O-CE1 3.07Å; V8-Y33 PolarHBondContact O-OH 3.34Å; V8-V48 HydrophobicContact CG2-CG1 4.29Å; V8-V48 HydrophobicContact CG2-CG2 4.3Å; V8-F86 HydrophobicContact CG2-CD1 3.87Å; V8-F86 HydrophobicContact CG2-CD2 4.38Å; V8-F86 HydrophobicContact CG2-CE1 3.75Å; V8-F86 HydrophobicContact CG2-CE2 4.25Å; V8-F86 HydrophobicContact CG2-CG 4.2Å; V8-F86 HydrophobicContact CG2-CZ 3.95Å
9	P	93.3	Very high	82	Confident	83 Å²	83	80.8 Å²	80.8	54%	0.539	46%	0.457	S	S	.	.			trans	-61	146.8	174.4	-24.9	35.1	0	0	0	113.2	T12	P9-T12 WeakPolarHBondContact O-CB 3.21Å; P9-T12 PolarHBondContact O-N 3.23Å; P9-T12 PolarHBondContact O-OG1 3.1Å; P9-T12 VanDerWaalsContact O-OG1 3.13Å
10	V	94.7	Very high	82.7	Confident	88 Å²	88	76.8 Å²	76.8	53%	0.533	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	140.1	166.3	167.8	0	0	0	0	109.4	C21	V10-C21 WeakPolarHBondContact CG1-O 3.35Å
11	G	94.8	Very high	83.4	Confident	47 Å²	47	75 Å²	75	49%	0.485	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	-19.2	-174	0	0	0	0	0	114.4	I13 F20	G11-I13 PolarHBondContact O-N 3.48Å; G11-F20 WeakPolarHBondContact CA-O 3.46Å; G11-F20 PolarHBondContact N-O 3.41Å
12	T	95.8	Very high	86.4	Confident	50 Å²	50	69.4 Å²	69.4	31%	0.307	40%	0.402	S	S	.	.			trans	-60.6	134.5	177.1	-63.2	0	0	0	0	111.5	V8 P9 I14 F20	V8-T12 HydrophobicContact CG1-CG2 3.79Å; P9-T12 WeakPolarHBondContact O-CB 3.21Å; P9-T12 PolarHBondContact O-N 3.23Å; P9-T12 PolarHBondContact O-OG1 3.1Å; P9-T12 VanDerWaalsContact O-OG1 3.13Å; T12-I14 HydrophobicContact CG2-CG2 4.22Å; T12-F20 WeakPolarHBondContact O-CD2 3.47Å; T12-F20 PolarHBondContact O-N 3.2Å
13	I	96.4	Very high	89.3	Confident	79 Å²	79	67.9 Å²	67.9	41%	0.405	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.9	174	-60	168.3	0	0	0	108.2	G11 W18 R19 M38	G11-I13 PolarHBondContact O-N 3.48Å; I13-W18 WeakPolarHBondContact CA-O 3.44Å; I13-R19 HydrophobicContact CG1-CB 3.94Å; I13-R19 HydrophobicContact CG1-CG 3.87Å; I13-M38 HydrophobicContact CD1-CE 4.04Å; I13-M38 HydrophobicContact CD1-SD 3.88Å; I13-M38 HydrophobicContact CG1-CE 4.46Å; I13-M38 HydrophobicContact CG1-SD 4.27Å; I13-M38 HydrophobicContact CG2-CE 3.6Å; I13-M38 HydrophobicContact CG2-SD 4.37Å
14	I	94.7	Very high	91.9	Very high	11 Å²	11	62 Å²	62	6%	0.056	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	140.4	175.6	69.8	167.6	0	0	0	111.2	T12 E16 R17 W18 F20 V46 F86 F88	T12-I14 HydrophobicContact CG2-CG2 4.22Å; I14-E16 PolarHBondContact O-N 3.37Å; I14-E16 VanDerWaalsContact O-N 3.12Å; I14-R17 PolarHBondContact O-N 3.1Å; I14-W18 HydrophobicContact CD1-CE3 4.37Å; I14-W18 HydrophobicContact CG1-CB 3.9Å; I14-W18 HydrophobicContact CG1-CE3 4.15Å; I14-W18 PolarHBondContact N-O 3.2Å; I14-W18 PolarHBondContact O-N 2.68Å; I14-W18 VanDerWaalsContact O-N 3.09Å; I14-F20 HydrophobicContact CB-CE2 4.4Å; I14-F20 HydrophobicContact CD1-CE2 3.78Å; I14-F20 HydrophobicContact CD1-CZ 4.25Å; I14-F20 HydrophobicContact CG1-CE2 3.87Å; I14-F20 HydrophobicContact CG2-CD2 4.33Å; I14-F20 HydrophobicContact CG2-CE2 3.67Å; I14-F20 HydrophobicContact CG2-CZ 4.38Å; I14-V46 HydrophobicContact CD1-CG1 4.21Å; I14-F86 HydrophobicContact CG2-CE2 4.15Å; I14-F86 HydrophobicContact CG2-CZ 3.76Å; I14-F88 HydrophobicContact CD1-CB 4.36Å; I14-F88 HydrophobicContact CD1-CD1 4Å; I14-F88 HydrophobicContact CD1-CD2 3.52Å; I14-F88 HydrophobicContact CD1-CE1 4.1Å; I14-F88 HydrophobicContact CD1-CE2 3.64Å; I14-F88 HydrophobicContact CD1-CG 3.71Å; I14-F88 HydrophobicContact CD1-CZ 3.92Å
15	K	94	Very high	93.3	Very high	78 Å²	78	58 Å²	58	34%	0.339	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.6	41.7	-175.7	-70.3	-158.1	167.6	-165.8	0	113.2	R17 W18 F88 N697 F699	K15-R17 VanDerWaalsContact O-CB 3.3Å; K15-R17 WeakPolarHBondContact O-CB 3.22Å; K15-R17 PolarHBondContact O-N 2.76Å; K15-W18 HydrophobicContact CB-CZ3 4.39Å; K15-F88 HydrophobicContact CD-CZ 4.08Å; K15-F88 HydrophobicContact CG-CZ 4.13Å; K15-N697 PolarHBondContact NZ-OD1 3.47Å; K15-F699 HydrophobicContact CD-CE2 3.83Å; K15-F699 HydrophobicContact CD-CZ 3.65Å
16	E	93.7	Very high	93.6	Very high	179 Å²	179	54.2 Å²	54.2	84%	0.836	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	14.3	179.7	-66.1	167.1	-166.2	0	0	115.2	I14 M38	I14-E16 PolarHBondContact O-N 3.37Å; I14-E16 VanDerWaalsContact O-N 3.12Å; E16-M38 WeakPolarHBondContact O-CE 3.49Å
17	R	96.8	Very high	93.2	Very high	58 Å²	58	52.7 Å²	52.7	22%	0.219	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	-45.6	-165.8	-179	172.7	176.7	172.4	-5.4	114.3	I14 K15 D37 M38 I39	I14-R17 PolarHBondContact O-N 3.1Å; K15-R17 VanDerWaalsContact O-CB 3.3Å; K15-R17 WeakPolarHBondContact O-CB 3.22Å; K15-R17 PolarHBondContact O-N 2.76Å; R17-D37 VanDerWaalsContact CG-OD1 3.22Å; R17-D37 WeakPolarHBondContact CG-OD1 3.3Å; R17-D37 IonicContact CZ-OD1 3.39Å; R17-D37 IonicContact CZ-OD2 2.68Å; R17-D37 VanDerWaalsContact NE-CG 3.34Å; R17-D37 IonicContact NE-OD1 2.7Å; R17-D37 PolarHBondContact NE-OD1 3.09Å; R17-D37 IonicContact NE-OD2 3.55Å; R17-D37 PolarHBondContact NE-OD2 3.04Å; R17-D37 VanDerWaalsContact NE-OD2 3.16Å; R17-D37 IonicContact NH2-OD1 2.83Å; R17-D37 IonicContact NH2-OD2 3.37Å; R17-D37 PolarHBondContact NH2-OD2 2.89Å; R17-M38 WeakPolarHBondContact O-CB 3.16Å; R17-M38 WeakPolarHBondContact O-CG 3.21Å; R17-M38 PolarHBondContact O-N 3.12Å; R17-I39 HydrophobicContact CG-CD1 3.95Å; R17-I39 HydrophobicContact CG-CG1 4.08Å
18	W	97.3	Very high	92.5	Very high	7 Å²	7	53.3 Å²	53.3	3%	0.027	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	108.6	-172.3	-60.5	-68.6	0	0	0	110.9	I13 I14 K15 V36 D37 I78 F88 V90	I13-W18 WeakPolarHBondContact CA-O 3.44Å; I14-W18 HydrophobicContact CD1-CE3 4.37Å; I14-W18 HydrophobicContact CG1-CB 3.9Å; I14-W18 HydrophobicContact CG1-CE3 4.15Å; I14-W18 PolarHBondContact N-O 3.2Å; I14-W18 PolarHBondContact O-N 2.68Å; I14-W18 VanDerWaalsContact O-N 3.09Å; K15-W18 HydrophobicContact CB-CZ3 4.39Å; W18-V36 WeakPolarHBondContact CA-O 3.2Å; W18-D37 VanDerWaalsContact NE1-CG 3.29Å; W18-D37 PolarHBondContact NE1-OD2 3.27Å; W18-D37 VanDerWaalsContact NE1-OD2 3.16Å; W18-I78 HydrophobicContact CZ2-CG2 4.14Å; W18-F88 HydrophobicContact CE3-CE2 4.25Å; W18-F88 AromaticContact CZ3-CE2 3.98Å; W18-F88 HydrophobicContact CZ3-CE2 3.98Å; W18-F88 HydrophobicContact CZ3-CZ 4.44Å; W18-V90 HydrophobicContact CD2-CG1 4.37Å; W18-V90 HydrophobicContact CD2-CG2 3.84Å; W18-V90 HydrophobicContact CE3-CG2 3.95Å; W18-V90 HydrophobicContact CG-CG1 4.41Å; W18-V90 HydrophobicContact CG-CG2 4.35Å; W18-V90 HydrophobicContact CH2-CG2 4.27Å; W18-V90 HydrophobicContact CZ2-CB 4.41Å; W18-V90 HydrophobicContact CZ2-CG1 4.4Å; W18-V90 HydrophobicContact CZ2-CG2 4.18Å; W18-V90 HydrophobicContact CZ3-CG2 4.17Å
19	R	97.7	Very high	91.9	Very high	111 Å²	111	56.4 Å²	56.4	42%	0.419	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.8	179.4	-173.3	-173.3	-59.3	161.2	1	110.2	I13 C21 A35 V36 M38	I13-R19 HydrophobicContact CG1-CB 3.94Å; I13-R19 HydrophobicContact CG1-CG 3.87Å; R19-C21 PolarHBondContact O-N 2.78Å; R19-C21 PolarHBondContact O-SG 3.16Å; R19-A35 CarbonylContact O-C 3.38Å; R19-A35 WeakPolarHBondContact O-CA 3.42Å; R19-A35 WeakPolarHBondContact O-CB 3.19Å; R19-V36 PolarHBondContact N-O 2.78Å; R19-V36 PolarHBondContact O-N 3.39Å; R19-M38 HydrophobicContact CB-CG 4.28Å; R19-M38 HydrophobicContact CB-SD 4.15Å; R19-M38 PolarHBondContact NH2-SD 2.96Å
20	F	96.8	Very high	91.7	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	124.4	178.9	-78	-126.5	0	0	0	109.8	V8 G11 T12 I14 Y33 V46 V48	V8-F20 HydrophobicContact CB-CD1 3.83Å; V8-F20 HydrophobicContact CB-CE1 3.58Å; V8-F20 HydrophobicContact CB-CZ 4.2Å; V8-F20 HydrophobicContact CG1-CD1 3.55Å; V8-F20 HydrophobicContact CG1-CD2 4.2Å; V8-F20 HydrophobicContact CG1-CE1 3.57Å; V8-F20 HydrophobicContact CG1-CE2 4.21Å; V8-F20 HydrophobicContact CG1-CG 3.9Å; V8-F20 HydrophobicContact CG1-CZ 3.91Å; V8-F20 HydrophobicContact CG2-CE1 3.92Å; V8-F20 HydrophobicContact CG2-CZ 4.18Å; G11-F20 WeakPolarHBondContact CA-O 3.46Å; G11-F20 PolarHBondContact N-O 3.41Å; T12-F20 WeakPolarHBondContact O-CD2 3.47Å; T12-F20 PolarHBondContact O-N 3.2Å; I14-F20 HydrophobicContact CB-CE2 4.4Å; I14-F20 HydrophobicContact CD1-CE2 3.78Å; I14-F20 HydrophobicContact CD1-CZ 4.25Å; I14-F20 HydrophobicContact CG1-CE2 3.87Å; I14-F20 HydrophobicContact CG2-CD2 4.33Å; I14-F20 HydrophobicContact CG2-CE2 3.67Å; I14-F20 HydrophobicContact CG2-CZ 4.38Å; F20-Y33 AromaticContact CD1-CD1 3.6Å; F20-Y33 HydrophobicContact CD1-CD1 3.6Å; F20-Y33 AromaticContact CD1-CD2 3.74Å; F20-Y33 HydrophobicContact CD1-CD2 3.74Å; F20-Y33 AromaticContact CD1-CE1 3.99Å; F20-Y33 HydrophobicContact CD1-CE1 3.99Å; F20-Y33 HydrophobicContact CD1-CE2 4.14Å; F20-Y33 AromaticContact CD1-CG 3.45Å; F20-Y33 HydrophobicContact CD1-CG 3.45Å; F20-Y33 VanDerWaalsContact CD1-CG 3.45Å; F20-Y33 HydrophobicContact CE1-CD1 4.26Å; F20-Y33 AromaticContact CE1-CD2 3.51Å; F20-Y33 HydrophobicContact CE1-CD2 3.51Å; F20-Y33 AromaticContact CE1-CE2 3.9Å; F20-Y33 HydrophobicContact CE1-CE2 3.9Å; F20-Y33 AromaticContact CE1-CG 3.71Å; F20-Y33 HydrophobicContact CE1-CG 3.71Å; F20-V46 HydrophobicContact CE1-CG1 4.31Å; F20-V46 HydrophobicContact CE2-CB 4.49Å; F20-V46 HydrophobicContact CE2-CG1 3.98Å; F20-V46 HydrophobicContact CZ-CB 4.18Å; F20-V46 HydrophobicContact CZ-CG1 3.54Å; F20-V48 HydrophobicContact CE1-CG1 4.06Å; F20-V48 HydrophobicContact CZ-CG1 3.84Å
21	C	95.9	Very high	91.7	Very high	40 Å²	40	49.2 Å²	49.2	27%	0.27	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-51.6	-172.9	-67.1	0	0	0	0	112.5	V10 R19 E34	V10-C21 WeakPolarHBondContact CG1-O 3.35Å; R19-C21 PolarHBondContact O-N 2.78Å; R19-C21 PolarHBondContact O-SG 3.16Å; C21-E34 WeakPolarHBondContact CA-O 3.46Å; C21-E34 WeakPolarHBondContact CB-O 3.05Å; C21-E34 PolarHBondContact N-O 2.92Å
22	T	95.4	Very high	91.7	Very high	63 Å²	63	47.4 Å²	47.4	39%	0.387	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148.6	176.3	60.7	0	0	0	0	110.9	Y33 E34	T22-Y33 CarbonylContact O-C 3.48Å; T22-Y33 WeakPolarHBondContact O-CA 3.36Å; T22-Y33 WeakPolarHBondContact O-CB 3.23Å; T22-E34 PolarHBondContact N-O 2.84Å; T22-E34 PolarHBondContact O-N 2.94Å
23	K	94.8	Very high	91.8	Very high	79 Å²	79	45 Å²	45	34%	0.343	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	109.9	172.3	-176.7	168.1	164.4	177.9	0	109	D6 E31 Y33	D6-K23 VanDerWaalsContact CG-NZ 3.33Å; D6-K23 IonicContact OD1-NZ 3.59Å; D6-K23 PolarHBondContact OD1-NZ 3.38Å; D6-K23 WeakPolarHBondContact OD2-CD 3.44Å; D6-K23 IonicContact OD2-NZ 3.39Å; K23-E31 WeakPolarHBondContact CE-OE1 3.45Å; K23-E31 VanDerWaalsContact NZ-CD 3.32Å; K23-E31 IonicContact NZ-OE1 2.81Å; K23-E31 PolarHBondContact NZ-OE1 3.05Å; K23-E31 IonicContact NZ-OE2 3.62Å; K23-Y33 HydrophobicContact CB-CD1 3.78Å; K23-Y33 HydrophobicContact CB-CE1 3.63Å; K23-Y33 HydrophobicContact CD-CE1 4.12Å; K23-Y33 HydrophobicContact CG-CD1 4.31Å; K23-Y33 HydrophobicContact CG-CE1 3.99Å
24	I	92.9	Very high	91.8	Very high	11 Å²	11	42.1 Å²	42.1	6%	0.056	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-18	-175.6	68.1	-171.2	0	0	0	112.3	I32 E34 L93 V591 M592 V593	I24-I32 HydrophobicContact CD1-CG1 4.25Å; I24-I32 HydrophobicContact CG1-CG1 4.17Å; I24-I32 HydrophobicContact CG1-CG2 4.05Å; I24-I32 WeakPolarHBondContact CG1-O 3.44Å; I24-I32 PolarHBondContact N-O 2.83Å; I24-E34 HydrophobicContact CG2-CB 3.9Å; I24-L93 HydrophobicContact CD1-CD1 3.82Å; I24-V591 CarbonylContact C-O 3.47Å; I24-V591 WeakPolarHBondContact CB-O 3.48Å; I24-V591 WeakPolarHBondContact O-CB 3.38Å; I24-M592 HydrophobicContact CD1-CG 3.84Å; I24-M592 HydrophobicContact CD1-SD 4.05Å; I24-M592 HydrophobicContact CG1-CG 4.45Å; I24-V593 HydrophobicContact CG2-CG2 4.33Å
25	G	88.4	Confident	91.9	Very high	11 Å²	11	41.6 Å²	41.6	11%	0.113	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	175.6	172	0	0	0	0	0	114.1	I32 V589	G25-I32 PolarHBondContact N-O 3.24Å; G25-I32 PolarHBondContact O-N 3.44Å; G25-V589 WeakPolarHBondContact CA-O 3.46Å
26	G	83.3	Confident	92	Very high	28 Å²	28	39 Å²	39	29%	0.289	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	176	171.7	174.2	0	0	0	0	0	114.5	G30 A588	G26-G30 WeakPolarHBondContact CA-O 3.17Å; G26-A588 WeakPolarHBondContact O-CA 3.38Å
27	G	78.3	Confident	92.2	Very high	35 Å²	35	30.5 Å²	30.5	36%	0.361	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.5	-170.1	178.5	0	0	0	0	0	112.2	F29 G30	G27-F29 PolarHBondContact O-N 3.37Å; G27-G30 PolarHBondContact N-O 3.04Å; G27-G30 PolarHBondContact O-N 2.86Å
28	G	75.8	Confident	92.1	Very high	58 Å²	58	29.9 Å²	29.9	60%	0.598	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	5	-173.7	0	0	0	0	0	117.3
29	F	79.9	Confident	91.9	Very high	67 Å²	67	35.6 Å²	35.6	29%	0.294	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	5.2	174.9	-58.9	-57.4	0	0	0	113.1	G27 V57 L167	G27-F29 PolarHBondContact O-N 3.37Å; F29-V57 HydrophobicContact CB-CG2 4.29Å; F29-L167 HydrophobicContact CE2-CD2 4.28Å
30	G	89.5	Confident	91.6	Very high	4 Å²	4	33.2 Å²	33.2	4%	0.041	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.6	-176.8	-174.5	0	0	0	0	0	113.8	G26 G27 V48	G26-G30 WeakPolarHBondContact CA-O 3.17Å; G27-G30 PolarHBondContact N-O 3.04Å; G27-G30 PolarHBondContact O-N 2.86Å; G30-V48 CarbonylContact C-O 3.48Å; G30-V48 WeakPolarHBondContact CA-O 3.09Å
31	E	93.9	Very high	91.4	Very high	17 Å²	17	39.4 Å²	39.4	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	156.4	-169.4	-62.9	177.1	148.3	0	0	109.9	I7 K23 Y33 K47 V48	I7-E31 VanDerWaalsContact CB-OE2 3.23Å; I7-E31 WeakPolarHBondContact CB-OE2 3.41Å; I7-E31 HydrophobicContact CD1-CB 4.49Å; I7-E31 HydrophobicContact CD1-CG 3.91Å; I7-E31 HydrophobicContact CG1-CG 4.37Å; I7-E31 VanDerWaalsContact CG1-OE2 3.25Å; I7-E31 WeakPolarHBondContact CG1-OE2 3.32Å; I7-E31 PolarHBondContact N-OE2 2.62Å; K23-E31 WeakPolarHBondContact CE-OE1 3.45Å; K23-E31 VanDerWaalsContact NZ-CD 3.32Å; K23-E31 IonicContact NZ-OE1 2.81Å; K23-E31 PolarHBondContact NZ-OE1 3.05Å; K23-E31 IonicContact NZ-OE2 3.62Å; E31-Y33 HydrophobicContact CB-CD2 4.43Å; E31-Y33 HydrophobicContact CB-CE2 3.65Å; E31-Y33 PolarHBondContact OE2-OH 2.93Å; E31-K47 CarbonylContact O-C 3.59Å; E31-K47 VanDerWaalsContact O-CA 3.31Å; E31-K47 WeakPolarHBondContact O-CA 3.47Å; E31-K47 WeakPolarHBondContact O-CG 3.44Å; E31-V48 HydrophobicContact CB-CG2 4Å; E31-V48 PolarHBondContact N-O 2.73Å; E31-V48 PolarHBondContact O-N 3.3Å
32	I	95.4	Very high	91.3	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.041	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135.4	178.9	-173	170.3	0	0	0	110.1	I24 G25 A45 V46 K47 I590	I24-I32 HydrophobicContact CD1-CG1 4.25Å; I24-I32 HydrophobicContact CG1-CG1 4.17Å; I24-I32 HydrophobicContact CG1-CG2 4.05Å; I24-I32 WeakPolarHBondContact CG1-O 3.44Å; I24-I32 PolarHBondContact N-O 2.83Å; G25-I32 PolarHBondContact N-O 3.24Å; G25-I32 PolarHBondContact O-N 3.44Å; I32-A45 HydrophobicContact CD1-CB 4.35Å; I32-V46 WeakPolarHBondContact CA-O 3.49Å; I32-K47 HydrophobicContact CB-CB 4.34Å; I32-K47 HydrophobicContact CB-CG 4.27Å; I32-K47 HydrophobicContact CD1-CB 4.4Å; I32-K47 HydrophobicContact CG1-CB 4.22Å; I32-I590 HydrophobicContact CD1-CD1 4.39Å; I32-I590 HydrophobicContact CD1-CG2 4.35Å; I32-I590 HydrophobicContact CG2-CG1 4.35Å
33	Y	96.7	Very high	91.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.6	-172.1	-64.9	-101.3	0	0	0	110.6	D6 V8 F20 T22 K23 E31 A45 V46 V48	D6-Y33 WeakPolarHBondContact CB-OH 3.41Å; V8-Y33 WeakPolarHBondContact O-CE1 3.07Å; V8-Y33 PolarHBondContact O-OH 3.34Å; F20-Y33 AromaticContact CD1-CD1 3.6Å; F20-Y33 HydrophobicContact CD1-CD1 3.6Å; F20-Y33 AromaticContact CD1-CD2 3.74Å; F20-Y33 HydrophobicContact CD1-CD2 3.74Å; F20-Y33 AromaticContact CD1-CE1 3.99Å; F20-Y33 HydrophobicContact CD1-CE1 3.99Å; F20-Y33 HydrophobicContact CD1-CE2 4.14Å; F20-Y33 AromaticContact CD1-CG 3.45Å; F20-Y33 HydrophobicContact CD1-CG 3.45Å; F20-Y33 VanDerWaalsContact CD1-CG 3.45Å; F20-Y33 HydrophobicContact CE1-CD1 4.26Å; F20-Y33 AromaticContact CE1-CD2 3.51Å; F20-Y33 HydrophobicContact CE1-CD2 3.51Å; F20-Y33 AromaticContact CE1-CE2 3.9Å; F20-Y33 HydrophobicContact CE1-CE2 3.9Å; F20-Y33 AromaticContact CE1-CG 3.71Å; F20-Y33 HydrophobicContact CE1-CG 3.71Å; T22-Y33 CarbonylContact O-C 3.48Å; T22-Y33 WeakPolarHBondContact O-CA 3.36Å; T22-Y33 WeakPolarHBondContact O-CB 3.23Å; K23-Y33 HydrophobicContact CB-CD1 3.78Å; K23-Y33 HydrophobicContact CB-CE1 3.63Å; K23-Y33 HydrophobicContact CD-CE1 4.12Å; K23-Y33 HydrophobicContact CG-CD1 4.31Å; K23-Y33 HydrophobicContact CG-CE1 3.99Å; E31-Y33 HydrophobicContact CB-CD2 4.43Å; E31-Y33 HydrophobicContact CB-CE2 3.65Å; E31-Y33 PolarHBondContact OE2-OH 2.93Å; Y33-A45 WeakPolarHBondContact O-CA 3.39Å; Y33-V46 PolarHBondContact N-O 3.37Å; Y33-V46 PolarHBondContact O-N 3.19Å; Y33-V48 HydrophobicContact CD2-CG2 4.33Å; Y33-V48 HydrophobicContact CE2-CG2 3.83Å
34	E	96.3	Very high	91.4	Very high	18 Å²	18	38.6 Å²	38.6	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	132.2	153.9	-174.4	-177.4	91.6	0	0	107.7	C21 T22 I24 K43 L93	C21-E34 WeakPolarHBondContact CA-O 3.46Å; C21-E34 WeakPolarHBondContact CB-O 3.05Å; C21-E34 PolarHBondContact N-O 2.92Å; T22-E34 PolarHBondContact N-O 2.84Å; T22-E34 PolarHBondContact O-N 2.94Å; I24-E34 HydrophobicContact CG2-CB 3.9Å; E34-K43 HydrophobicContact CG-CB 4.4Å; E34-K43 HydrophobicContact CG-CD 4.36Å; E34-K43 HydrophobicContact CG-CG 4.41Å; E34-K43 WeakPolarHBondContact OE1-CE 3.22Å; E34-K43 IonicContact OE1-NZ 2.73Å; E34-K43 PolarHBondContact OE1-NZ 3Å; E34-K43 WeakPolarHBondContact OE2-CD 3.31Å; E34-K43 IonicContact OE2-NZ 3.04Å; E34-K43 PolarHBondContact OE2-NZ 2.63Å; E34-L93 HydrophobicContact CG-CD2 4.09Å
35	A	97.1	Very high	91.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	157.5	172.8	0	0	0	0	0	110.3	R19 K43 V44 V46	R19-A35 CarbonylContact O-C 3.38Å; R19-A35 WeakPolarHBondContact O-CA 3.42Å; R19-A35 WeakPolarHBondContact O-CB 3.19Å; A35-K43 CarbonylContact O-C 3.55Å; A35-K43 WeakPolarHBondContact O-CA 3.3Å; A35-V44 HydrophobicContact CB-CG2 4.11Å; A35-V44 PolarHBondContact N-O 2.92Å; A35-V44 WeakPolarHBondContact O-CG2 3.48Å; A35-V44 PolarHBondContact O-N 3.04Å; A35-V46 HydrophobicContact CB-CB 4.49Å; A35-V46 HydrophobicContact CB-CG2 3.56Å
36	V	96.9	Very high	92	Very high	25 Å²	25	37.7 Å²	37.7	15%	0.152	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.6	168.3	173.7	0	0	0	0	109.3	W18 R19 M38 K43	W18-V36 WeakPolarHBondContact CA-O 3.2Å; R19-V36 PolarHBondContact N-O 2.78Å; R19-V36 PolarHBondContact O-N 3.39Å; V36-M38 PolarHBondContact O-N 2.81Å; V36-K43 HydrophobicContact CG2-CG 4.29Å
37	D	96.3	Very high	92.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	100.2	168.7	-175.8	-15.2	0	0	0	109	R17 W18 I39 N40 Q41 Q42 V44	R17-D37 VanDerWaalsContact CG-OD1 3.22Å; R17-D37 WeakPolarHBondContact CG-OD1 3.3Å; R17-D37 IonicContact CZ-OD1 3.39Å; R17-D37 IonicContact CZ-OD2 2.68Å; R17-D37 VanDerWaalsContact NE-CG 3.34Å; R17-D37 IonicContact NE-OD1 2.7Å; R17-D37 PolarHBondContact NE-OD1 3.09Å; R17-D37 IonicContact NE-OD2 3.55Å; R17-D37 PolarHBondContact NE-OD2 3.04Å; R17-D37 VanDerWaalsContact NE-OD2 3.16Å; R17-D37 IonicContact NH2-OD1 2.83Å; R17-D37 IonicContact NH2-OD2 3.37Å; R17-D37 PolarHBondContact NH2-OD2 2.89Å; W18-D37 VanDerWaalsContact NE1-CG 3.29Å; W18-D37 PolarHBondContact NE1-OD2 3.27Å; W18-D37 VanDerWaalsContact NE1-OD2 3.16Å; D37-I39 PolarHBondContact O-N 2.74Å; D37-I39 PolarHBondContact OD1-N 3.16Å; D37-N40 WeakPolarHBondContact CB-OD1 3.34Å; D37-N40 PolarHBondContact O-N 3.13Å; D37-N40 VanDerWaalsContact O-N 3.13Å; D37-N40 PolarHBondContact O-OD1 2.39Å; D37-N40 PolarHBondContact OD2-ND2 2.93Å; D37-Q41 WeakPolarHBondContact O-CA 3.38Å; D37-Q41 PolarHBondContact O-N 3.03Å; D37-Q42 PolarHBondContact N-O 2.85Å; D37-V44 HydrophobicContact CB-CG1 4.16Å; D37-V44 HydrophobicContact CB-CG2 4.42Å
38	M	95.3	Very high	93.5	Very high	44 Å²	44	35.4 Å²	35.4	22%	0.217	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-12.9	-170.6	-58.7	-170.1	-47.5	0	0	114.1	I13 E16 R17 R19 V36 Q41	I13-M38 HydrophobicContact CD1-CE 4.04Å; I13-M38 HydrophobicContact CD1-SD 3.88Å; I13-M38 HydrophobicContact CG1-CE 4.46Å; I13-M38 HydrophobicContact CG1-SD 4.27Å; I13-M38 HydrophobicContact CG2-CE 3.6Å; I13-M38 HydrophobicContact CG2-SD 4.37Å; E16-M38 WeakPolarHBondContact O-CE 3.49Å; R17-M38 WeakPolarHBondContact O-CB 3.16Å; R17-M38 WeakPolarHBondContact O-CG 3.21Å; R17-M38 PolarHBondContact O-N 3.12Å; R19-M38 HydrophobicContact CB-CG 4.28Å; R19-M38 HydrophobicContact CB-SD 4.15Å; R19-M38 PolarHBondContact NH2-SD 2.96Å; V36-M38 PolarHBondContact O-N 2.81Å; M38-Q41 PolarHBondContact O-NE2 3.33Å
39	I	93.6	Very high	94.4	Very high	127 Å²	127	32.7 Å²	32.7	65%	0.651	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-37.7	175.5	-64.4	-179.3	0	0	0	111.4	R17 D37	R17-I39 HydrophobicContact CG-CD1 3.95Å; R17-I39 HydrophobicContact CG-CG1 4.08Å; D37-I39 PolarHBondContact O-N 2.74Å; D37-I39 PolarHBondContact OD1-N 3.16Å
40	N	90.8	Very high	95.1	Very high	62 Å²	62	31 Å²	31	33%	0.332	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	0.7	-178.1	57.4	54	0	0	0	113.7	D37 Q42	D37-N40 WeakPolarHBondContact CB-OD1 3.34Å; D37-N40 PolarHBondContact O-N 3.13Å; D37-N40 VanDerWaalsContact O-N 3.13Å; D37-N40 PolarHBondContact O-OD1 2.39Å; D37-N40 PolarHBondContact OD2-ND2 2.93Å; N40-Q42 HydrophobicContact CB-CG 4.47Å; N40-Q42 VanDerWaalsContact O-CG 3.23Å; N40-Q42 WeakPolarHBondContact O-CG 3.44Å; N40-Q42 PolarHBondContact O-N 3.19Å; N40-Q42 VanDerWaalsContact O-N 3.16Å; N40-Q42 VanDerWaalsContact OD1-CB 3.32Å; N40-Q42 WeakPolarHBondContact OD1-CB 3.45Å; N40-Q42 PolarHBondContact OD1-N 3.26Å
41	Q	93.8	Very high	95.4	Very high	131 Å²	131	31.6 Å²	31.6	61%	0.612	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	23.7	-178	-60	-63.1	-35	0	0	114.4	D37 M38	D37-Q41 WeakPolarHBondContact O-CA 3.38Å; D37-Q41 PolarHBondContact O-N 3.03Å; M38-Q41 PolarHBondContact O-NE2 3.33Å
42	Q	94	Very high	95.3	Very high	86 Å²	86	37.9 Å²	37.9	40%	0.402	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	152	-179.1	-52.6	-140.1	-38.7	0	0	112.7	D37 N40 P152	D37-Q42 PolarHBondContact N-O 2.85Å; N40-Q42 HydrophobicContact CB-CG 4.47Å; N40-Q42 VanDerWaalsContact O-CG 3.23Å; N40-Q42 WeakPolarHBondContact O-CG 3.44Å; N40-Q42 PolarHBondContact O-N 3.19Å; N40-Q42 VanDerWaalsContact O-N 3.16Å; N40-Q42 VanDerWaalsContact OD1-CB 3.32Å; N40-Q42 WeakPolarHBondContact OD1-CB 3.45Å; N40-Q42 PolarHBondContact OD1-N 3.26Å; Q42-P152 HydrophobicContact CB-CG 4.46Å
43	K	95.7	Very high	95	Very high	78 Å²	78	39.7 Å²	39.7	34%	0.339	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	137.3	179.4	-68.4	177.4	164.1	-148.3	0	111.6	E34 A35 V36 L93 Q595	E34-K43 HydrophobicContact CG-CB 4.4Å; E34-K43 HydrophobicContact CG-CD 4.36Å; E34-K43 HydrophobicContact CG-CG 4.41Å; E34-K43 WeakPolarHBondContact OE1-CE 3.22Å; E34-K43 IonicContact OE1-NZ 2.73Å; E34-K43 PolarHBondContact OE1-NZ 3Å; E34-K43 WeakPolarHBondContact OE2-CD 3.31Å; E34-K43 IonicContact OE2-NZ 3.04Å; E34-K43 PolarHBondContact OE2-NZ 2.63Å; A35-K43 CarbonylContact O-C 3.55Å; A35-K43 WeakPolarHBondContact O-CA 3.3Å; V36-K43 HydrophobicContact CG2-CG 4.29Å; K43-L93 HydrophobicContact CB-CD2 3.94Å; K43-Q595 VanDerWaalsContact CD-NE2 3.28Å
44	V	96.4	Very high	94.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	157.2	179.8	-64.1	0	0	0	0	110.5	A35 D37 V46 I78 V90 P152	A35-V44 HydrophobicContact CB-CG2 4.11Å; A35-V44 PolarHBondContact N-O 2.92Å; A35-V44 WeakPolarHBondContact O-CG2 3.48Å; A35-V44 PolarHBondContact O-N 3.04Å; D37-V44 HydrophobicContact CB-CG1 4.16Å; D37-V44 HydrophobicContact CB-CG2 4.42Å; V44-V46 HydrophobicContact CG2-CG2 4.19Å; V44-I78 HydrophobicContact CB-CD1 4.3Å; V44-I78 HydrophobicContact CG1-CD1 3.55Å; V44-V90 HydrophobicContact CB-CG1 3.93Å; V44-V90 HydrophobicContact CG1-CG1 4.44Å; V44-V90 HydrophobicContact CG2-CG1 3.74Å; V44-P152 HydrophobicContact CG1-CG 3.66Å
45	A	96.8	Very high	94.3	Very high	3 Å²	3	50.1 Å²	50.1	3%	0.025	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.8	169.9	0	0	0	0	0	109.9	I32 Y33 V90 M91 L93	I32-A45 HydrophobicContact CD1-CB 4.35Å; Y33-A45 WeakPolarHBondContact O-CA 3.39Å; A45-V90 WeakPolarHBondContact O-CA 3.46Å; A45-M91 HydrophobicContact CB-CG 3.97Å; A45-M91 PolarHBondContact N-O 2.77Å; A45-M91 PolarHBondContact O-N 3.05Å; A45-L93 HydrophobicContact CB-CD1 4.01Å
46	V	96.9	Very high	94.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	116.4	174.8	-174.1	0	0	0	0	109	I14 F20 I32 Y33 A35 V44 V48 F88 I89 V90	I14-V46 HydrophobicContact CD1-CG1 4.21Å; F20-V46 HydrophobicContact CE1-CG1 4.31Å; F20-V46 HydrophobicContact CE2-CB 4.49Å; F20-V46 HydrophobicContact CE2-CG1 3.98Å; F20-V46 HydrophobicContact CZ-CB 4.18Å; F20-V46 HydrophobicContact CZ-CG1 3.54Å; I32-V46 WeakPolarHBondContact CA-O 3.49Å; Y33-V46 PolarHBondContact N-O 3.37Å; Y33-V46 PolarHBondContact O-N 3.19Å; A35-V46 HydrophobicContact CB-CB 4.49Å; A35-V46 HydrophobicContact CB-CG2 3.56Å; V44-V46 HydrophobicContact CG2-CG2 4.19Å; V46-V48 HydrophobicContact CG1-CG1 4.14Å; V46-F88 HydrophobicContact CG1-CB 4.46Å; V46-I89 WeakPolarHBondContact CA-O 3.45Å; V46-V90 HydrophobicContact CG1-CG2 4.44Å; V46-V90 HydrophobicContact CG2-CG1 4.15Å; V46-V90 HydrophobicContact CG2-CG2 4.18Å
47	K	96.4	Very high	93.9	Very high	15 Å²	15	53.8 Å²	53.8	7%	0.065	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.1	175.7	-169.7	-175.4	-168.5	-169.9	0	109.3	E31 I32 L58 E61 F88 I89 D164	E31-K47 CarbonylContact O-C 3.59Å; E31-K47 VanDerWaalsContact O-CA 3.31Å; E31-K47 WeakPolarHBondContact O-CA 3.47Å; E31-K47 WeakPolarHBondContact O-CG 3.44Å; I32-K47 HydrophobicContact CB-CB 4.34Å; I32-K47 HydrophobicContact CB-CG 4.27Å; I32-K47 HydrophobicContact CD1-CB 4.4Å; I32-K47 HydrophobicContact CG1-CB 4.22Å; K47-L58 HydrophobicContact CB-CD1 4.39Å; K47-L58 HydrophobicContact CD-CD1 3.87Å; K47-L58 HydrophobicContact CG-CD1 4.04Å; K47-E61 IonicContact NZ-OE1 3.16Å; K47-E61 PolarHBondContact NZ-OE1 2.85Å; K47-E61 IonicContact NZ-OE2 3.38Å; K47-E61 PolarHBondContact NZ-OE2 3.13Å; K47-F88 WeakPolarHBondContact O-CA 3.05Å; K47-I89 HydrophobicContact CB-CG2 3.78Å; K47-I89 PolarHBondContact N-O 2.84Å; K47-I89 PolarHBondContact O-N 3.43Å; K47-D164 IonicContact NZ-OD1 3.79Å; K47-D164 PolarHBondContact NZ-OD1 3.17Å
48	V	96.3	Very high	93.8	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.7	-175.7	-58.4	0	0	0	0	111.7	I7 V8 F20 G30 E31 Y33 V46 F86 N87 F88	I7-V48 HydrophobicContact CB-CG2 4.25Å; I7-V48 HydrophobicContact CD1-CG2 4.47Å; I7-V48 HydrophobicContact CG2-CG2 4.3Å; V8-V48 HydrophobicContact CG2-CG1 4.29Å; V8-V48 HydrophobicContact CG2-CG2 4.3Å; F20-V48 HydrophobicContact CE1-CG1 4.06Å; F20-V48 HydrophobicContact CZ-CG1 3.84Å; G30-V48 CarbonylContact C-O 3.48Å; G30-V48 WeakPolarHBondContact CA-O 3.09Å; E31-V48 HydrophobicContact CB-CG2 4Å; E31-V48 PolarHBondContact N-O 2.73Å; E31-V48 PolarHBondContact O-N 3.3Å; Y33-V48 HydrophobicContact CD2-CG2 4.33Å; Y33-V48 HydrophobicContact CE2-CG2 3.83Å; V46-V48 HydrophobicContact CG1-CG1 4.14Å; V48-F86 HydrophobicContact CB-CD2 4.46Å; V48-F86 HydrophobicContact CG1-CD2 4.15Å; V48-N87 VanDerWaalsContact CA-O 3.3Å; V48-N87 WeakPolarHBondContact CA-O 3.4Å; V48-F88 HydrophobicContact CG1-CB 3.9Å
49	E	95.4	Very high	93.7	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	142.5	165.6	63.3	-179.9	-172.1	0	0	108.1	A51 Q56 V57 L58 F86 N87	E49-A51 PolarHBondContact O-N 2.96Å; E49-Q56 WeakPolarHBondContact OE1-CB 3.4Å; E49-Q56 WeakPolarHBondContact OE2-CA 3.22Å; E49-V57 WeakPolarHBondContact OE2-CG2 3.5Å; E49-V57 PolarHBondContact OE2-N 2.93Å; E49-L58 HydrophobicContact CG-CB 3.82Å; E49-L58 HydrophobicContact CG-CD2 4.29Å; E49-L58 VanDerWaalsContact OE1-CB 3.27Å; E49-L58 WeakPolarHBondContact OE1-CB 3.41Å; E49-L58 PolarHBondContact OE1-N 3.26Å; E49-L58 PolarHBondContact OE2-N 2.82Å; E49-F86 CarbonylContact O-C 3.5Å; E49-F86 WeakPolarHBondContact O-CA 3.33Å; E49-F86 VanDerWaalsContact O-CB 3.25Å; E49-F86 WeakPolarHBondContact O-CB 3.25Å; E49-N87 HydrophobicContact CG-CB 3.74Å; E49-N87 PolarHBondContact N-O 2.89Å; E49-N87 PolarHBondContact O-N 2.92Å; E49-N87 PolarHBondContact OE1-ND2 3.08Å
50	S	94.5	Very high	93.7	Very high	30 Å²	30	56.7 Å²	56.7	21%	0.21	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	135.9	176.3	174.6	0	0	0	0	110.3	Q52 Q53 Q85	S50-Q52 PolarHBondContact O-N 2.91Å; S50-Q52 VanDerWaalsContact O-N 3.15Å; S50-Q52 PolarHBondContact OG-N 2.93Å; S50-Q53 WeakPolarHBondContact O-CB 3.49Å; S50-Q53 WeakPolarHBondContact O-CG 3.45Å; S50-Q53 PolarHBondContact O-N 3.46Å; S50-Q85 CarbonylContact C-O 3.54Å; S50-Q85 VanDerWaalsContact CA-O 3.3Å; S50-Q85 WeakPolarHBondContact CA-O 3.45Å; S50-Q85 PolarHBondContact OG-O 2.95Å
51	A	94.5	Very high	93.9	Very high	18 Å²	18	54 Å²	54	15%	0.149	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.9	179.7	0	0	0	0	0	111.7	E49 Q53 Q56 Q85	E49-A51 PolarHBondContact O-N 2.96Å; A51-Q53 VanDerWaalsContact C-N 3.28Å; A51-Q53 PolarHBondContact O-N 3.16Å; A51-Q56 PolarHBondContact O-NE2 3.33Å; A51-Q85 PolarHBondContact N-O 2.74Å
52	Q	92.3	Very high	94.1	Very high	149 Å²	149	48.9 Å²	48.9	70%	0.696	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-0.3	179	-50.4	-56.3	-31	0	0	113.6	S50 P54 E84	S50-Q52 PolarHBondContact O-N 2.91Å; S50-Q52 VanDerWaalsContact O-N 3.15Å; S50-Q52 PolarHBondContact OG-N 2.93Å; Q52-P54 WeakPolarHBondContact O-CD 3.48Å; Q52-E84 PolarHBondContact NE2-O 2.63Å
53	Q	88.9	Confident	94.2	Very high	46 Å²	46	46.5 Å²	46.5	22%	0.215	24%	0.242	C	C	.	.			trans	-70.9	127.6	176.8	-71.3	-172.7	6.5	0	0	111.6	S50 A51 K55	S50-Q53 WeakPolarHBondContact O-CB 3.49Å; S50-Q53 WeakPolarHBondContact O-CG 3.45Å; S50-Q53 PolarHBondContact O-N 3.46Å; A51-Q53 VanDerWaalsContact C-N 3.28Å; A51-Q53 PolarHBondContact O-N 3.16Å; Q53-K55 PolarHBondContact O-N 3.11Å
54	P	90.2	Very high	94.3	Very high	144 Å²	144	42.8 Å²	42.8	94%	0.935	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-9.6	179.7	-26.2	35.1	0	0	0	116	Q52	Q52-P54 WeakPolarHBondContact O-CD 3.48Å
55	K	88.6	Confident	94.3	Very high	93 Å²	93	43 Å²	43	40%	0.404	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.2	65.2	-179.5	-166.7	-167.5	134.4	-72	0	111.5	Q53 V57	Q53-K55 PolarHBondContact O-N 3.11Å; K55-V57 PolarHBondContact O-N 2.93Å
56	Q	92.4	Very high	94.4	Very high	89 Å²	89	47.4 Å²	47.4	42%	0.416	25%	0.245	S	C	.	.			trans	-49.5	125.5	165.7	-65.4	-177.9	11.6	0	0	110.8	E49 A51 N87	E49-Q56 WeakPolarHBondContact OE1-CB 3.4Å; E49-Q56 WeakPolarHBondContact OE2-CA 3.22Å; A51-Q56 PolarHBondContact O-NE2 3.33Å; Q56-N87 VanDerWaalsContact CD-ND2 3.28Å; Q56-N87 PolarHBondContact OE1-ND2 2.88Å
57	V	92.8	Very high	94.4	Very high	13 Å²	13	53.7 Å²	53.7	8%	0.079	27%	0.269	C	S	.	.			trans	-115.5	-23.8	176.8	-68.4	0	0	0	0	113	F29 E49 K55 K59 M60 E61 G166	F29-V57 HydrophobicContact CB-CG2 4.29Å; E49-V57 WeakPolarHBondContact OE2-CG2 3.5Å; E49-V57 PolarHBondContact OE2-N 2.93Å; K55-V57 PolarHBondContact O-N 2.93Å; V57-K59 PolarHBondContact O-N 2.57Å; V57-K59 VanDerWaalsContact O-N 3.13Å; V57-M60 WeakPolarHBondContact O-CA 3.15Å; V57-M60 WeakPolarHBondContact O-CB 3.41Å; V57-M60 PolarHBondContact O-N 2.87Å; V57-E61 PolarHBondContact O-N 3.35Å; V57-G166 WeakPolarHBondContact CG1-O 3.32Å
58	L	93.7	Very high	94.5	Very high	6 Å²	6	53 Å²	53	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-62.8	-27.9	-171.5	-152.4	72.6	0	0	0	112.2	K47 E49 M60 E61 V62 N87 I89	K47-L58 HydrophobicContact CB-CD1 4.39Å; K47-L58 HydrophobicContact CD-CD1 3.87Å; K47-L58 HydrophobicContact CG-CD1 4.04Å; E49-L58 HydrophobicContact CG-CB 3.82Å; E49-L58 HydrophobicContact CG-CD2 4.29Å; E49-L58 VanDerWaalsContact OE1-CB 3.27Å; E49-L58 WeakPolarHBondContact OE1-CB 3.41Å; E49-L58 PolarHBondContact OE1-N 3.26Å; E49-L58 PolarHBondContact OE2-N 2.82Å; L58-M60 VanDerWaalsContact C-N 3.28Å; L58-M60 PolarHBondContact O-N 2.99Å; L58-E61 PolarHBondContact O-N 3.43Å; L58-V62 VanDerWaalsContact O-CG2 3.3Å; L58-V62 WeakPolarHBondContact O-CG2 3.49Å; L58-V62 PolarHBondContact O-N 2.81Å; L58-N87 HydrophobicContact CD2-CB 4.13Å; L58-I89 HydrophobicContact CD1-CG2 3.74Å; L58-I89 HydrophobicContact CD2-CB 4.3Å; L58-I89 HydrophobicContact CD2-CG2 4.1Å; L58-I89 HydrophobicContact CG-CB 4.36Å; L58-I89 HydrophobicContact CG-CG2 4.03Å
59	K	94.3	Very high	94.5	Very high	142 Å²	142	56.2 Å²	56.2	62%	0.617	28%	0.281	S	S	*	.	H	α-helix	trans	-57.6	-37.2	169.7	-178.1	175.8	178.1	177.6	0	112.9	V57 A63	V57-K59 PolarHBondContact O-N 2.57Å; V57-K59 VanDerWaalsContact O-N 3.13Å; K59-A63 PolarHBondContact O-N 2.83Å
60	M	93.6	Very high	94.5	Very high	84 Å²	84	60.5 Å²	60.5	41%	0.414	33%	0.325	S	S	.	.	H	α-helix	trans	-75.1	-42.5	176.3	-174.5	58.3	63.4	0	0	111	V57 L58 V62 A63 V64 F134	V57-M60 WeakPolarHBondContact O-CA 3.15Å; V57-M60 WeakPolarHBondContact O-CB 3.41Å; V57-M60 PolarHBondContact O-N 2.87Å; L58-M60 VanDerWaalsContact C-N 3.28Å; L58-M60 PolarHBondContact O-N 2.99Å; M60-V62 PolarHBondContact O-N 3.21Å; M60-A63 WeakPolarHBondContact O-CB 3.41Å; M60-A63 PolarHBondContact O-N 2.9Å; M60-V64 WeakPolarHBondContact O-CG2 3.45Å; M60-V64 PolarHBondContact O-N 2.82Å; M60-F134 HydrophobicContact SD-CE1 3.63Å; M60-F134 HydrophobicContact SD-CZ 4.37Å
61	E	95.5	Very high	94.5	Very high	4 Å²	4	63.3 Å²	63.3	2%	0.019	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-40.7	179.1	178.6	157.1	-152.7	0	0	112.6	K47 V57 L58 A63 V64 L65 D164 F165	K47-E61 IonicContact NZ-OE1 3.16Å; K47-E61 PolarHBondContact NZ-OE1 2.85Å; K47-E61 IonicContact NZ-OE2 3.38Å; K47-E61 PolarHBondContact NZ-OE2 3.13Å; V57-E61 PolarHBondContact O-N 3.35Å; L58-E61 PolarHBondContact O-N 3.43Å; E61-A63 VanDerWaalsContact C-N 3.32Å; E61-A63 PolarHBondContact O-N 2.91Å; E61-V64 PolarHBondContact O-N 3.37Å; E61-L65 VanDerWaalsContact O-CB 3.27Å; E61-L65 WeakPolarHBondContact O-CB 3.39Å; E61-L65 PolarHBondContact O-N 2.85Å; E61-D164 WeakPolarHBondContact OE1-CA 3.33Å; E61-F165 HydrophobicContact CB-CB 4.29Å; E61-F165 HydrophobicContact CG-CB 4.02Å; E61-F165 HydrophobicContact CG-CD2 4.49Å; E61-F165 PolarHBondContact OE1-N 3.21Å; E61-F165 VanDerWaalsContact OE1-N 3.12Å
62	V	96.7	Very high	94.6	Very high	24 Å²	24	65 Å²	65	15%	0.145	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-43.1	169	171.5	0	0	0	0	111.2	L58 M60 K66 F77 C80 I89	L58-V62 VanDerWaalsContact O-CG2 3.3Å; L58-V62 WeakPolarHBondContact O-CG2 3.49Å; L58-V62 PolarHBondContact O-N 2.81Å; M60-V62 PolarHBondContact O-N 3.21Å; V62-K66 HydrophobicContact CG1-CD 4.18Å; V62-K66 HydrophobicContact CG1-CG 4.42Å; V62-K66 VanDerWaalsContact O-CB 3.31Å; V62-K66 WeakPolarHBondContact O-CB 3.27Å; V62-K66 WeakPolarHBondContact O-CG 3.42Å; V62-K66 PolarHBondContact O-N 2.98Å; V62-F77 HydrophobicContact CG1-CE2 4.22Å; V62-C80 HydrophobicContact CG2-CB 4.02Å; V62-I89 HydrophobicContact CB-CD1 4.3Å; V62-I89 HydrophobicContact CG2-CB 4.05Å; V62-I89 HydrophobicContact CG2-CD1 3.57Å; V62-I89 HydrophobicContact CG2-CG1 3.88Å
63	A	96.4	Very high	94.9	Very high	37 Å²	37	58.7 Å²	58.7	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-69	-38.4	-178.4	0	0	0	0	0	112.7	K59 M60 E61 R67	K59-A63 PolarHBondContact O-N 2.83Å; M60-A63 WeakPolarHBondContact O-CB 3.41Å; M60-A63 PolarHBondContact O-N 2.9Å; E61-A63 VanDerWaalsContact C-N 3.32Å; E61-A63 PolarHBondContact O-N 2.91Å; A63-R67 WeakPolarHBondContact O-CG 3.39Å; A63-R67 PolarHBondContact O-N 3.19Å
64	V	97.7	Very high	95.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.8	-50.8	173.6	176.2	0	0	0	0	110.4	M60 E61 K66 R67 L68 F134 F165 A168	M60-V64 WeakPolarHBondContact O-CG2 3.45Å; M60-V64 PolarHBondContact O-N 2.82Å; E61-V64 PolarHBondContact O-N 3.37Å; V64-K66 VanDerWaalsContact C-N 3.32Å; V64-K66 PolarHBondContact O-N 3.46Å; V64-R67 PolarHBondContact O-N 2.85Å; V64-R67 VanDerWaalsContact O-N 3.11Å; V64-L68 HydrophobicContact CG1-CD1 3.72Å; V64-L68 HydrophobicContact CG1-CG 4.39Å; V64-L68 WeakPolarHBondContact O-CG 3.29Å; V64-L68 PolarHBondContact O-N 2.95Å; V64-F134 HydrophobicContact CG2-CD1 3.48Å; V64-F134 VanDerWaalsContact CG2-CD1 3.48Å; V64-F134 HydrophobicContact CG2-CD2 4.14Å; V64-F134 HydrophobicContact CG2-CE1 3.55Å; V64-F134 HydrophobicContact CG2-CE2 4.2Å; V64-F134 HydrophobicContact CG2-CG 3.8Å; V64-F134 HydrophobicContact CG2-CZ 3.93Å; V64-F165 HydrophobicContact CB-CB 4.08Å; V64-F165 HydrophobicContact CB-CG 4.17Å; V64-F165 HydrophobicContact CG1-CB 3.98Å; V64-F165 HydrophobicContact CG1-CD1 3.61Å; V64-F165 HydrophobicContact CG1-CD2 4.1Å; V64-F165 HydrophobicContact CG1-CE1 4.11Å; V64-F165 HydrophobicContact CG1-CG 3.61Å; V64-A168 HydrophobicContact CG2-CB 4.12Å
65	L	97.6	Very high	95.5	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-40.5	-178	-170.4	66.4	0	0	0	111.8	E61 L68 Q69 T74 C75 F77 I89 M91 F165	E61-L65 VanDerWaalsContact O-CB 3.27Å; E61-L65 WeakPolarHBondContact O-CB 3.39Å; E61-L65 PolarHBondContact O-N 2.85Å; L65-L68 PolarHBondContact O-N 3.03Å; L65-Q69 WeakPolarHBondContact O-CG 3.49Å; L65-Q69 PolarHBondContact O-N 3.2Å; L65-Q69 PolarHBondContact O-NE2 2.75Å; L65-T74 HydrophobicContact CD1-CG2 3.72Å; L65-C75 HydrophobicContact CD1-CB 4.19Å; L65-C75 WeakPolarHBondContact CD1-O 3.33Å; L65-F77 HydrophobicContact CD2-CB 4.32Å; L65-F77 HydrophobicContact CD2-CD2 4.3Å; L65-F77 HydrophobicContact CG-CB 4.47Å; L65-I89 HydrophobicContact CD2-CD1 3.68Å; L65-M91 HydrophobicContact CD2-CB 4.18Å; L65-M91 HydrophobicContact CD2-CE 4.25Å; L65-M91 HydrophobicContact CD2-SD 4.31Å; L65-F165 HydrophobicContact CD1-CE2 3.94Å
66	K	97.4	Very high	95.9	Very high	97 Å²	97	49.7 Å²	49.7	42%	0.422	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-41.8	174	-78.3	-170.4	174.7	-165.4	0	112.8	V62 V64 L68 Q69 F77	V62-K66 HydrophobicContact CG1-CD 4.18Å; V62-K66 HydrophobicContact CG1-CG 4.42Å; V62-K66 VanDerWaalsContact O-CB 3.31Å; V62-K66 WeakPolarHBondContact O-CB 3.27Å; V62-K66 WeakPolarHBondContact O-CG 3.42Å; V62-K66 PolarHBondContact O-N 2.98Å; V64-K66 VanDerWaalsContact C-N 3.32Å; V64-K66 PolarHBondContact O-N 3.46Å; K66-L68 PolarHBondContact O-N 2.89Å; K66-Q69 PolarHBondContact O-N 2.81Å; K66-F77 HydrophobicContact CG-CD2 4.18Å; K66-F77 HydrophobicContact CG-CE2 4.33Å; K66-F77 HydrophobicContact CG-CG 4.31Å
67	R	97.1	Very high	96.1	Very high	131 Å²	131	47.1 Å²	47.1	49%	0.494	25%	0.248	S	C	.	.	H	α-helix	trans	-69.9	-19.4	177.1	-74.1	175.4	179.5	-166.7	3	113.7	A63 V64 V132	A63-R67 WeakPolarHBondContact O-CG 3.39Å; A63-R67 PolarHBondContact O-N 3.19Å; V64-R67 PolarHBondContact O-N 2.85Å; V64-R67 VanDerWaalsContact O-N 3.11Å; R67-V132 HydrophobicContact CB-CB 4.36Å
68	L	97.8	Very high	96.2	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-4.9	177.1	-69.2	171.3	0	0	0	114.1	V64 L65 K66 R71 T74 N128 V129 V132 F165	V64-L68 HydrophobicContact CG1-CD1 3.72Å; V64-L68 HydrophobicContact CG1-CG 4.39Å; V64-L68 WeakPolarHBondContact O-CG 3.29Å; V64-L68 PolarHBondContact O-N 2.95Å; L65-L68 PolarHBondContact O-N 3.03Å; K66-L68 PolarHBondContact O-N 2.89Å; L68-R71 VanDerWaalsContact O-CB 3.3Å; L68-R71 WeakPolarHBondContact O-CB 3.41Å; L68-R71 PolarHBondContact O-N 2.91Å; L68-R71 VanDerWaalsContact O-N 3.11Å; L68-T74 HydrophobicContact CB-CG2 3.46Å; L68-T74 VanDerWaalsContact CB-CG2 3.46Å; L68-T74 HydrophobicContact CD1-CG2 4.32Å; L68-N128 HydrophobicContact CD2-CB 4.33Å; L68-V129 HydrophobicContact CD1-CG2 4.09Å; L68-V129 HydrophobicContact CD2-CG2 4.42Å; L68-V132 HydrophobicContact CD2-CG1 4.19Å; L68-V132 HydrophobicContact CD2-CG2 3.58Å; L68-V132 HydrophobicContact CG-CG2 4.09Å; L68-F165 HydrophobicContact CD1-CE1 3.82Å; L68-F165 HydrophobicContact CD1-CE2 4.1Å; L68-F165 HydrophobicContact CD1-CZ 3.53Å
69	Q	97.1	Very high	96.3	Very high	69 Å²	69	48 Å²	48	32%	0.322	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	144.2	179.3	-63	-55.1	-76.7	0	0	111.6	L65 K66 R71 C75 F77	L65-Q69 WeakPolarHBondContact O-CG 3.49Å; L65-Q69 PolarHBondContact O-N 3.2Å; L65-Q69 PolarHBondContact O-NE2 2.75Å; K66-Q69 PolarHBondContact O-N 2.81Å; Q69-R71 PolarHBondContact O-N 3.33Å; Q69-C75 PolarHBondContact NE2-O 2.85Å; Q69-F77 HydrophobicContact CG-CB 4.16Å
70	G	94.5	Very high	96.4	Very high	91 Å²	91	43.5 Å²	43.5	94%	0.938	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.7	-7.3	-172.1	0	0	0	0	0	114.9
71	R	96.3	Very high	96.5	Very high	88 Å²	88	40.3 Å²	40.3	33%	0.332	23%	0.229	S	C	.	.	S	Bend	trans	-94.5	145.2	174.4	-61.1	176.8	175.4	-96.4	0.8	111.6	L68 Q69 T74 N128	L68-R71 VanDerWaalsContact O-CB 3.3Å; L68-R71 WeakPolarHBondContact O-CB 3.41Å; L68-R71 PolarHBondContact O-N 2.91Å; L68-R71 VanDerWaalsContact O-N 3.11Å; Q69-R71 PolarHBondContact O-N 3.33Å; R71-T74 PolarHBondContact O-OG1 2.88Å; R71-N128 HydrophobicContact CB-CB 4.48Å; R71-N128 WeakPolarHBondContact CD-OD1 3.27Å; R71-N128 PolarHBondContact NH1-OD1 2.98Å
72	A	95.8	Very high	96.5	Very high	53 Å²	53	47.7 Å²	47.7	44%	0.438	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	158.4	172	0	0	0	0	0	112.3	T74 N128	A72-T74 VanDerWaalsContact C-N 3.26Å; A72-T74 PolarHBondContact O-N 3.39Å; A72-T74 PolarHBondContact O-OG1 2.79Å; A72-N128 PolarHBondContact O-ND2 2.77Å
73	H	97.7	Very high	96.4	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.083	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	26.9	178	-46.8	-60.4	0	0	0	115.1	Q121 A125 I160 L162	H73-Q121 PolarHBondContact CD2-O 3.24Å; H73-A125 HydrophobicContact CB-CB 3.63Å; H73-I160 WeakPolarHBondContact CA-O 3.47Å; H73-I160 HydrophobicContact CB-CD1 4.14Å; H73-I160 WeakPolarHBondContact CB-O 3.47Å; H73-I160 PolarHBondContact ND1-O 3.2Å; H73-L162 PolarHBondContact O-N 2.83Å
74	T	96.9	Very high	96.2	Very high	15 Å²	15	56 Å²	56	9%	0.092	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-124.8	138.2	-178.7	-54.3	0	0	0	0	110.2	L65 L68 R71 A72	L65-T74 HydrophobicContact CD1-CG2 3.72Å; L68-T74 HydrophobicContact CB-CG2 3.46Å; L68-T74 VanDerWaalsContact CB-CG2 3.46Å; L68-T74 HydrophobicContact CD1-CG2 4.32Å; R71-T74 PolarHBondContact O-OG1 2.88Å; A72-T74 VanDerWaalsContact C-N 3.26Å; A72-T74 PolarHBondContact O-N 3.39Å; A72-T74 PolarHBondContact O-OG1 2.79Å
75	C	96.5	Very high	95.9	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.02	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-62.3	143.9	170.8	-66.7	0	0	0	0	111.3	L65 Q69 F77 M91 V161 L163	L65-C75 HydrophobicContact CD1-CB 4.19Å; L65-C75 WeakPolarHBondContact CD1-O 3.33Å; Q69-C75 PolarHBondContact NE2-O 2.85Å; C75-F77 PolarHBondContact O-N 2.83Å; C75-M91 HydrophobicContact CB-CB 4.14Å; C75-M91 HydrophobicContact CB-CG 4.22Å; C75-M91 HydrophobicContact CB-SD 3.99Å; C75-V161 HydrophobicContact CB-CG1 4.43Å; C75-V161 WeakPolarHBondContact SG-CG1 3.36Å; C75-L163 VanDerWaalsContact SG-CD2 3.54Å
76	R	95.7	Very high	95.8	Very high	75 Å²	75	62.4 Å²	62.4	28%	0.283	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-70.5	127.4	168.9	-172.9	166.6	75.9	106.1	-35.9	109.9	M91 S92 P152	R76-M91 CarbonylContact O-C 3.46Å; R76-M91 WeakPolarHBondContact O-CA 3.42Å; R76-M91 WeakPolarHBondContact O-CB 3.25Å; R76-S92 PolarHBondContact N-OG 3.2Å; R76-S92 PolarHBondContact O-N 2.89Å; R76-P152 PolarHBondContact NE-O 2.97Å; R76-P152 PolarHBondContact NH2-O 2.83Å
77	F	96.6	Very high	95.8	Very high	35 Å²	35	58.1 Å²	58.1	15%	0.154	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	130	168.7	176.5	-91.2	0	0	0	109.5	V62 L65 K66 Q69 C75 G79 C80 I89	V62-F77 HydrophobicContact CG1-CE2 4.22Å; L65-F77 HydrophobicContact CD2-CB 4.32Å; L65-F77 HydrophobicContact CD2-CD2 4.3Å; L65-F77 HydrophobicContact CG-CB 4.47Å; K66-F77 HydrophobicContact CG-CD2 4.18Å; K66-F77 HydrophobicContact CG-CE2 4.33Å; K66-F77 HydrophobicContact CG-CG 4.31Å; Q69-F77 HydrophobicContact CG-CB 4.16Å; C75-F77 PolarHBondContact O-N 2.83Å; F77-G79 WeakPolarHBondContact CE2-O 3.46Å; F77-G79 VanDerWaalsContact CZ-C 3.43Å; F77-C80 HydrophobicContact CE2-CB 4.07Å; F77-C80 HydrophobicContact CZ-CB 4.13Å; F77-I89 HydrophobicContact CD2-CD1 4.3Å; F77-I89 HydrophobicContact CD2-CG1 4.31Å; F77-I89 HydrophobicContact CE2-CD1 4.39Å; F77-I89 HydrophobicContact CE2-CG1 4.14Å
78	I	95.6	Very high	95.8	Very high	28 Å²	28	52.1 Å²	52.1	14%	0.144	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-37.8	179.6	-60.5	176.3	0	0	0	110.7	W18 V44 V90 P152	W18-I78 HydrophobicContact CZ2-CG2 4.14Å; V44-I78 HydrophobicContact CB-CD1 4.3Å; V44-I78 HydrophobicContact CG1-CD1 3.55Å; I78-V90 HydrophobicContact CB-CB 4.25Å; I78-V90 HydrophobicContact CB-CG1 4.03Å; I78-V90 HydrophobicContact CG2-CG1 4.07Å; I78-V90 PolarHBondContact N-O 2.92Å; I78-P152 HydrophobicContact CD1-CB 4.16Å; I78-P152 HydrophobicContact CD1-CG 3.69Å
79	G	95.4	Very high	95.8	Very high	9 Å²	9	52.1 Å²	52.1	9%	0.093	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.3	174.7	178.7	0	0	0	0	0	113.6	F77 V90	F77-G79 WeakPolarHBondContact CE2-O 3.46Å; F77-G79 VanDerWaalsContact CZ-C 3.43Å; G79-V90 PolarHBondContact N-O 2.98Å; G79-V90 VanDerWaalsContact N-O 3.13Å; G79-V90 PolarHBondContact O-N 3.13Å
80	C	97	Very high	95.8	Very high	48 Å²	48	48.8 Å²	48.8	32%	0.324	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	165.8	170.2	61.8	0	0	0	0	110.8	V62 F77 F88 I89	V62-C80 HydrophobicContact CG2-CB 4.02Å; F77-C80 HydrophobicContact CE2-CB 4.07Å; F77-C80 HydrophobicContact CZ-CB 4.13Å; C80-F88 CarbonylContact C-O 3.57Å; C80-F88 VanDerWaalsContact CA-O 3.25Å; C80-F88 WeakPolarHBondContact CA-O 3.48Å; C80-F88 WeakPolarHBondContact CB-O 3.46Å; C80-I89 HydrophobicContact CB-CG1 4.43Å
81	G	96	Very high	95.9	Very high	17 Å²	17	45.2 Å²	45.2	18%	0.175	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	-178.6	172.7	0	0	0	0	0	113	F88	G81-F88 VanDerWaalsContact CA-CE1 3.46Å; G81-F88 PolarHBondContact N-O 3.42Å; G81-F88 PolarHBondContact O-N 2.99Å
82	R	95.7	Very high	95.8	Very high	159 Å²	159	41.2 Å²	41.2	60%	0.6	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.1	172.5	-52.3	-168.7	-178.5	106.3	15.6	108.7	N87	R82-N87 WeakPolarHBondContact CB-OD1 3.39Å; R82-N87 WeakPolarHBondContact CD-OD1 3.46Å; R82-N87 HydrophobicContact CG-CB 4.36Å; R82-N87 WeakPolarHBondContact CG-OD1 3.5Å
83	N	92.9	Very high	95.8	Very high	67 Å²	67	39.3 Å²	39.3	36%	0.358	19%	0.19	S	C	.	.			trans	-144	-176.5	162.1	62.9	38.1	0	0	0	108.1	Q85 F86	N83-Q85 PolarHBondContact O-N 2.81Å; N83-Q85 WeakPolarHBondContact OD1-CA 3.32Å; N83-Q85 WeakPolarHBondContact OD1-CB 3.18Å; N83-Q85 PolarHBondContact OD1-N 3.35Å; N83-F86 PolarHBondContact N-O 2.84Å; N83-F86 WeakPolarHBondContact ND2-CE1 3.37Å; N83-F86 VanDerWaalsContact ND2-CZ 3.27Å; N83-F86 WeakPolarHBondContact ND2-CZ 3.46Å; N83-F86 PolarHBondContact OD1-N 2.9Å; N83-F86 PolarHBondContact OD1-O 2.93Å
84	E	92.4	Very high	95.8	Very high	170 Å²	170	38.6 Å²	38.6	79%	0.794	19%	0.187	S	C	*	.	S	Bend	trans	-63.5	-20.2	-178	-55.9	-178.4	154.6	0	0	114.3	Q52	Q52-E84 PolarHBondContact NE2-O 2.63Å
85	Q	92.9	Very high	95.7	Very high	130 Å²	130	38.6 Å²	38.6	61%	0.607	19%	0.19	S	C	*	.	S	Bend	trans	-99	-44.4	-173.9	-58.7	174.7	-5.2	0	0	111.9	S50 A51 N83	S50-Q85 CarbonylContact C-O 3.54Å; S50-Q85 VanDerWaalsContact CA-O 3.3Å; S50-Q85 WeakPolarHBondContact CA-O 3.45Å; S50-Q85 PolarHBondContact OG-O 2.95Å; A51-Q85 PolarHBondContact N-O 2.74Å; N83-Q85 PolarHBondContact O-N 2.81Å; N83-Q85 WeakPolarHBondContact OD1-CA 3.32Å; N83-Q85 WeakPolarHBondContact OD1-CB 3.18Å; N83-Q85 PolarHBondContact OD1-N 3.35Å
86	F	95.3	Very high	95.6	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.026	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.4	-174.5	59.6	-91.9	0	0	0	114.7	I7 V8 I14 V48 E49 N83 F88	I7-F86 HydrophobicContact CG2-CB 4.01Å; V8-F86 HydrophobicContact CG2-CD1 3.87Å; V8-F86 HydrophobicContact CG2-CD2 4.38Å; V8-F86 HydrophobicContact CG2-CE1 3.75Å; V8-F86 HydrophobicContact CG2-CE2 4.25Å; V8-F86 HydrophobicContact CG2-CG 4.2Å; V8-F86 HydrophobicContact CG2-CZ 3.95Å; I14-F86 HydrophobicContact CG2-CE2 4.15Å; I14-F86 HydrophobicContact CG2-CZ 3.76Å; V48-F86 HydrophobicContact CB-CD2 4.46Å; V48-F86 HydrophobicContact CG1-CD2 4.15Å; E49-F86 CarbonylContact O-C 3.5Å; E49-F86 WeakPolarHBondContact O-CA 3.33Å; E49-F86 VanDerWaalsContact O-CB 3.25Å; E49-F86 WeakPolarHBondContact O-CB 3.25Å; N83-F86 PolarHBondContact N-O 2.84Å; N83-F86 WeakPolarHBondContact ND2-CE1 3.37Å; N83-F86 VanDerWaalsContact ND2-CZ 3.27Å; N83-F86 WeakPolarHBondContact ND2-CZ 3.46Å; N83-F86 PolarHBondContact OD1-N 2.9Å; N83-F86 PolarHBondContact OD1-O 2.93Å; F86-F88 HydrophobicContact CD2-CB 4.17Å; F86-F88 HydrophobicContact CD2-CD1 4.22Å; F86-F88 HydrophobicContact CE2-CB 4.3Å; F86-F88 AromaticContact CE2-CD1 3.93Å; F86-F88 HydrophobicContact CE2-CD1 3.93Å; F86-F88 HydrophobicContact CE2-CG 4.45Å
87	N	96.8	Very high	95.7	Very high	7 Å²	7	38.7 Å²	38.7	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	146.7	160.7	-59	-31.6	0	0	0	108.7	V48 E49 Q56 L58 R82	V48-N87 VanDerWaalsContact CA-O 3.3Å; V48-N87 WeakPolarHBondContact CA-O 3.4Å; E49-N87 HydrophobicContact CG-CB 3.74Å; E49-N87 PolarHBondContact N-O 2.89Å; E49-N87 PolarHBondContact O-N 2.92Å; E49-N87 PolarHBondContact OE1-ND2 3.08Å; Q56-N87 VanDerWaalsContact CD-ND2 3.28Å; Q56-N87 PolarHBondContact OE1-ND2 2.88Å; L58-N87 HydrophobicContact CD2-CB 4.13Å; R82-N87 WeakPolarHBondContact CB-OD1 3.39Å; R82-N87 WeakPolarHBondContact CD-OD1 3.46Å; R82-N87 HydrophobicContact CG-CB 4.36Å; R82-N87 WeakPolarHBondContact CG-OD1 3.5Å
88	F	97	Very high	95.8	Very high	6 Å²	6	37 Å²	37	3%	0.026	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.9	176.8	72.2	-91.4	0	0	0	114	I14 K15 W18 V46 K47 V48 C80 G81 F86 V90	I14-F88 HydrophobicContact CD1-CB 4.36Å; I14-F88 HydrophobicContact CD1-CD1 4Å; I14-F88 HydrophobicContact CD1-CD2 3.52Å; I14-F88 HydrophobicContact CD1-CE1 4.1Å; I14-F88 HydrophobicContact CD1-CE2 3.64Å; I14-F88 HydrophobicContact CD1-CG 3.71Å; I14-F88 HydrophobicContact CD1-CZ 3.92Å; K15-F88 HydrophobicContact CD-CZ 4.08Å; K15-F88 HydrophobicContact CG-CZ 4.13Å; W18-F88 HydrophobicContact CE3-CE2 4.25Å; W18-F88 AromaticContact CZ3-CE2 3.98Å; W18-F88 HydrophobicContact CZ3-CE2 3.98Å; W18-F88 HydrophobicContact CZ3-CZ 4.44Å; V46-F88 HydrophobicContact CG1-CB 4.46Å; K47-F88 WeakPolarHBondContact O-CA 3.05Å; V48-F88 HydrophobicContact CG1-CB 3.9Å; C80-F88 CarbonylContact C-O 3.57Å; C80-F88 VanDerWaalsContact CA-O 3.25Å; C80-F88 WeakPolarHBondContact CA-O 3.48Å; C80-F88 WeakPolarHBondContact CB-O 3.46Å; G81-F88 VanDerWaalsContact CA-CE1 3.46Å; G81-F88 PolarHBondContact N-O 3.42Å; G81-F88 PolarHBondContact O-N 2.99Å; F86-F88 HydrophobicContact CD2-CB 4.17Å; F86-F88 HydrophobicContact CD2-CD1 4.22Å; F86-F88 HydrophobicContact CE2-CB 4.3Å; F86-F88 AromaticContact CE2-CD1 3.93Å; F86-F88 HydrophobicContact CE2-CD1 3.93Å; F86-F88 HydrophobicContact CE2-CG 4.45Å; F88-V90 HydrophobicContact CD2-CG2 3.92Å; F88-V90 HydrophobicContact CE2-CG2 4.05Å
89	I	97.2	Very high	95.8	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.1	169.7	-169.6	179.4	0	0	0	109	V46 K47 L58 V62 L65 F77 C80 M91	V46-I89 WeakPolarHBondContact CA-O 3.45Å; K47-I89 HydrophobicContact CB-CG2 3.78Å; K47-I89 PolarHBondContact N-O 2.84Å; K47-I89 PolarHBondContact O-N 3.43Å; L58-I89 HydrophobicContact CD1-CG2 3.74Å; L58-I89 HydrophobicContact CD2-CB 4.3Å; L58-I89 HydrophobicContact CD2-CG2 4.1Å; L58-I89 HydrophobicContact CG-CB 4.36Å; L58-I89 HydrophobicContact CG-CG2 4.03Å; V62-I89 HydrophobicContact CB-CD1 4.3Å; V62-I89 HydrophobicContact CG2-CB 4.05Å; V62-I89 HydrophobicContact CG2-CD1 3.57Å; V62-I89 HydrophobicContact CG2-CG1 3.88Å; L65-I89 HydrophobicContact CD2-CD1 3.68Å; F77-I89 HydrophobicContact CD2-CD1 4.3Å; F77-I89 HydrophobicContact CD2-CG1 4.31Å; F77-I89 HydrophobicContact CE2-CD1 4.39Å; F77-I89 HydrophobicContact CE2-CG1 4.14Å; C80-I89 HydrophobicContact CB-CG1 4.43Å; I89-M91 HydrophobicContact CD1-CE 4.1Å; I89-M91 HydrophobicContact CG1-CE 4.32Å; I89-M91 HydrophobicContact CG2-CE 3.69Å
90	V	96.9	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.8	177.8	-168.8	0	0	0	0	108.7	W18 V44 A45 V46 I78 G79 F88	W18-V90 HydrophobicContact CD2-CG1 4.37Å; W18-V90 HydrophobicContact CD2-CG2 3.84Å; W18-V90 HydrophobicContact CE3-CG2 3.95Å; W18-V90 HydrophobicContact CG-CG1 4.41Å; W18-V90 HydrophobicContact CG-CG2 4.35Å; W18-V90 HydrophobicContact CH2-CG2 4.27Å; W18-V90 HydrophobicContact CZ2-CB 4.41Å; W18-V90 HydrophobicContact CZ2-CG1 4.4Å; W18-V90 HydrophobicContact CZ2-CG2 4.18Å; W18-V90 HydrophobicContact CZ3-CG2 4.17Å; V44-V90 HydrophobicContact CB-CG1 3.93Å; V44-V90 HydrophobicContact CG1-CG1 4.44Å; V44-V90 HydrophobicContact CG2-CG1 3.74Å; A45-V90 WeakPolarHBondContact O-CA 3.46Å; V46-V90 HydrophobicContact CG1-CG2 4.44Å; V46-V90 HydrophobicContact CG2-CG1 4.15Å; V46-V90 HydrophobicContact CG2-CG2 4.18Å; I78-V90 HydrophobicContact CB-CB 4.25Å; I78-V90 HydrophobicContact CB-CG1 4.03Å; I78-V90 HydrophobicContact CG2-CG1 4.07Å; I78-V90 PolarHBondContact N-O 2.92Å; G79-V90 PolarHBondContact N-O 2.98Å; G79-V90 VanDerWaalsContact N-O 3.13Å; G79-V90 PolarHBondContact O-N 3.13Å; F88-V90 HydrophobicContact CD2-CG2 3.92Å; F88-V90 HydrophobicContact CE2-CG2 4.05Å
91	M	96.6	Very high	95.9	Very high	16 Å²	16	36 Å²	36	8%	0.079	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	168.1	-178.5	69.9	-170.7	81.6	0	0	111.9	A45 L65 C75 R76 I89 L93	A45-M91 HydrophobicContact CB-CG 3.97Å; A45-M91 PolarHBondContact N-O 2.77Å; A45-M91 PolarHBondContact O-N 3.05Å; L65-M91 HydrophobicContact CD2-CB 4.18Å; L65-M91 HydrophobicContact CD2-CE 4.25Å; L65-M91 HydrophobicContact CD2-SD 4.31Å; C75-M91 HydrophobicContact CB-CB 4.14Å; C75-M91 HydrophobicContact CB-CG 4.22Å; C75-M91 HydrophobicContact CB-SD 3.99Å; R76-M91 CarbonylContact O-C 3.46Å; R76-M91 WeakPolarHBondContact O-CA 3.42Å; R76-M91 WeakPolarHBondContact O-CB 3.25Å; I89-M91 HydrophobicContact CD1-CE 4.1Å; I89-M91 HydrophobicContact CG1-CE 4.32Å; I89-M91 HydrophobicContact CG2-CE 3.69Å; M91-L93 PolarHBondContact O-N 2.64Å
92	S	95.5	Very high	96	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	128.1	173.9	53.9	0	0	0	0	111.4	R76 Q94	R76-S92 PolarHBondContact N-OG 3.2Å; R76-S92 PolarHBondContact O-N 2.89Å; S92-Q94 VanDerWaalsContact C-NE2 3.33Å; S92-Q94 PolarHBondContact O-NE2 2.63Å; S92-Q94 PolarHBondContact OG-NE2 2.78Å
93	L	96	Very high	96	Very high	13 Å²	13	34.4 Å²	34.4	7%	0.068	16%	0.164	C	C	.	.			trans	-64.6	142.8	171	-171.9	67.6	0	0	0	109.9	I24 E34 K43 A45 M91 T148 M592	I24-L93 HydrophobicContact CD1-CD1 3.82Å; E34-L93 HydrophobicContact CG-CD2 4.09Å; K43-L93 HydrophobicContact CB-CD2 3.94Å; A45-L93 HydrophobicContact CB-CD1 4.01Å; M91-L93 PolarHBondContact O-N 2.64Å; L93-T148 PolarHBondContact O-OG1 3.5Å; L93-M592 HydrophobicContact CD1-SD 3.82Å
94	Q	96.4	Very high	96.1	Very high	3 Å²	3	35.5 Å²	35.5	1%	0.014	18%	0.176	C	C	.	.			trans	-121	167.9	174.2	-43.7	-58	-52.3	0	0	109.8	S92 A145 L146 V161 L163 M592	S92-Q94 VanDerWaalsContact C-NE2 3.33Å; S92-Q94 PolarHBondContact O-NE2 2.63Å; S92-Q94 PolarHBondContact OG-NE2 2.78Å; Q94-A145 HydrophobicContact CB-CB 3.95Å; Q94-L146 WeakPolarHBondContact CB-O 3.4Å; Q94-V161 HydrophobicContact CG-CB 4.14Å; Q94-V161 HydrophobicContact CG-CG1 4.15Å; Q94-V161 HydrophobicContact CG-CG2 4.37Å; Q94-L163 HydrophobicContact CG-CD2 4.31Å; Q94-M592 HydrophobicContact CB-CE 3.6Å; Q94-M592 HydrophobicContact CG-CE 4.29Å; Q94-M592 WeakPolarHBondContact O-CB 3.46Å
95	G	94.9	Very high	96.2	Very high	15 Å²	15	28.6 Å²	28.6	16%	0.155	15%	0.146	C	C	.	.			trans	-84.1	-154.2	-179	0	0	0	0	0	114.2	A145 L146	G95-A145 WeakPolarHBondContact O-CB 3.3Å; G95-L146 WeakPolarHBondContact CA-O 3.23Å; G95-L146 PolarHBondContact N-O 3.17Å
96	K	95.4	Very high	96.1	Very high	78 Å²	78	34.5 Å²	34.5	34%	0.339	16%	0.163	S	C	.	.			trans	-57.4	140.5	-176.5	-68.5	168.2	177.9	153.2	0	112.4	L101 A145 L146 D594	K96-L101 HydrophobicContact CB-CD1 4.18Å; K96-L101 HydrophobicContact CB-CD2 4.02Å; K96-L101 HydrophobicContact CB-CG 3.89Å; K96-L101 HydrophobicContact CD-CD2 4.08Å; K96-A145 WeakPolarHBondContact O-CA 3.44Å; K96-L146 PolarHBondContact O-N 3.23Å; K96-L146 VanDerWaalsContact O-N 3.09Å; K96-D594 WeakPolarHBondContact CE-OD1 3.32Å; K96-D594 VanDerWaalsContact CE-OD2 3.3Å; K96-D594 WeakPolarHBondContact CE-OD2 3.41Å; K96-D594 IonicContact NZ-OD1 3.95Å; K96-D594 PolarHBondContact NZ-OD1 3.42Å; K96-D594 IonicContact NZ-OD2 3.24Å; K96-D594 PolarHBondContact NZ-OD2 3.24Å
97	N	97.2	Very high	96	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.016	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-80.8	156.1	175.1	74.7	63.2	0	0	0	112.5	A99 D100 L101 F144 I590	N97-A99 PolarHBondContact O-N 2.91Å; N97-A99 VanDerWaalsContact O-N 3.16Å; N97-A99 WeakPolarHBondContact OD1-CA 3.46Å; N97-A99 WeakPolarHBondContact OD1-CB 3.45Å; N97-A99 PolarHBondContact OD1-N 2.89Å; N97-D100 PolarHBondContact ND2-OD2 3.29Å; N97-D100 PolarHBondContact O-N 3.01Å; N97-D100 VanDerWaalsContact O-N 3.16Å; N97-D100 PolarHBondContact OD1-N 3.04Å; N97-D100 PolarHBondContact OD1-OD2 2.66Å; N97-L101 WeakPolarHBondContact O-CG 3.3Å; N97-L101 PolarHBondContact O-N 3.09Å; N97-F144 CarbonylContact C-O 3.43Å; N97-F144 WeakPolarHBondContact CA-O 3.47Å; N97-F144 WeakPolarHBondContact CB-O 3.38Å; N97-I590 PolarHBondContact ND2-O 3.31Å
98	L	98.1	Very high	95.9	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-20.4	-177	-59.5	-177.5	0	0	0	113.4	L101 R102 L118 M122 P141 F144 I160 F220	L98-L101 HydrophobicContact CD2-CD1 4.12Å; L98-R102 VanDerWaalsContact O-CB 3.27Å; L98-R102 WeakPolarHBondContact O-CB 3.34Å; L98-R102 PolarHBondContact O-N 2.87Å; L98-L118 HydrophobicContact CD1-CD1 4.36Å; L98-L118 HydrophobicContact CD1-CD2 4.08Å; L98-L118 HydrophobicContact CD2-CD1 4.11Å; L98-L118 HydrophobicContact CD2-CD2 3.75Å; L98-M122 HydrophobicContact CD1-SD 3.84Å; L98-P141 HydrophobicContact CB-CB 4.24Å; L98-P141 WeakPolarHBondContact CB-O 3.19Å; L98-P141 PolarHBondContact N-O 2.68Å; L98-P141 VanDerWaalsContact N-O 3.13Å; L98-F144 HydrophobicContact CD1-CB 3.63Å; L98-F144 HydrophobicContact CD1-CG 4.31Å; L98-F144 HydrophobicContact CG-CB 3.87Å; L98-F144 PolarHBondContact N-O 2.92Å; L98-I160 HydrophobicContact CD1-CG2 4.36Å; L98-I160 HydrophobicContact CD2-CG2 4.15Å; L98-F220 HydrophobicContact CB-CZ 4.04Å; L98-F220 HydrophobicContact CD1-CE2 4.18Å; L98-F220 HydrophobicContact CD1-CZ 4.05Å
99	A	97.2	Very high	95.8	Very high	7 Å²	7	46.3 Å²	46.3	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-72.3	-41.3	175.5	0	0	0	0	0	111.6	N97 R103 P141	N97-A99 PolarHBondContact O-N 2.91Å; N97-A99 VanDerWaalsContact O-N 3.16Å; N97-A99 WeakPolarHBondContact OD1-CA 3.46Å; N97-A99 WeakPolarHBondContact OD1-CB 3.45Å; N97-A99 PolarHBondContact OD1-N 2.89Å; A99-R103 WeakPolarHBondContact O-CG 3.49Å; A99-R103 PolarHBondContact O-N 3.42Å; A99-R103 VanDerWaalsContact O-N 3.11Å; A99-R103 PolarHBondContact O-NE 3.03Å; A99-R103 PolarHBondContact O-NH1 3.45Å; A99-P141 HydrophobicContact CB-CB 3.8Å; A99-P141 PolarHBondContact N-O 3.19Å
100	D	96.2	Very high	95.9	Very high	50 Å²	50	46.7 Å²	46.7	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-73.1	-42.9	175.7	-72	-51.9	0	0	0	111.7	N97 R102 R103 S104	N97-D100 PolarHBondContact ND2-OD2 3.29Å; N97-D100 PolarHBondContact O-N 3.01Å; N97-D100 VanDerWaalsContact O-N 3.16Å; N97-D100 PolarHBondContact OD1-N 3.04Å; N97-D100 PolarHBondContact OD1-OD2 2.66Å; D100-R102 VanDerWaalsContact C-N 3.29Å; D100-R102 PolarHBondContact O-N 3.33Å; D100-R103 CarbonylContact O-C 3.51Å; D100-R103 WeakPolarHBondContact O-CA 3.31Å; D100-R103 WeakPolarHBondContact O-CB 3.47Å; D100-R103 PolarHBondContact O-N 2.76Å; D100-R103 IonicContact OD1-CZ 3.72Å; D100-R103 VanDerWaalsContact OD1-CZ 3.22Å; D100-R103 IonicContact OD1-NE 2.74Å; D100-R103 PolarHBondContact OD1-NE 3.09Å; D100-R103 IonicContact OD1-NH2 2.76Å; D100-R103 PolarHBondContact OD1-NH2 3.37Å; D100-R103 IonicContact OD2-NH2 3.53Å; D100-R103 PolarHBondContact OD2-NH2 2.98Å; D100-S104 PolarHBondContact O-N 3.03Å; D100-S104 PolarHBondContact O-OG 3.09Å
101	L	97.1	Very high	95.9	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-59.1	-38.5	173.6	-69.3	164.2	0	0	0	112.3	K96 N97 L98 S104 F110 L146 W298	K96-L101 HydrophobicContact CB-CD1 4.18Å; K96-L101 HydrophobicContact CB-CD2 4.02Å; K96-L101 HydrophobicContact CB-CG 3.89Å; K96-L101 HydrophobicContact CD-CD2 4.08Å; N97-L101 WeakPolarHBondContact O-CG 3.3Å; N97-L101 PolarHBondContact O-N 3.09Å; L98-L101 HydrophobicContact CD2-CD1 4.12Å; L101-S104 WeakPolarHBondContact CA-OG 3.25Å; L101-S104 PolarHBondContact O-OG 2.89Å; L101-F110 HydrophobicContact CB-CE1 4.37Å; L101-F110 HydrophobicContact CB-CZ 4.06Å; L101-L146 HydrophobicContact CD1-CD1 3.54Å; L101-L146 HydrophobicContact CD1-CG 3.74Å; L101-L146 HydrophobicContact CD2-CD1 4.48Å; L101-W298 HydrophobicContact CB-CE3 4.15Å; L101-W298 HydrophobicContact CD1-CD2 4.43Å; L101-W298 HydrophobicContact CD1-CE3 4.44Å; L101-W298 HydrophobicContact CD2-CB 4.11Å; L101-W298 HydrophobicContact CD2-CD2 4.05Å; L101-W298 HydrophobicContact CD2-CE3 4.35Å; L101-W298 HydrophobicContact CD2-CG 3.93Å
102	R	97.6	Very high	95.9	Very high	13 Å²	13	51.5 Å²	51.5	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-67	-42.2	173.2	-171.7	176.5	67.4	82.5	-6.1	111.4	L98 D100 S104 T105 G108 F110 E219 G223	L98-R102 VanDerWaalsContact O-CB 3.27Å; L98-R102 WeakPolarHBondContact O-CB 3.34Å; L98-R102 PolarHBondContact O-N 2.87Å; D100-R102 VanDerWaalsContact C-N 3.29Å; D100-R102 PolarHBondContact O-N 3.33Å; R102-S104 VanDerWaalsContact C-N 3.32Å; R102-S104 PolarHBondContact O-N 3.16Å; R102-T105 PolarHBondContact O-N 2.83Å; R102-T105 PolarHBondContact O-OG1 3.03Å; R102-G108 WeakPolarHBondContact CD-O 3.5Å; R102-G108 VanDerWaalsContact CG-O 3.27Å; R102-G108 WeakPolarHBondContact CG-O 3.17Å; R102-G108 PolarHBondContact NH1-O 3.49Å; R102-G108 WeakPolarHBondContact O-CA 3.25Å; R102-F110 HydrophobicContact CB-CD2 4.48Å; R102-F110 HydrophobicContact CB-CE1 4.14Å; R102-F110 HydrophobicContact CB-CE2 3.83Å; R102-F110 HydrophobicContact CB-CZ 3.64Å; R102-F110 HydrophobicContact CG-CD2 4.47Å; R102-F110 HydrophobicContact CG-CE2 4.3Å; R102-F110 HydrophobicContact CG-CZ 4.39Å; R102-E219 IonicContact CZ-OE2 2.79Å; R102-E219 IonicContact NE-OE2 2.87Å; R102-E219 IonicContact NH2-OE1 3.79Å; R102-E219 PolarHBondContact NH2-OE1 2.88Å; R102-E219 IonicContact NH2-OE2 2.88Å; R102-E219 PolarHBondContact NH2-OE2 3.4Å; R102-G223 PolarHBondContact NH1-O 2.96Å
103	R	96	Very high	96	Very high	129 Å²	129	52.5 Å²	52.5	49%	0.487	25%	0.253	S	S	.	.	H	α-helix	trans	-63.2	-32.8	177.6	-80.7	-176.1	-74.3	-91.7	12.5	113.2	A99 D100 T105	A99-R103 WeakPolarHBondContact O-CG 3.49Å; A99-R103 PolarHBondContact O-N 3.42Å; A99-R103 VanDerWaalsContact O-N 3.11Å; A99-R103 PolarHBondContact O-NE 3.03Å; A99-R103 PolarHBondContact O-NH1 3.45Å; D100-R103 CarbonylContact O-C 3.51Å; D100-R103 WeakPolarHBondContact O-CA 3.31Å; D100-R103 WeakPolarHBondContact O-CB 3.47Å; D100-R103 PolarHBondContact O-N 2.76Å; D100-R103 IonicContact OD1-CZ 3.72Å; D100-R103 VanDerWaalsContact OD1-CZ 3.22Å; D100-R103 IonicContact OD1-NE 2.74Å; D100-R103 PolarHBondContact OD1-NE 3.09Å; D100-R103 IonicContact OD1-NH2 2.76Å; D100-R103 PolarHBondContact OD1-NH2 3.37Å; D100-R103 IonicContact OD2-NH2 3.53Å; D100-R103 PolarHBondContact OD2-NH2 2.98Å; R103-T105 VanDerWaalsContact C-N 3.31Å
104	S	94.8	Very high	96.1	Very high	89 Å²	89	51.9 Å²	51.9	62%	0.622	25%	0.25	S	C	*	.	H	α-helix	trans	-75.1	-15.3	176.5	54	0	0	0	0	114	D100 L101 R102	D100-S104 PolarHBondContact O-N 3.03Å; D100-S104 PolarHBondContact O-OG 3.09Å; L101-S104 WeakPolarHBondContact CA-OG 3.25Å; L101-S104 PolarHBondContact O-OG 2.89Å; R102-S104 VanDerWaalsContact C-N 3.32Å; R102-S104 PolarHBondContact O-N 3.16Å
105	T	94.8	Very high	96.2	Very high	26 Å²	26	51.7 Å²	51.7	16%	0.16	25%	0.249	C	C	.	.	S	Bend	trans	-67.1	140	172.5	68.8	0	0	0	0	111.1	R102 R103 R107 G108 C109 F110	R102-T105 PolarHBondContact O-N 2.83Å; R102-T105 PolarHBondContact O-OG1 3.03Å; R103-T105 VanDerWaalsContact C-N 3.31Å; T105-R107 PolarHBondContact O-N 2.83Å; T105-G108 PolarHBondContact O-N 3.44Å; T105-G108 VanDerWaalsContact OG1-CA 3.29Å; T105-G108 WeakPolarHBondContact OG1-CA 3.3Å; T105-G108 PolarHBondContact OG1-N 3.19Å; T105-G108 VanDerWaalsContact OG1-N 3.12Å; T105-C109 PolarHBondContact OG1-N 2.96Å; T105-C109 PolarHBondContact OG1-O 2.81Å; T105-F110 HydrophobicContact CG2-CD1 3.76Å; T105-F110 HydrophobicContact CG2-CE1 3.87Å
106	R	90.9	Very high	96.3	Very high	253 Å²	253	51 Å²	51	96%	0.955	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-24.3	-178.3	-178.2	177.2	176	-162.1	1.2	115.1
107	R	92.6	Very high	96.5	Very high	218 Å²	218	47.3 Å²	47.3	82%	0.823	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113	-2.2	-178.7	-69.2	-177.1	178.6	175.5	0.6	113.9	T105 C109	T105-R107 PolarHBondContact O-N 2.83Å; R107-C109 WeakPolarHBondContact CB-SG 3.43Å; R107-C109 PolarHBondContact O-N 2.99Å
108	G	94.7	Very high	96.5	Very high	17 Å²	17	47.2 Å²	47.2	18%	0.175	23%	0.225	C	C	.	.	S	Bend	trans	66.5	18.9	-169.7	0	0	0	0	0	113.8	R102 T105 G223	R102-G108 WeakPolarHBondContact CD-O 3.5Å; R102-G108 VanDerWaalsContact CG-O 3.27Å; R102-G108 WeakPolarHBondContact CG-O 3.17Å; R102-G108 PolarHBondContact NH1-O 3.49Å; R102-G108 WeakPolarHBondContact O-CA 3.25Å; T105-G108 PolarHBondContact O-N 3.44Å; T105-G108 VanDerWaalsContact OG1-CA 3.29Å; T105-G108 WeakPolarHBondContact OG1-CA 3.3Å; T105-G108 PolarHBondContact OG1-N 3.19Å; T105-G108 VanDerWaalsContact OG1-N 3.12Å; G108-G223 WeakPolarHBondContact O-CA 3.3Å
109	C	96.4	Very high	96.6	Very high	33 Å²	33	47.2 Å²	47.2	22%	0.223	23%	0.225	C	C	.	.			trans	-137.3	146.3	-179.6	66.9	0	0	0	0	110	T105 R107 F220	T105-C109 PolarHBondContact OG1-N 2.96Å; T105-C109 PolarHBondContact OG1-O 2.81Å; R107-C109 WeakPolarHBondContact CB-SG 3.43Å; R107-C109 PolarHBondContact O-N 2.99Å; C109-F220 CarbonylContact C-O 3.58Å; C109-F220 VanDerWaalsContact CA-O 3.31Å; C109-F220 WeakPolarHBondContact CA-O 3.12Å; C109-F220 WeakPolarHBondContact CB-O 3.17Å
110	F	97.8	Very high	96.6	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.031	23%	0.234	C	C	.	.			trans	-86.1	159.1	173.3	-67.3	-46.9	0	0	0	111.4	L101 R102 T105 T114 L118 F220 D297 W298	L101-F110 HydrophobicContact CB-CE1 4.37Å; L101-F110 HydrophobicContact CB-CZ 4.06Å; R102-F110 HydrophobicContact CB-CD2 4.48Å; R102-F110 HydrophobicContact CB-CE1 4.14Å; R102-F110 HydrophobicContact CB-CE2 3.83Å; R102-F110 HydrophobicContact CB-CZ 3.64Å; R102-F110 HydrophobicContact CG-CD2 4.47Å; R102-F110 HydrophobicContact CG-CE2 4.3Å; R102-F110 HydrophobicContact CG-CZ 4.39Å; T105-F110 HydrophobicContact CG2-CD1 3.76Å; T105-F110 HydrophobicContact CG2-CE1 3.87Å; F110-T114 HydrophobicContact CB-CG2 3.81Å; F110-T114 HydrophobicContact CD1-CG2 3.81Å; F110-T114 HydrophobicContact CD2-CG2 4.18Å; F110-T114 HydrophobicContact CE1-CG2 4.4Å; F110-T114 HydrophobicContact CG-CG2 3.69Å; F110-L118 HydrophobicContact CD2-CD1 4.1Å; F110-L118 HydrophobicContact CE2-CD1 3.92Å; F110-F220 HydrophobicContact CD2-CB 4Å; F110-F220 HydrophobicContact CD2-CD1 4.17Å; F110-F220 AromaticContact CD2-CD2 3.74Å; F110-F220 HydrophobicContact CD2-CD2 3.74Å; F110-F220 HydrophobicContact CD2-CE2 4.2Å; F110-F220 AromaticContact CD2-CG 3.71Å; F110-F220 HydrophobicContact CD2-CG 3.71Å; F110-F220 HydrophobicContact CE2-CD1 4.24Å; F110-F220 HydrophobicContact CE2-CD2 4.05Å; F110-F220 HydrophobicContact CE2-CE1 4.21Å; F110-F220 HydrophobicContact CE2-CE2 4.04Å; F110-F220 HydrophobicContact CE2-CG 4.15Å; F110-F220 HydrophobicContact CE2-CZ 4.12Å; F110-F220 PolarHBondContact N-O 3.33Å; F110-D297 WeakPolarHBondContact CA-OD2 3.47Å; F110-D297 VanDerWaalsContact CB-OD2 3.26Å; F110-D297 WeakPolarHBondContact CB-OD2 3.32Å; F110-D297 HydrophobicContact CD1-CB 4.39Å; F110-D297 WeakPolarHBondContact CD1-OD2 3.39Å; F110-W298 HydrophobicContact CD1-CZ3 4.31Å; F110-W298 AromaticContact CE1-CE3 3.83Å; F110-W298 HydrophobicContact CE1-CE3 3.83Å; F110-W298 AromaticContact CE1-CZ3 3.68Å; F110-W298 HydrophobicContact CE1-CZ3 3.68Å; F110-W298 HydrophobicContact CZ-CE3 4.33Å; F110-W298 AromaticContact CZ-CZ3 3.86Å; F110-W298 HydrophobicContact CZ-CZ3 3.86Å
111	T	96.9	Very high	96.7	Very high	67 Å²	67	49 Å²	49	41%	0.411	23%	0.227	S	C	.	.			trans	-65.5	159.2	164.4	69	0	0	0	0	110.3	S113 T114 T115 D297	T111-S113 PolarHBondContact O-N 2.99Å; T111-T114 PolarHBondContact O-N 2.82Å; T111-T114 PolarHBondContact OG1-N 3.35Å; T111-T114 VanDerWaalsContact OG1-N 3.17Å; T111-T114 PolarHBondContact OG1-OG1 3.21Å; T111-T115 WeakPolarHBondContact O-CB 3.34Å; T111-T115 PolarHBondContact O-N 3.11Å; T111-T115 PolarHBondContact O-OG1 2.89Å; T111-D297 WeakPolarHBondContact CB-OD1 3.5Å; T111-D297 WeakPolarHBondContact CG2-OD1 3.49Å; T111-D297 PolarHBondContact N-OD2 3.04Å; T111-D297 PolarHBondContact OG1-OD1 3.21Å
112	I	97.1	Very high	96.8	Very high	51 Å²	51	48.6 Å²	48.6	26%	0.262	23%	0.226	S	C	.	.	H	α-helix	trans	-68.7	-26.5	176.2	-46.2	-179.2	0	0	0	110.8	T115 V116 I221 P253 Y284	I112-T115 PolarHBondContact O-N 2.77Å; I112-V116 HydrophobicContact CG2-CG2 3.97Å; I112-V116 WeakPolarHBondContact O-CB 3.45Å; I112-V116 WeakPolarHBondContact O-CG2 3.32Å; I112-V116 PolarHBondContact O-N 2.74Å; I112-I221 HydrophobicContact CG1-CG1 4.49Å; I112-I221 HydrophobicContact CG2-CD1 4.49Å; I112-P253 HydrophobicContact CG2-CG 3.73Å; I112-Y284 HydrophobicContact CB-CE1 4.43Å; I112-Y284 HydrophobicContact CG2-CD1 4.5Å; I112-Y284 HydrophobicContact CG2-CE1 3.54Å
113	S	97.8	Very high	96.9	Very high	23 Å²	23	48 Å²	48	16%	0.161	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-54.3	172.5	173.1	0	0	0	0	111.3	T111 T115 V116 R117 I290	T111-S113 PolarHBondContact O-N 2.99Å; S113-T115 VanDerWaalsContact C-N 3.34Å; S113-T115 PolarHBondContact O-N 2.88Å; S113-V116 PolarHBondContact O-N 2.91Å; S113-R117 PolarHBondContact O-N 2.95Å; S113-R117 PolarHBondContact O-NE 2.87Å; S113-R117 VanDerWaalsContact O-NE 3.17Å; S113-R117 PolarHBondContact OG-NE 3.37Å; S113-R117 PolarHBondContact OG-NH2 3.34Å; S113-I290 WeakPolarHBondContact OG-CG2 3.42Å
114	T	98.2	Very high	97	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.1	-45.8	174.2	-73.4	0	0	0	0	111.2	F110 T111 V116 L118 F296 D297 W298	F110-T114 HydrophobicContact CB-CG2 3.81Å; F110-T114 HydrophobicContact CD1-CG2 3.81Å; F110-T114 HydrophobicContact CD2-CG2 4.18Å; F110-T114 HydrophobicContact CE1-CG2 4.4Å; F110-T114 HydrophobicContact CG-CG2 3.69Å; T111-T114 PolarHBondContact O-N 2.82Å; T111-T114 PolarHBondContact OG1-N 3.35Å; T111-T114 VanDerWaalsContact OG1-N 3.17Å; T111-T114 PolarHBondContact OG1-OG1 3.21Å; T114-V116 PolarHBondContact O-N 2.72Å; T114-L118 HydrophobicContact CG2-CD1 3.74Å; T114-L118 HydrophobicContact CG2-CG 4.39Å; T114-L118 WeakPolarHBondContact O-CB 3.32Å; T114-L118 VanDerWaalsContact O-CG 3.25Å; T114-L118 WeakPolarHBondContact O-CG 3.34Å; T114-L118 PolarHBondContact O-N 3.05Å; T114-F296 HydrophobicContact CG2-CD1 3.94Å; T114-F296 WeakPolarHBondContact OG1-CA 3.2Å; T114-D297 WeakPolarHBondContact CB-OD1 3.5Å; T114-D297 WeakPolarHBondContact CB-OD2 3.4Å; T114-D297 PolarHBondContact OG1-N 3.37Å; T114-D297 VanDerWaalsContact OG1-N 3.09Å; T114-D297 PolarHBondContact OG1-OD1 3.42Å; T114-D297 PolarHBondContact OG1-OD2 2.78Å; T114-W298 HydrophobicContact CG2-CH2 4.07Å; T114-W298 HydrophobicContact CG2-CZ3 3.66Å
115	T	98.3	Very high	97.2	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-44.9	-177.9	-57.8	0	0	0	0	113.1	T111 I112 S113 A119 L217 F220 I221	T111-T115 WeakPolarHBondContact O-CB 3.34Å; T111-T115 PolarHBondContact O-N 3.11Å; T111-T115 PolarHBondContact O-OG1 2.89Å; I112-T115 PolarHBondContact O-N 2.77Å; S113-T115 VanDerWaalsContact C-N 3.34Å; S113-T115 PolarHBondContact O-N 2.88Å; T115-A119 WeakPolarHBondContact O-CB 3.41Å; T115-A119 PolarHBondContact O-N 2.93Å; T115-L217 HydrophobicContact CG2-CB 4.31Å; T115-L217 HydrophobicContact CG2-CD2 3.71Å; T115-F220 HydrophobicContact CG2-CB 3.96Å; T115-F220 HydrophobicContact CG2-CD2 4.27Å; T115-I221 HydrophobicContact CG2-CD1 4.03Å; T115-I221 HydrophobicContact CG2-CG1 3.9Å
116	V	98.2	Very high	97.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-75.4	-34.8	-175.7	173.5	0	0	0	0	112	I112 S113 T114 A119 R120 F256 L281 Y284 M285	I112-V116 HydrophobicContact CG2-CG2 3.97Å; I112-V116 WeakPolarHBondContact O-CB 3.45Å; I112-V116 WeakPolarHBondContact O-CG2 3.32Å; I112-V116 PolarHBondContact O-N 2.74Å; S113-V116 PolarHBondContact O-N 2.91Å; T114-V116 PolarHBondContact O-N 2.72Å; V116-A119 WeakPolarHBondContact O-CB 3.27Å; V116-A119 PolarHBondContact O-N 3.28Å; V116-R120 PolarHBondContact O-N 3.34Å; V116-R120 VanDerWaalsContact O-N 3.07Å; V116-F256 HydrophobicContact CG2-CE2 4.18Å; V116-F256 HydrophobicContact CG2-CZ 4.36Å; V116-L281 HydrophobicContact CG1-CB 4.21Å; V116-L281 HydrophobicContact CG1-CD2 4.15Å; V116-Y284 HydrophobicContact CB-CD1 4.26Å; V116-Y284 HydrophobicContact CG1-CD1 4.18Å; V116-Y284 HydrophobicContact CG2-CD1 3.76Å; V116-Y284 HydrophobicContact CG2-CE1 4.1Å; V116-M285 HydrophobicContact CG1-CG 3.67Å; V116-M285 HydrophobicContact CG1-SD 4.03Å
117	R	98.3	Very high	97.7	Very high	1 Å²	1	28 Å²	28	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-65.2	-43.7	171.6	-71.6	179.9	-70.7	138.9	-12.8	111.7	S113 A119 R120 Q121 M285 I290 N291 D294 P295 F296	S113-R117 PolarHBondContact O-N 2.95Å; S113-R117 PolarHBondContact O-NE 2.87Å; S113-R117 VanDerWaalsContact O-NE 3.17Å; S113-R117 PolarHBondContact OG-NE 3.37Å; S113-R117 PolarHBondContact OG-NH2 3.34Å; R117-A119 VanDerWaalsContact C-N 3.34Å; R117-A119 PolarHBondContact O-N 3.45Å; R117-R120 PolarHBondContact O-N 3.31Å; R117-Q121 PolarHBondContact O-N 3.29Å; R117-M285 HydrophobicContact CG-CE 3.77Å; R117-M285 HydrophobicContact CG-SD 4.19Å; R117-I290 HydrophobicContact CG-CG2 4.25Å; R117-N291 WeakPolarHBondContact CD-O 3.38Å; R117-D294 PolarHBondContact NH1-O 2.95Å; R117-P295 PolarHBondContact NH2-O 3.05Å; R117-F296 HydrophobicContact CB-CE1 3.87Å; R117-F296 HydrophobicContact CB-CZ 4.23Å
118	L	98.6	Very high	98	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-42.2	170.3	-73.6	174.4	0	0	0	111.9	L98 F110 T114 R120 Q121 M122 I160 F220 F296 W298	L98-L118 HydrophobicContact CD1-CD1 4.36Å; L98-L118 HydrophobicContact CD1-CD2 4.08Å; L98-L118 HydrophobicContact CD2-CD1 4.11Å; L98-L118 HydrophobicContact CD2-CD2 3.75Å; F110-L118 HydrophobicContact CD2-CD1 4.1Å; F110-L118 HydrophobicContact CE2-CD1 3.92Å; T114-L118 HydrophobicContact CG2-CD1 3.74Å; T114-L118 HydrophobicContact CG2-CG 4.39Å; T114-L118 WeakPolarHBondContact O-CB 3.32Å; T114-L118 VanDerWaalsContact O-CG 3.25Å; T114-L118 WeakPolarHBondContact O-CG 3.34Å; T114-L118 PolarHBondContact O-N 3.05Å; L118-R120 VanDerWaalsContact C-N 3.34Å; L118-R120 PolarHBondContact O-N 3.11Å; L118-Q121 PolarHBondContact O-N 3.4Å; L118-M122 HydrophobicContact CB-CE 4.1Å; L118-M122 WeakPolarHBondContact O-CB 3.36Å; L118-M122 VanDerWaalsContact O-CG 3.29Å; L118-M122 WeakPolarHBondContact O-CG 3.45Å; L118-M122 PolarHBondContact O-N 3.09Å; L118-I160 HydrophobicContact CD2-CG2 3.56Å; L118-F220 HydrophobicContact CD1-CD2 4.46Å; L118-F220 HydrophobicContact CD1-CE2 4.12Å; L118-F296 HydrophobicContact CD2-CE1 4.46Å; L118-F296 HydrophobicContact CG-CE1 4.24Å; L118-W298 HydrophobicContact CD1-CH2 4.07Å; L118-W298 HydrophobicContact CD1-CZ3 4.27Å; L118-W298 HydrophobicContact CD2-CH2 4.16Å; L118-W298 HydrophobicContact CG-CH2 4.38Å
119	A	98.5	Very high	98.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.1	-43.5	178.7	0	0	0	0	0	112.3	T115 V116 R117 M122 L123 L217 L281	T115-A119 WeakPolarHBondContact O-CB 3.41Å; T115-A119 PolarHBondContact O-N 2.93Å; V116-A119 WeakPolarHBondContact O-CB 3.27Å; V116-A119 PolarHBondContact O-N 3.28Å; R117-A119 VanDerWaalsContact C-N 3.34Å; R117-A119 PolarHBondContact O-N 3.45Å; A119-M122 PolarHBondContact O-N 2.93Å; A119-L123 VanDerWaalsContact O-CB 3.29Å; A119-L123 WeakPolarHBondContact O-CB 3.3Å; A119-L123 PolarHBondContact O-N 3.34Å; A119-L217 HydrophobicContact CB-CD1 3.73Å; A119-L217 HydrophobicContact CB-CD2 3.65Å; A119-L217 HydrophobicContact CB-CG 4.36Å; A119-L281 HydrophobicContact CB-CD1 3.95Å; A119-L281 HydrophobicContact CB-CD2 3.92Å
120	R	98.4	Very high	98.3	Very high	68 Å²	68	16.5 Å²	16.5	26%	0.257	9%	0.087	S	C	.	.	H	α-helix	trans	-61	-49.1	176.8	-72.4	179.1	66.6	-175.4	-2.8	111.6	V116 R117 L118 L123 V124 H278 L281 N282 M285 E292	V116-R120 PolarHBondContact O-N 3.34Å; V116-R120 VanDerWaalsContact O-N 3.07Å; R117-R120 PolarHBondContact O-N 3.31Å; L118-R120 VanDerWaalsContact C-N 3.34Å; L118-R120 PolarHBondContact O-N 3.11Å; R120-L123 PolarHBondContact O-N 3.3Å; R120-V124 WeakPolarHBondContact O-CG2 3.34Å; R120-V124 PolarHBondContact O-N 2.95Å; R120-V124 VanDerWaalsContact O-N 3.13Å; R120-H278 PolarHBondContact O-CE1 2.86Å; R120-L281 HydrophobicContact CG-CB 3.74Å; R120-L281 HydrophobicContact CG-CD1 3.82Å; R120-L281 HydrophobicContact CG-CG 4.42Å; R120-N282 PolarHBondContact NE-OD1 3.28Å; R120-M285 WeakPolarHBondContact CD-SD 3.45Å; R120-M285 PolarHBondContact NH1-SD 3.09Å; R120-E292 IonicContact CZ-OE1 3.85Å; R120-E292 IonicContact NE-OE1 3.85Å; R120-E292 IonicContact NH1-OE1 3.23Å; R120-E292 PolarHBondContact NH1-OE1 3.31Å; R120-E292 IonicContact NH2-OE1 3.95Å
121	Q	98.5	Very high	98.3	Very high	26 Å²	26	19.2 Å²	19.2	12%	0.121	10%	0.102	C	C	.	.	H	α-helix	trans	-64.6	-42.8	179.8	-62.4	-170.5	29.5	0	0	112.3	H73 R117 L118 L123 V124 A125 R158 Q159 I160	H73-Q121 PolarHBondContact CD2-O 3.24Å; R117-Q121 PolarHBondContact O-N 3.29Å; L118-Q121 PolarHBondContact O-N 3.4Å; Q121-L123 VanDerWaalsContact C-N 3.31Å; Q121-L123 PolarHBondContact O-N 3.39Å; Q121-V124 PolarHBondContact O-N 3.11Å; Q121-A125 PolarHBondContact O-N 2.97Å; Q121-R158 PolarHBondContact NE2-O 2.88Å; Q121-R158 VanDerWaalsContact NE2-O 3.11Å; Q121-Q159 VanDerWaalsContact OE1-CA 3.29Å; Q121-I160 HydrophobicContact CB-CD1 4.11Å; Q121-I160 HydrophobicContact CB-CG1 3.48Å; Q121-I160 VanDerWaalsContact CB-CG1 3.48Å; Q121-I160 HydrophobicContact CG-CG1 4.47Å
122	M	98.8	Very high	98.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.6	-35.2	176	-69	-174	-64.8	0	0	112.3	L98 L118 A119 A125 I126 F144 I160 L213 M216 L217 F220	L98-M122 HydrophobicContact CD1-SD 3.84Å; L118-M122 HydrophobicContact CB-CE 4.1Å; L118-M122 WeakPolarHBondContact O-CB 3.36Å; L118-M122 VanDerWaalsContact O-CG 3.29Å; L118-M122 WeakPolarHBondContact O-CG 3.45Å; L118-M122 PolarHBondContact O-N 3.09Å; A119-M122 PolarHBondContact O-N 2.93Å; M122-A125 PolarHBondContact O-N 2.75Å; M122-I126 VanDerWaalsContact O-CG1 3.3Å; M122-I126 WeakPolarHBondContact O-CG1 2.94Å; M122-I126 PolarHBondContact O-N 3.27Å; M122-F144 HydrophobicContact CB-CE1 4.05Å; M122-F144 HydrophobicContact CB-CZ 4Å; M122-F144 HydrophobicContact CG-CD1 3.93Å; M122-F144 HydrophobicContact CG-CD2 4.32Å; M122-F144 HydrophobicContact CG-CE1 3.7Å; M122-F144 HydrophobicContact CG-CE2 4.15Å; M122-F144 HydrophobicContact CG-CG 4.2Å; M122-F144 HydrophobicContact CG-CZ 3.81Å; M122-F144 HydrophobicContact SD-CD1 4.48Å; M122-F144 HydrophobicContact SD-CD2 3.84Å; M122-F144 HydrophobicContact SD-CE1 4.41Å; M122-F144 HydrophobicContact SD-CE2 3.79Å; M122-F144 HydrophobicContact SD-CG 4.18Å; M122-F144 HydrophobicContact SD-CZ 4.07Å; M122-I160 HydrophobicContact CG-CD1 4.07Å; M122-L213 HydrophobicContact CB-CD1 3.98Å; M122-L213 HydrophobicContact CE-CD1 3.65Å; M122-L213 HydrophobicContact SD-CD1 4.24Å; M122-M216 HydrophobicContact CE-CE 4.17Å; M122-M216 HydrophobicContact SD-CE 3.38Å; M122-M216 WeakPolarHBondContact SD-CE 3.43Å; M122-L217 HydrophobicContact CE-CD2 3.7Å; M122-F220 HydrophobicContact CE-CE2 3.89Å; M122-F220 HydrophobicContact SD-CE2 4.48Å
123	L	98.7	Very high	98.4	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-66.1	-43.4	175.9	-174	60.3	0	0	0	111.8	A119 R120 Q121 A125 I126 E127 L210 L213 Y274 L277 L281	A119-L123 VanDerWaalsContact O-CB 3.29Å; A119-L123 WeakPolarHBondContact O-CB 3.3Å; A119-L123 PolarHBondContact O-N 3.34Å; R120-L123 PolarHBondContact O-N 3.3Å; Q121-L123 VanDerWaalsContact C-N 3.31Å; Q121-L123 PolarHBondContact O-N 3.39Å; L123-A125 VanDerWaalsContact C-N 3.33Å; L123-A125 PolarHBondContact O-N 3.12Å; L123-I126 PolarHBondContact O-N 3.28Å; L123-E127 WeakPolarHBondContact O-CB 3.31Å; L123-E127 PolarHBondContact O-N 2.69Å; L123-L210 HydrophobicContact CD1-CD2 3.61Å; L123-L213 HydrophobicContact CD1-CD2 4.33Å; L123-Y274 HydrophobicContact CD1-CD1 4.01Å; L123-L277 HydrophobicContact CD1-CD1 4.29Å; L123-L277 HydrophobicContact CD2-CB 3.67Å; L123-L281 HydrophobicContact CD2-CD1 4.11Å
124	V	98.6	Very high	98.4	Very high	48 Å²	48	14.1 Å²	14.1	29%	0.291	7%	0.073	S	C	.	.	H	α-helix	trans	-61.6	-41.3	172.6	179	0	0	0	0	111.2	R120 Q121 E127 N128	R120-V124 WeakPolarHBondContact O-CG2 3.34Å; R120-V124 PolarHBondContact O-N 2.95Å; R120-V124 VanDerWaalsContact O-N 3.13Å; Q121-V124 PolarHBondContact O-N 3.11Å; V124-E127 PolarHBondContact O-N 2.96Å; V124-N128 WeakPolarHBondContact O-CB 3.48Å; V124-N128 PolarHBondContact O-N 2.91Å; V124-N128 PolarHBondContact O-ND2 3.47Å
125	A	98.7	Very high	98.4	Very high	3 Å²	3	14.2 Å²	14.2	3%	0.025	7%	0.073	C	C	.	.	H	α-helix	trans	-62.4	-44.4	177.7	0	0	0	0	0	112.2	H73 Q121 M122 L123 N128 V129 F144 I160 L162	H73-A125 HydrophobicContact CB-CB 3.63Å; Q121-A125 PolarHBondContact O-N 2.97Å; M122-A125 PolarHBondContact O-N 2.75Å; L123-A125 VanDerWaalsContact C-N 3.33Å; L123-A125 PolarHBondContact O-N 3.12Å; A125-N128 PolarHBondContact O-N 3.03Å; A125-V129 WeakPolarHBondContact O-CG2 3.27Å; A125-V129 PolarHBondContact O-N 3.16Å; A125-F144 HydrophobicContact CB-CE1 4.2Å; A125-I160 HydrophobicContact CB-CD1 4.19Å; A125-L162 HydrophobicContact CB-CB 4.22Å; A125-L162 HydrophobicContact CB-CD2 3.96Å
126	I	98.9	Very high	98.4	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-66.5	-45.2	176.7	-70.2	165.9	0	0	0	111	M122 L123 N128 V129 H130 I139 D209 L210 L213	M122-I126 VanDerWaalsContact O-CG1 3.3Å; M122-I126 WeakPolarHBondContact O-CG1 2.94Å; M122-I126 PolarHBondContact O-N 3.27Å; L123-I126 PolarHBondContact O-N 3.28Å; I126-N128 VanDerWaalsContact C-N 3.3Å; I126-N128 PolarHBondContact O-N 3.11Å; I126-V129 PolarHBondContact O-N 2.94Å; I126-H130 WeakPolarHBondContact CG2-CE1 3.43Å; I126-H130 PolarHBondContact O-CD2 3Å; I126-H130 VanDerWaalsContact O-CG 3.29Å; I126-H130 PolarHBondContact O-N 3.06Å; I126-I139 HydrophobicContact CD1-CD1 4.15Å; I126-I139 HydrophobicContact CD1-CG1 4.18Å; I126-I139 HydrophobicContact CD1-CG2 4.01Å; I126-I139 HydrophobicContact CG1-CD1 3.8Å; I126-I139 HydrophobicContact CG1-CG1 4.24Å; I126-D209 HydrophobicContact CG2-CB 4.42Å; I126-L210 HydrophobicContact CG2-CD2 4.06Å; I126-L213 HydrophobicContact CD1-CB 4.08Å; I126-L213 HydrophobicContact CD1-CD2 4.11Å
127	E	98.7	Very high	98.4	Very high	24 Å²	24	16 Å²	16	11%	0.112	8%	0.08	C	C	.	.	H	α-helix	trans	-60.3	-39.7	174.9	173.8	158.6	-153.4	0	0	111.5	L123 V124 V129 H130 N131 R271 Y274	L123-E127 WeakPolarHBondContact O-CB 3.31Å; L123-E127 PolarHBondContact O-N 2.69Å; V124-E127 PolarHBondContact O-N 2.96Å; E127-V129 VanDerWaalsContact C-N 3.35Å; E127-V129 PolarHBondContact O-N 3.32Å; E127-H130 PolarHBondContact O-N 3.01Å; E127-N131 WeakPolarHBondContact CG-ND2 3.33Å; E127-N131 VanDerWaalsContact O-CB 3.28Å; E127-N131 WeakPolarHBondContact O-CB 3.13Å; E127-N131 VanDerWaalsContact O-CG 3.3Å; E127-N131 PolarHBondContact O-N 3.41Å; E127-N131 PolarHBondContact OE1-ND2 3.24Å; E127-R271 IonicContact OE1-CZ 3.38Å; E127-R271 IonicContact OE1-NH2 2.71Å; E127-R271 PolarHBondContact OE1-NH2 2.71Å; E127-Y274 HydrophobicContact CB-CD1 3.89Å; E127-Y274 HydrophobicContact CB-CD2 4.43Å; E127-Y274 HydrophobicContact CB-CE1 4.14Å; E127-Y274 HydrophobicContact CB-CG 4.06Å; E127-Y274 VanDerWaalsContact CD-CD2 3.48Å; E127-Y274 HydrophobicContact CG-CD1 4.43Å; E127-Y274 HydrophobicContact CG-CD2 4.08Å; E127-Y274 HydrophobicContact CG-CE2 4.34Å; E127-Y274 HydrophobicContact CG-CG 4.14Å; E127-Y274 WeakPolarHBondContact OE1-CD2 3.43Å; E127-Y274 WeakPolarHBondContact OE2-CB 3.29Å
128	N	98.5	Very high	98.4	Very high	21 Å²	21	16.1 Å²	16.1	11%	0.112	8%	0.081	C	C	.	.	H	α-helix	trans	-58.9	-42.8	176.3	-87.4	-34.4	0	0	0	112.6	L68 R71 A72 V124 A125 I126 V132	L68-N128 HydrophobicContact CD2-CB 4.33Å; R71-N128 HydrophobicContact CB-CB 4.48Å; R71-N128 WeakPolarHBondContact CD-OD1 3.27Å; R71-N128 PolarHBondContact NH1-OD1 2.98Å; A72-N128 PolarHBondContact O-ND2 2.77Å; V124-N128 WeakPolarHBondContact O-CB 3.48Å; V124-N128 PolarHBondContact O-N 2.91Å; V124-N128 PolarHBondContact O-ND2 3.47Å; A125-N128 PolarHBondContact O-N 3.03Å; I126-N128 VanDerWaalsContact C-N 3.3Å; I126-N128 PolarHBondContact O-N 3.11Å; N128-V132 PolarHBondContact O-N 3.03Å
129	V	98.7	Very high	98.4	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.012	8%	0.081	C	C	.	.	H	α-helix	trans	-64.3	-44.2	174.5	178	0	0	0	0	111.2	L68 A125 I126 E127 V132 F134 L162 F165	L68-V129 HydrophobicContact CD1-CG2 4.09Å; L68-V129 HydrophobicContact CD2-CG2 4.42Å; A125-V129 WeakPolarHBondContact O-CG2 3.27Å; A125-V129 PolarHBondContact O-N 3.16Å; I126-V129 PolarHBondContact O-N 2.94Å; E127-V129 VanDerWaalsContact C-N 3.35Å; E127-V129 PolarHBondContact O-N 3.32Å; V129-V132 VanDerWaalsContact O-CG2 3.24Å; V129-V132 WeakPolarHBondContact O-CG2 3.35Å; V129-V132 PolarHBondContact O-N 2.89Å; V129-F134 CarbonylContact C-O 3.56Å; V129-F134 HydrophobicContact CG1-CB 3.94Å; V129-F134 PolarHBondContact O-N 2.89Å; V129-F134 VanDerWaalsContact O-O 3.12Å; V129-L162 HydrophobicContact CG2-CD2 3.82Å; V129-F165 HydrophobicContact CG2-CE1 3.95Å
130	H	98.7	Very high	98.4	Very high	5 Å²	5	16.4 Å²	16.4	2%	0.023	8%	0.082	C	C	.	.	H	α-helix	trans	-67.2	-36.9	-179.9	-65.8	175.6	0	0	0	112.6	I126 E127 V132 G133 F134 F171 R206 D209 Y274	I126-H130 WeakPolarHBondContact CG2-CE1 3.43Å; I126-H130 PolarHBondContact O-CD2 3Å; I126-H130 VanDerWaalsContact O-CG 3.29Å; I126-H130 PolarHBondContact O-N 3.06Å; E127-H130 PolarHBondContact O-N 3.01Å; H130-V132 VanDerWaalsContact C-N 3.28Å; H130-V132 PolarHBondContact O-N 3.15Å; H130-G133 PolarHBondContact O-N 2.72Å; H130-G133 VanDerWaalsContact O-N 3.12Å; H130-F134 WeakPolarHBondContact CA-O 3.5Å; H130-F134 PolarHBondContact CD2-O 3.4Å; H130-F134 VanDerWaalsContact CD2-O 3.26Å; H130-F171 WeakPolarHBondContact O-CE1 3.36Å; H130-F171 WeakPolarHBondContact O-CZ 3.34Å; H130-R206 HydrophobicContact CB-CG 4.38Å; H130-R206 PolarHBondContact CE1-O 3.2Å; H130-D209 IonicContact NE2-OD2 3.6Å; H130-Y274 AromaticContact ND1-CE1 3.99Å; H130-Y274 AromaticContact ND1-CZ 3.76Å; H130-Y274 PolarHBondContact ND1-OH 2.85Å
131	N	97.6	Very high	98.4	Very high	64 Å²	64	13.2 Å²	13.2	34%	0.342	7%	0.07	S	C	.	.	H	α-helix	trans	-75	-11.2	179	-73.6	-13	0	0	0	113.7	E127 R271	E127-N131 WeakPolarHBondContact CG-ND2 3.33Å; E127-N131 VanDerWaalsContact O-CB 3.28Å; E127-N131 WeakPolarHBondContact O-CB 3.13Å; E127-N131 VanDerWaalsContact O-CG 3.3Å; E127-N131 PolarHBondContact O-N 3.41Å; E127-N131 PolarHBondContact OE1-ND2 3.24Å; N131-R271 PolarHBondContact OD1-NH1 3.22Å
132	V	97.4	Very high	98.3	Very high	24 Å²	24	12.7 Å²	12.7	15%	0.145	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	11.4	167.1	-60	0	0	0	0	113.4	R67 L68 N128 V129 H130 F134	R67-V132 HydrophobicContact CB-CB 4.36Å; L68-V132 HydrophobicContact CD2-CG1 4.19Å; L68-V132 HydrophobicContact CD2-CG2 3.58Å; L68-V132 HydrophobicContact CG-CG2 4.09Å; N128-V132 PolarHBondContact O-N 3.03Å; V129-V132 VanDerWaalsContact O-CG2 3.24Å; V129-V132 WeakPolarHBondContact O-CG2 3.35Å; V129-V132 PolarHBondContact O-N 2.89Å; H130-V132 VanDerWaalsContact C-N 3.28Å; H130-V132 PolarHBondContact O-N 3.15Å; V132-F134 HydrophobicContact CG2-CD2 4.09Å; V132-F134 VanDerWaalsContact O-CD2 3.27Å; V132-F134 WeakPolarHBondContact O-CD2 3.06Å
133	G	97.9	Very high	98.2	Very high	6 Å²	6	12.7 Å²	12.7	6%	0.062	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	12.6	172.2	0	0	0	0	0	115.7	H130 Q170 F171 T172	H130-G133 PolarHBondContact O-N 2.72Å; H130-G133 VanDerWaalsContact O-N 3.12Å; G133-Q170 CarbonylContact O-C 3.39Å; G133-Q170 VanDerWaalsContact O-CA 3.29Å; G133-Q170 WeakPolarHBondContact O-CA 3.44Å; G133-Q170 VanDerWaalsContact O-CG 3.29Å; G133-Q170 WeakPolarHBondContact O-CG 3.45Å; G133-F171 VanDerWaalsContact C-CD1 3.41Å; G133-F171 WeakPolarHBondContact O-CD1 3.5Å; G133-F171 PolarHBondContact O-N 3.28Å; G133-T172 WeakPolarHBondContact CA-OG1 3.14Å; G133-T172 PolarHBondContact O-N 3.43Å
134	F	98.4	Very high	98.2	Very high	3 Å²	3	12.7 Å²	12.7	1%	0.013	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	157.7	179.4	-68.8	-93.5	0	0	0	112.6	M60 V64 V129 H130 V132 R169 Q170 F171	M60-F134 HydrophobicContact SD-CE1 3.63Å; M60-F134 HydrophobicContact SD-CZ 4.37Å; V64-F134 HydrophobicContact CG2-CD1 3.48Å; V64-F134 VanDerWaalsContact CG2-CD1 3.48Å; V64-F134 HydrophobicContact CG2-CD2 4.14Å; V64-F134 HydrophobicContact CG2-CE1 3.55Å; V64-F134 HydrophobicContact CG2-CE2 4.2Å; V64-F134 HydrophobicContact CG2-CG 3.8Å; V64-F134 HydrophobicContact CG2-CZ 3.93Å; V129-F134 CarbonylContact C-O 3.56Å; V129-F134 HydrophobicContact CG1-CB 3.94Å; V129-F134 PolarHBondContact O-N 2.89Å; V129-F134 VanDerWaalsContact O-O 3.12Å; H130-F134 WeakPolarHBondContact CA-O 3.5Å; H130-F134 PolarHBondContact CD2-O 3.4Å; H130-F134 VanDerWaalsContact CD2-O 3.26Å; V132-F134 HydrophobicContact CG2-CD2 4.09Å; V132-F134 VanDerWaalsContact O-CD2 3.27Å; V132-F134 WeakPolarHBondContact O-CD2 3.06Å; F134-R169 CarbonylContact C-O 3.55Å; F134-R169 WeakPolarHBondContact CA-O 3.44Å; F134-Q170 HydrophobicContact CD1-CB 3.91Å; F134-Q170 VanDerWaalsContact CD1-N 3.34Å; F134-Q170 HydrophobicContact CE1-CB 3.6Å; F134-Q170 HydrophobicContact CE1-CG 4.19Å; F134-Q170 HydrophobicContact CE2-CG 4.45Å; F134-Q170 HydrophobicContact CZ-CB 4.04Å; F134-Q170 HydrophobicContact CZ-CG 4.16Å; F134-F171 WeakPolarHBondContact O-CE1 3.41Å
135	L	98.5	Very high	98.2	Very high	2 Å²	2	10.4 Å²	10.4	1%	0.01	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	148	161.6	-56.2	177.4	0	0	0	108.1	R137 A168 R169 F171 L204 R206	L135-R137 HydrophobicContact CB-CG 3.7Å; L135-A168 CarbonylContact O-C 3.53Å; L135-A168 WeakPolarHBondContact O-CA 3.35Å; L135-A168 WeakPolarHBondContact O-CB 3.29Å; L135-R169 PolarHBondContact N-O 2.63Å; L135-R169 PolarHBondContact O-N 2.63Å; L135-F171 HydrophobicContact CD1-CB 4.14Å; L135-F171 HydrophobicContact CD2-CD1 3.66Å; L135-F171 HydrophobicContact CD2-CE1 4.08Å; L135-F171 HydrophobicContact CD2-CG 4.22Å; L135-F171 HydrophobicContact CG-CB 4.05Å; L135-F171 HydrophobicContact CG-CD1 3.7Å; L135-F171 HydrophobicContact CG-CG 4.14Å; L135-L204 WeakPolarHBondContact CD1-O 3.41Å; L135-R206 HydrophobicContact CD2-CB 4.25Å; L135-R206 HydrophobicContact CD2-CG 3.67Å
136	H	98.5	Very high	98.1	Very high	2 Å²	2	11 Å²	11	1%	0.009	6%	0.058	C	C	.	.			trans	-83.2	-44.9	177.6	-165.4	-53.5	0	0	0	111.7	D138 I139 L162 L163 D164 F165 L167 D209	H136-D138 PolarHBondContact O-N 3.12Å; H136-I139 HydrophobicContact CB-CD1 3.72Å; H136-I139 HydrophobicContact CB-CG1 4.05Å; H136-L162 WeakPolarHBondContact NE2-CD1 3.3Å; H136-L163 PolarHBondContact CE1-O 3.05Å; H136-L163 PolarHBondContact NE2-O 2.79Å; H136-L163 VanDerWaalsContact NE2-O 3.09Å; H136-D164 PolarHBondContact CE1-O 3.45Å; H136-F165 AromaticContact CD2-CD1 3.92Å; H136-F165 AromaticContact CD2-CE1 3.87Å; H136-L167 CarbonylContact O-C 3.53Å; H136-D209 PolarHBondContact N-OD2 3.42Å
137	R	98.3	Very high	98	Very high	35 Å²	35	11.2 Å²	11.2	13%	0.132	6%	0.061	C	C	.	.	S	Bend	trans	61.4	18	177	-47.3	-175.3	-56.3	157.9	1.6	115.9	L135 L167 G189 L204 D209	L135-R137 HydrophobicContact CB-CG 3.7Å; R137-L167 VanDerWaalsContact CZ-O 3.24Å; R137-L167 PolarHBondContact NE-O 3.46Å; R137-L167 PolarHBondContact NH2-O 3.3Å; R137-G189 WeakPolarHBondContact O-CA 3.44Å; R137-L204 HydrophobicContact CB-CD1 3.99Å; R137-L204 HydrophobicContact CG-CB 4.45Å; R137-L204 HydrophobicContact CG-CD1 4.06Å; R137-D209 WeakPolarHBondContact CA-OD1 3.4Å; R137-D209 VanDerWaalsContact N-CG 3.35Å; R137-D209 PolarHBondContact N-OD1 2.93Å; R137-D209 PolarHBondContact N-OD2 2.91Å
138	D	97.7	Very high	97.7	Very high	4 Å²	4	11.8 Å²	11.8	2%	0.021	7%	0.066	C	C	.	.			trans	-156.4	41.9	173.6	-163.4	31.4	0	0	0	111.6	H136 K140 N143 L167 G189 T190 H587	H136-D138 PolarHBondContact O-N 3.12Å; D138-K140 PolarHBondContact O-N 3.22Å; D138-K140 IonicContact OD1-NZ 3.71Å; D138-K140 IonicContact OD2-NZ 3.33Å; D138-K140 PolarHBondContact OD2-NZ 3.13Å; D138-N143 PolarHBondContact O-ND2 2.72Å; D138-L167 HydrophobicContact CB-CB 4.35Å; D138-L167 HydrophobicContact CB-CD1 3.81Å; D138-G189 VanDerWaalsContact OD1-CA 3.24Å; D138-G189 WeakPolarHBondContact OD1-CA 3.17Å; D138-T190 WeakPolarHBondContact OD1-CB 3.39Å; D138-T190 PolarHBondContact OD1-N 3.44Å; D138-T190 PolarHBondContact OD1-OG1 3.37Å; D138-H587 IonicContact OD1-CD2 3.48Å; D138-H587 IonicContact OD1-NE2 3.98Å; D138-H587 IonicContact OD2-CD2 2.75Å; D138-H587 PolarHBondContact OD2-CD2 3.39Å
139	I	98.6	Very high	97.4	Very high	2 Å²	2	12.8 Å²	12.8	1%	0.01	8%	0.081	C	C	.	.			trans	-63.4	114.9	173.5	-67.1	-58.2	0	0	0	108.9	I126 H136 F144 L162 D209 L213 M216	I126-I139 HydrophobicContact CD1-CD1 4.15Å; I126-I139 HydrophobicContact CD1-CG1 4.18Å; I126-I139 HydrophobicContact CD1-CG2 4.01Å; I126-I139 HydrophobicContact CG1-CD1 3.8Å; I126-I139 HydrophobicContact CG1-CG1 4.24Å; H136-I139 HydrophobicContact CB-CD1 3.72Å; H136-I139 HydrophobicContact CB-CG1 4.05Å; I139-F144 HydrophobicContact CD1-CZ 4.1Å; I139-F144 HydrophobicContact CG2-CE2 4.04Å; I139-F144 HydrophobicContact CG2-CZ 4.3Å; I139-L162 HydrophobicContact CD1-CD1 4.02Å; I139-L162 HydrophobicContact CD1-CD2 4.32Å; I139-D209 HydrophobicContact CG1-CB 3.84Å; I139-D209 WeakPolarHBondContact CG1-OD1 3.15Å; I139-L213 HydrophobicContact CG2-CB 4.47Å; I139-M216 HydrophobicContact CG2-SD 3.77Å
140	K	98	Very high	97	Very high	5 Å²	5	17.6 Å²	17.6	2%	0.022	11%	0.105	C	C	.	.			trans	-158.4	160.1	-176.9	73.1	-163.5	-171.5	-151.4	0	111.2	D138 S142 N143 F144 T190 Y193 M216	D138-K140 PolarHBondContact O-N 3.22Å; D138-K140 IonicContact OD1-NZ 3.71Å; D138-K140 IonicContact OD2-NZ 3.33Å; D138-K140 PolarHBondContact OD2-NZ 3.13Å; K140-S142 VanDerWaalsContact C-N 3.26Å; K140-S142 WeakPolarHBondContact CE-OG 3.38Å; K140-S142 PolarHBondContact O-N 2.66Å; K140-S142 VanDerWaalsContact O-N 3.12Å; K140-N143 WeakPolarHBondContact CE-ND2 3.06Å; K140-N143 WeakPolarHBondContact CE-OD1 3.19Å; K140-N143 HydrophobicContact CG-CB 4.07Å; K140-N143 PolarHBondContact O-N 2.76Å; K140-F144 WeakPolarHBondContact O-CD2 3.37Å; K140-T190 HydrophobicContact CD-CG2 4.34Å; K140-T190 WeakPolarHBondContact CD-OG1 3.47Å; K140-T190 PolarHBondContact NZ-OG1 3Å; K140-Y193 HydrophobicContact CB-CD2 3.46Å; K140-Y193 VanDerWaalsContact CB-CD2 3.46Å; K140-Y193 HydrophobicContact CB-CE2 3.67Å; K140-Y193 HydrophobicContact CB-CG 4.23Å; K140-M216 VanDerWaalsContact C-SD 3.52Å; K140-M216 WeakPolarHBondContact CA-SD 3.43Å
141	P	98.2	Very high	96.4	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.006	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-62.8	-24.7	-173.1	-23.2	34.9	0	0	0	115.3	L98 A99 N143 Y193 M216 F220	L98-P141 HydrophobicContact CB-CB 4.24Å; L98-P141 WeakPolarHBondContact CB-O 3.19Å; L98-P141 PolarHBondContact N-O 2.68Å; L98-P141 VanDerWaalsContact N-O 3.13Å; A99-P141 HydrophobicContact CB-CB 3.8Å; A99-P141 PolarHBondContact N-O 3.19Å; P141-N143 VanDerWaalsContact C-N 3.32Å; P141-Y193 HydrophobicContact CG-CE1 4.15Å; P141-M216 HydrophobicContact CB-CE 4.34Å; P141-M216 HydrophobicContact CG-CE 4Å; P141-M216 HydrophobicContact CG-CG 3.98Å; P141-M216 HydrophobicContact CG-SD 4.36Å; P141-F220 HydrophobicContact CB-CE1 3.84Å; P141-F220 HydrophobicContact CB-CZ 4.07Å; P141-F220 HydrophobicContact CG-CE1 3.65Å; P141-F220 HydrophobicContact CG-CZ 4.15Å
142	S	96.2	Very high	95.6	Very high	15 Å²	15	16.1 Å²	16.1	11%	0.105	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-80.7	-12.6	177.3	68.5	0	0	0	0	113.8	K140 F144	K140-S142 VanDerWaalsContact C-N 3.26Å; K140-S142 WeakPolarHBondContact CE-OG 3.38Å; K140-S142 PolarHBondContact O-N 2.66Å; K140-S142 VanDerWaalsContact O-N 3.12Å; S142-F144 VanDerWaalsContact C-N 3.33Å
143	N	97.8	Very high	94.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-96.2	10.2	177.5	-71.8	6.3	0	0	0	111.8	D138 K140 P141 L162 L163	D138-N143 PolarHBondContact O-ND2 2.72Å; K140-N143 WeakPolarHBondContact CE-ND2 3.06Å; K140-N143 WeakPolarHBondContact CE-OD1 3.19Å; K140-N143 HydrophobicContact CG-CB 4.07Å; K140-N143 PolarHBondContact O-N 2.76Å; P141-N143 VanDerWaalsContact C-N 3.32Å; N143-L162 WeakPolarHBondContact O-CA 3.26Å; N143-L162 WeakPolarHBondContact O-CD1 3.27Å; N143-L163 WeakPolarHBondContact CB-O 3.34Å; N143-L163 PolarHBondContact O-N 2.83Å
144	F	98.3	Very high	94.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.9	167.4	-64.6	-81.8	0	0	0	108.8	N97 L98 M122 A125 I139 K140 S142 I160 V161 L162 M216	N97-F144 CarbonylContact C-O 3.43Å; N97-F144 WeakPolarHBondContact CA-O 3.47Å; N97-F144 WeakPolarHBondContact CB-O 3.38Å; L98-F144 HydrophobicContact CD1-CB 3.63Å; L98-F144 HydrophobicContact CD1-CG 4.31Å; L98-F144 HydrophobicContact CG-CB 3.87Å; L98-F144 PolarHBondContact N-O 2.92Å; M122-F144 HydrophobicContact CB-CE1 4.05Å; M122-F144 HydrophobicContact CB-CZ 4Å; M122-F144 HydrophobicContact CG-CD1 3.93Å; M122-F144 HydrophobicContact CG-CD2 4.32Å; M122-F144 HydrophobicContact CG-CE1 3.7Å; M122-F144 HydrophobicContact CG-CE2 4.15Å; M122-F144 HydrophobicContact CG-CG 4.2Å; M122-F144 HydrophobicContact CG-CZ 3.81Å; M122-F144 HydrophobicContact SD-CD1 4.48Å; M122-F144 HydrophobicContact SD-CD2 3.84Å; M122-F144 HydrophobicContact SD-CE1 4.41Å; M122-F144 HydrophobicContact SD-CE2 3.79Å; M122-F144 HydrophobicContact SD-CG 4.18Å; M122-F144 HydrophobicContact SD-CZ 4.07Å; A125-F144 HydrophobicContact CB-CE1 4.2Å; I139-F144 HydrophobicContact CD1-CZ 4.1Å; I139-F144 HydrophobicContact CG2-CE2 4.04Å; I139-F144 HydrophobicContact CG2-CZ 4.3Å; K140-F144 WeakPolarHBondContact O-CD2 3.37Å; S142-F144 VanDerWaalsContact C-N 3.33Å; F144-I160 HydrophobicContact CD1-CD1 3.59Å; F144-I160 HydrophobicContact CE1-CD1 3.99Å; F144-V161 VanDerWaalsContact CA-O 3.3Å; F144-V161 WeakPolarHBondContact CA-O 3.47Å; F144-L162 HydrophobicContact CD1-CB 4.24Å; F144-L162 HydrophobicContact CD1-CD1 3.99Å; F144-L162 HydrophobicContact CE1-CB 4.13Å; F144-L162 HydrophobicContact CE1-CD1 3.63Å; F144-L162 HydrophobicContact CE1-CD2 4.28Å; F144-L162 HydrophobicContact CE1-CG 4.23Å; F144-L162 HydrophobicContact CE2-CD1 4.42Å; F144-L162 HydrophobicContact CZ-CD1 3.88Å; F144-M216 HydrophobicContact CD2-CE 3.75Å; F144-M216 HydrophobicContact CD2-SD 4.48Å; F144-M216 HydrophobicContact CE2-CE 3.73Å; F144-M216 HydrophobicContact CE2-SD 4.04Å
145	A	97.7	Very high	93.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	151.1	176.1	0	0	0	0	0	111.6	Q94 G95 K96 I160 V161 L163 M592	Q94-A145 HydrophobicContact CB-CB 3.95Å; G95-A145 WeakPolarHBondContact O-CB 3.3Å; K96-A145 WeakPolarHBondContact O-CA 3.44Å; A145-I160 CarbonylContact O-C 3.55Å; A145-I160 VanDerWaalsContact O-CA 3.25Å; A145-I160 WeakPolarHBondContact O-CA 3.38Å; A145-V161 PolarHBondContact N-O 2.82Å; A145-V161 PolarHBondContact O-N 3.49Å; A145-L163 HydrophobicContact CB-CD1 3.77Å; A145-M592 HydrophobicContact CB-CE 3.89Å
146	L	97.4	Very high	93.7	Very high	16 Å²	16	23 Å²	23	8%	0.084	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	149.2	168.7	-63.3	178.1	0	0	0	110.4	Q94 G95 K96 L101 Q159 I160 W298	Q94-L146 WeakPolarHBondContact CB-O 3.4Å; G95-L146 WeakPolarHBondContact CA-O 3.23Å; G95-L146 PolarHBondContact N-O 3.17Å; K96-L146 PolarHBondContact O-N 3.23Å; K96-L146 VanDerWaalsContact O-N 3.09Å; L101-L146 HydrophobicContact CD1-CD1 3.54Å; L101-L146 HydrophobicContact CD1-CG 3.74Å; L101-L146 HydrophobicContact CD2-CD1 4.48Å; L146-Q159 CarbonylContact C-O 3.57Å; L146-Q159 WeakPolarHBondContact CA-O 3.34Å; L146-I160 HydrophobicContact CD2-CG2 4.09Å; L146-W298 HydrophobicContact CD1-CZ2 3.84Å; L146-W298 HydrophobicContact CD2-CH2 4.49Å; L146-W298 HydrophobicContact CD2-CZ2 3.83Å; L146-W298 HydrophobicContact CG-CZ2 4.39Å
147	G	95.9	Very high	93.5	Very high	5 Å²	5	25.9 Å²	25.9	5%	0.052	17%	0.173	C	C	.	.			trans	-58.8	160.9	166.6	0	0	0	0	0	112.4	V155 P157 Q159	G147-V155 CarbonylContact C-O 3.4Å; G147-V155 WeakPolarHBondContact CA-O 3.15Å; G147-P157 WeakPolarHBondContact O-CA 3.4Å; G147-Q159 PolarHBondContact N-O 3.42Å
148	T	93.9	Very high	93.3	Very high	36 Å²	36	27.5 Å²	27.5	22%	0.221	18%	0.179	C	C	.	.			trans	-88.1	-21.8	175	38.9	0	0	0	0	113.5	L93 I150 V155	L93-T148 PolarHBondContact O-OG1 3.5Å; T148-I150 VanDerWaalsContact CB-O 3.31Å; T148-I150 WeakPolarHBondContact CB-O 3.04Å; T148-I150 PolarHBondContact O-N 3.45Å; T148-I150 PolarHBondContact OG1-O 3.46Å; T148-V155 PolarHBondContact N-O 3.39Å
149	G	92.7	Very high	93.3	Very high	41 Å²	41	31.3 Å²	31.3	42%	0.423	20%	0.197	S	C	.	.	S	Bend	trans	69.1	-23.1	-165	0	0	0	0	0	115	A154 V155	G149-A154 WeakPolarHBondContact O-CB 3.41Å; G149-V155 WeakPolarHBondContact CA-O 3.49Å; G149-V155 PolarHBondContact N-O 2.88Å
150	I	89.9	Confident	93.3	Very high	104 Å²	104	31.2 Å²	31.2	53%	0.533	20%	0.196	S	C	.	.	S	Bend	trans	-119.3	155.5	178.7	61.1	172.9	0	0	0	112	T148 A154	T148-I150 VanDerWaalsContact CB-O 3.31Å; T148-I150 WeakPolarHBondContact CB-O 3.04Å; T148-I150 PolarHBondContact O-N 3.45Å; T148-I150 PolarHBondContact OG1-O 3.46Å; I150-A154 VanDerWaalsContact C-CB 3.47Å; I150-A154 WeakPolarHBondContact O-CB 3.25Å
151	G	86	Confident	93.3	Very high	26 Å²	26	31 Å²	31	27%	0.268	20%	0.195	S	C	.	.	S	Bend	trans	106.5	173.1	179.9	0	0	0	0	0	114.4	G153 A154	G151-G153 PolarHBondContact O-N 3.12Å; G151-A154 PolarHBondContact O-N 3.09Å; G151-A154 VanDerWaalsContact O-N 3.11Å
152	P	81.2	Confident	93.3	Very high	11 Å²	11	31 Å²	31	7%	0.071	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	99.2	-171.9	23.7	-32.7	0	0	0	112.1	Q42 V44 R76 I78	Q42-P152 HydrophobicContact CB-CG 4.46Å; V44-P152 HydrophobicContact CG1-CG 3.66Å; R76-P152 PolarHBondContact NE-O 2.97Å; R76-P152 PolarHBondContact NH2-O 2.83Å; I78-P152 HydrophobicContact CD1-CB 4.16Å; I78-P152 HydrophobicContact CD1-CG 3.69Å
153	G	80.9	Confident	93.3	Very high	40 Å²	40	30.8 Å²	30.8	41%	0.412	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	49.7	-173.4	0	0	0	0	0	112	G151	G151-G153 PolarHBondContact O-N 3.12Å
154	A	84.5	Confident	93.1	Very high	37 Å²	37	31.6 Å²	31.6	31%	0.306	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-55	142.2	176.8	0	0	0	0	0	112.8	G149 I150 G151	G149-A154 WeakPolarHBondContact O-CB 3.41Å; I150-A154 VanDerWaalsContact C-CB 3.47Å; I150-A154 WeakPolarHBondContact O-CB 3.25Å; G151-A154 PolarHBondContact O-N 3.09Å; G151-A154 VanDerWaalsContact O-N 3.11Å
155	V	91.3	Very high	93	Very high	20 Å²	20	31.9 Å²	31.9	12%	0.121	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-89.1	147.1	165.5	177.3	0	0	0	0	108.6	G147 T148 G149 Q159 V161	G147-V155 CarbonylContact C-O 3.4Å; G147-V155 WeakPolarHBondContact CA-O 3.15Å; T148-V155 PolarHBondContact N-O 3.39Å; G149-V155 WeakPolarHBondContact CA-O 3.49Å; G149-V155 PolarHBondContact N-O 2.88Å; V155-Q159 HydrophobicContact CG1-CB 3.71Å; V155-V161 HydrophobicContact CB-CG2 3.77Å; V155-V161 HydrophobicContact CG1-CG2 3.64Å; V155-V161 HydrophobicContact CG2-CG2 3.71Å
156	N	93.9	Very high	92.8	Very high	82 Å²	82	32.4 Å²	32.4	44%	0.439	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-58.1	139.1	179.7	-178.1	-69.2	0	0	0	110.9	R158 Q159	N156-R158 PolarHBondContact O-N 3.44Å; N156-R158 VanDerWaalsContact O-N 3.08Å; N156-R158 WeakPolarHBondContact OD1-CB 3.39Å; N156-R158 PolarHBondContact OD1-N 3.13Å; N156-Q159 HydrophobicContact CB-CB 4.32Å; N156-Q159 HydrophobicContact CB-CG 4.07Å; N156-Q159 WeakPolarHBondContact O-CB 3.33Å; N156-Q159 PolarHBondContact O-N 3.27Å
157	P	94.5	Very high	92.7	Very high	63 Å²	63	32.1 Å²	32.1	41%	0.409	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-13	-175.3	27.5	-35.5	0	0	0	114.8	G147	G147-P157 WeakPolarHBondContact O-CA 3.4Å
158	R	95.8	Very high	92.7	Very high	69 Å²	69	32.3 Å²	32.3	26%	0.26	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	2.2	174.1	-47	-167.2	75.4	-123.2	2.8	112.9	Q121 N156 E292 D294 F296 E299	Q121-R158 PolarHBondContact NE2-O 2.88Å; Q121-R158 VanDerWaalsContact NE2-O 3.11Å; N156-R158 PolarHBondContact O-N 3.44Å; N156-R158 VanDerWaalsContact O-N 3.08Å; N156-R158 WeakPolarHBondContact OD1-CB 3.39Å; N156-R158 PolarHBondContact OD1-N 3.13Å; R158-E292 PolarHBondContact NH1-O 3.26Å; R158-D294 PolarHBondContact NH2-O 3.36Å; R158-F296 HydrophobicContact CB-CE2 4.2Å; R158-E299 WeakPolarHBondContact CG-OE1 3.37Å; R158-E299 IonicContact CZ-OE1 2.72Å; R158-E299 IonicContact CZ-OE2 2.66Å; R158-E299 IonicContact NE-OE1 3.64Å; R158-E299 PolarHBondContact NE-OE1 2.82Å; R158-E299 IonicContact NE-OE2 3.82Å; R158-E299 PolarHBondContact NE-OE2 3.02Å; R158-E299 IonicContact NH2-OE1 4Å; R158-E299 IonicContact NH2-OE2 3.75Å; R158-E299 PolarHBondContact NH2-OE2 2.7Å
159	Q	96.9	Very high	92.9	Very high	84 Å²	84	33.6 Å²	33.6	39%	0.393	21%	0.205	S	C	.	.	S	Bend	trans	-108.2	137.2	175.1	-71.4	177.7	-16.2	0	0	110.9	Q121 L146 G147 V155 N156	Q121-Q159 VanDerWaalsContact OE1-CA 3.29Å; L146-Q159 CarbonylContact C-O 3.57Å; L146-Q159 WeakPolarHBondContact CA-O 3.34Å; G147-Q159 PolarHBondContact N-O 3.42Å; V155-Q159 HydrophobicContact CG1-CB 3.71Å; N156-Q159 HydrophobicContact CB-CB 4.32Å; N156-Q159 HydrophobicContact CB-CG 4.07Å; N156-Q159 WeakPolarHBondContact O-CB 3.33Å; N156-Q159 PolarHBondContact O-N 3.27Å
160	I	98.1	Very high	93.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	156.7	170.9	61.9	103.1	0	0	0	111.9	H73 L98 L118 Q121 M122 A125 F144 A145 L146	H73-I160 WeakPolarHBondContact CA-O 3.47Å; H73-I160 HydrophobicContact CB-CD1 4.14Å; H73-I160 WeakPolarHBondContact CB-O 3.47Å; H73-I160 PolarHBondContact ND1-O 3.2Å; L98-I160 HydrophobicContact CD1-CG2 4.36Å; L98-I160 HydrophobicContact CD2-CG2 4.15Å; L118-I160 HydrophobicContact CD2-CG2 3.56Å; Q121-I160 HydrophobicContact CB-CD1 4.11Å; Q121-I160 HydrophobicContact CB-CG1 3.48Å; Q121-I160 VanDerWaalsContact CB-CG1 3.48Å; Q121-I160 HydrophobicContact CG-CG1 4.47Å; M122-I160 HydrophobicContact CG-CD1 4.07Å; A125-I160 HydrophobicContact CB-CD1 4.19Å; F144-I160 HydrophobicContact CD1-CD1 3.59Å; F144-I160 HydrophobicContact CE1-CD1 3.99Å; A145-I160 CarbonylContact O-C 3.55Å; A145-I160 VanDerWaalsContact O-CA 3.25Å; A145-I160 WeakPolarHBondContact O-CA 3.38Å; L146-I160 HydrophobicContact CD2-CG2 4.09Å
161	V	98	Very high	93.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135.4	175.4	-179.2	0	0	0	0	109.3	C75 Q94 F144 A145 V155 L163	C75-V161 HydrophobicContact CB-CG1 4.43Å; C75-V161 WeakPolarHBondContact SG-CG1 3.36Å; Q94-V161 HydrophobicContact CG-CB 4.14Å; Q94-V161 HydrophobicContact CG-CG1 4.15Å; Q94-V161 HydrophobicContact CG-CG2 4.37Å; F144-V161 VanDerWaalsContact CA-O 3.3Å; F144-V161 WeakPolarHBondContact CA-O 3.47Å; A145-V161 PolarHBondContact N-O 2.82Å; A145-V161 PolarHBondContact O-N 3.49Å; V155-V161 HydrophobicContact CB-CG2 3.77Å; V155-V161 HydrophobicContact CG1-CG2 3.64Å; V155-V161 HydrophobicContact CG2-CG2 3.71Å; V161-L163 HydrophobicContact CG1-CD2 4.13Å
162	L	98.3	Very high	94.1	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	133.9	-179.5	-178.5	48.8	0	0	0	111.2	H73 A125 V129 H136 I139 N143 F144 F165	H73-L162 PolarHBondContact O-N 2.83Å; A125-L162 HydrophobicContact CB-CB 4.22Å; A125-L162 HydrophobicContact CB-CD2 3.96Å; V129-L162 HydrophobicContact CG2-CD2 3.82Å; H136-L162 WeakPolarHBondContact NE2-CD1 3.3Å; I139-L162 HydrophobicContact CD1-CD1 4.02Å; I139-L162 HydrophobicContact CD1-CD2 4.32Å; N143-L162 WeakPolarHBondContact O-CA 3.26Å; N143-L162 WeakPolarHBondContact O-CD1 3.27Å; F144-L162 HydrophobicContact CD1-CB 4.24Å; F144-L162 HydrophobicContact CD1-CD1 3.99Å; F144-L162 HydrophobicContact CE1-CB 4.13Å; F144-L162 HydrophobicContact CE1-CD1 3.63Å; F144-L162 HydrophobicContact CE1-CD2 4.28Å; F144-L162 HydrophobicContact CE1-CG 4.23Å; F144-L162 HydrophobicContact CE2-CD1 4.42Å; F144-L162 HydrophobicContact CZ-CD1 3.88Å; L162-F165 HydrophobicContact CD2-CE1 4.49Å; L162-F165 HydrophobicContact CG-CE1 4.17Å; L162-F165 HydrophobicContact CG-CZ 4.34Å
163	L	96.4	Very high	94.8	Very high	10 Å²	10	30.5 Å²	30.5	5%	0.052	17%	0.173	C	C	.	.			trans	-128	158.9	-167.8	-49.3	178.1	0	0	0	113	C75 Q94 H136 N143 A145 V161 I590 M592	C75-L163 VanDerWaalsContact SG-CD2 3.54Å; Q94-L163 HydrophobicContact CG-CD2 4.31Å; H136-L163 PolarHBondContact CE1-O 3.05Å; H136-L163 PolarHBondContact NE2-O 2.79Å; H136-L163 VanDerWaalsContact NE2-O 3.09Å; N143-L163 WeakPolarHBondContact CB-O 3.34Å; N143-L163 PolarHBondContact O-N 2.83Å; A145-L163 HydrophobicContact CB-CD1 3.77Å; V161-L163 HydrophobicContact CG1-CD2 4.13Å; L163-I590 HydrophobicContact CB-CD1 4.23Å; L163-I590 HydrophobicContact CD1-CG2 4.21Å; L163-M592 HydrophobicContact CD1-CE 3.63Å
164	D	94.4	Very high	95.3	Very high	17 Å²	17	33.4 Å²	33.4	9%	0.091	19%	0.193	C	C	.	.			trans	63.5	72.2	174.8	-163.9	10.8	0	0	0	115.9	K47 E61 H136 G166 I590	K47-D164 IonicContact NZ-OD1 3.79Å; K47-D164 PolarHBondContact NZ-OD1 3.17Å; E61-D164 WeakPolarHBondContact OE1-CA 3.33Å; H136-D164 PolarHBondContact CE1-O 3.45Å; D164-G166 PolarHBondContact O-N 3.23Å; D164-G166 PolarHBondContact OD1-N 3.49Å; D164-I590 HydrophobicContact CB-CD1 3.97Å
165	F	96	Very high	95.8	Very high	5 Å²	5	38.5 Å²	38.5	2%	0.022	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-78.5	10.7	172.2	-51.4	-71.9	0	0	0	113.2	E61 V64 L65 L68 V129 H136 L162 L167 A168	E61-F165 HydrophobicContact CB-CB 4.29Å; E61-F165 HydrophobicContact CG-CB 4.02Å; E61-F165 HydrophobicContact CG-CD2 4.49Å; E61-F165 PolarHBondContact OE1-N 3.21Å; E61-F165 VanDerWaalsContact OE1-N 3.12Å; V64-F165 HydrophobicContact CB-CB 4.08Å; V64-F165 HydrophobicContact CB-CG 4.17Å; V64-F165 HydrophobicContact CG1-CB 3.98Å; V64-F165 HydrophobicContact CG1-CD1 3.61Å; V64-F165 HydrophobicContact CG1-CD2 4.1Å; V64-F165 HydrophobicContact CG1-CE1 4.11Å; V64-F165 HydrophobicContact CG1-CG 3.61Å; L65-F165 HydrophobicContact CD1-CE2 3.94Å; L68-F165 HydrophobicContact CD1-CE1 3.82Å; L68-F165 HydrophobicContact CD1-CE2 4.1Å; L68-F165 HydrophobicContact CD1-CZ 3.53Å; V129-F165 HydrophobicContact CG2-CE1 3.95Å; H136-F165 AromaticContact CD2-CD1 3.92Å; H136-F165 AromaticContact CD2-CE1 3.87Å; L162-F165 HydrophobicContact CD2-CE1 4.49Å; L162-F165 HydrophobicContact CG-CE1 4.17Å; L162-F165 HydrophobicContact CG-CZ 4.34Å; F165-L167 PolarHBondContact O-N 3.38Å; F165-L167 VanDerWaalsContact O-N 3.13Å; F165-A168 HydrophobicContact CB-CB 4.08Å; F165-A168 WeakPolarHBondContact O-CB 3.46Å; F165-A168 PolarHBondContact O-N 2.9Å
166	G	93.1	Very high	95.9	Very high	11 Å²	11	39.6 Å²	39.6	11%	0.113	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-63.4	-16.2	179.2	0	0	0	0	0	114.7	V57 D164	V57-G166 WeakPolarHBondContact CG1-O 3.32Å; D164-G166 PolarHBondContact O-N 3.23Å; D164-G166 PolarHBondContact OD1-N 3.49Å
167	L	94.7	Very high	96	Very high	10 Å²	10	40 Å²	40	5%	0.052	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-106.1	3.5	171.8	-68.1	-179.9	0	0	0	114.2	F29 H136 R137 D138 F165	F29-L167 HydrophobicContact CE2-CD2 4.28Å; H136-L167 CarbonylContact O-C 3.53Å; R137-L167 VanDerWaalsContact CZ-O 3.24Å; R137-L167 PolarHBondContact NE-O 3.46Å; R137-L167 PolarHBondContact NH2-O 3.3Å; D138-L167 HydrophobicContact CB-CB 4.35Å; D138-L167 HydrophobicContact CB-CD1 3.81Å; F165-L167 PolarHBondContact O-N 3.38Å; F165-L167 VanDerWaalsContact O-N 3.13Å
168	A	97.3	Very high	96.2	Very high	10 Å²	10	39.5 Å²	39.5	8%	0.083	23%	0.227	C	C	.	.			trans	-63.2	161.6	-178.8	0	0	0	0	0	113.4	V64 L135 F165	V64-A168 HydrophobicContact CG2-CB 4.12Å; L135-A168 CarbonylContact O-C 3.53Å; L135-A168 WeakPolarHBondContact O-CA 3.35Å; L135-A168 WeakPolarHBondContact O-CB 3.29Å; F165-A168 HydrophobicContact CB-CB 4.08Å; F165-A168 WeakPolarHBondContact O-CB 3.46Å; F165-A168 PolarHBondContact O-N 2.9Å
169	R	97.2	Very high	96.3	Very high	62 Å²	62	41.1 Å²	41.1	23%	0.234	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	129.8	176	174.7	166.4	176.1	64	0.9	111.3	F134 L135 F171 E203	F134-R169 CarbonylContact C-O 3.55Å; F134-R169 WeakPolarHBondContact CA-O 3.44Å; L135-R169 PolarHBondContact N-O 2.63Å; L135-R169 PolarHBondContact O-N 2.63Å; R169-F171 PolarHBondContact O-N 3.49Å; R169-E203 IonicContact CZ-OE2 3.15Å; R169-E203 VanDerWaalsContact CZ-OE2 3.23Å; R169-E203 IonicContact NE-OE1 3.76Å; R169-E203 PolarHBondContact NE-OE1 2.92Å; R169-E203 IonicContact NE-OE2 2.76Å; R169-E203 PolarHBondContact NE-OE2 2.96Å; R169-E203 IonicContact NH2-OE2 2.95Å; R169-E203 PolarHBondContact NH2-OE2 2.83Å
170	Q	97.8	Very high	96.3	Very high	44 Å²	44	41.2 Å²	41.2	21%	0.206	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	117.7	171.1	-162.6	-175.1	-8.1	0	0	109.5	G133 F134 T172 T173 R179	G133-Q170 CarbonylContact O-C 3.39Å; G133-Q170 VanDerWaalsContact O-CA 3.29Å; G133-Q170 WeakPolarHBondContact O-CA 3.44Å; G133-Q170 VanDerWaalsContact O-CG 3.29Å; G133-Q170 WeakPolarHBondContact O-CG 3.45Å; F134-Q170 HydrophobicContact CD1-CB 3.91Å; F134-Q170 VanDerWaalsContact CD1-N 3.34Å; F134-Q170 HydrophobicContact CE1-CB 3.6Å; F134-Q170 HydrophobicContact CE1-CG 4.19Å; F134-Q170 HydrophobicContact CE2-CG 4.45Å; F134-Q170 HydrophobicContact CZ-CB 4.04Å; F134-Q170 HydrophobicContact CZ-CG 4.16Å; Q170-T172 WeakPolarHBondContact CG-O 3.46Å; Q170-T172 PolarHBondContact NE2-O 2.86Å; Q170-T172 PolarHBondContact NE2-OG1 3.42Å; Q170-T173 PolarHBondContact NE2-O 3.44Å; Q170-R179 WeakPolarHBondContact O-CD 3.45Å
171	F	98.1	Very high	96.3	Very high	10 Å²	10	43.7 Å²	43.7	4%	0.044	26%	0.264	C	S	.	.			trans	-93	-12.9	175.5	73.7	-87.9	0	0	0	112.4	H130 G133 F134 L135 R169 I178 R179 R206	H130-F171 WeakPolarHBondContact O-CE1 3.36Å; H130-F171 WeakPolarHBondContact O-CZ 3.34Å; G133-F171 VanDerWaalsContact C-CD1 3.41Å; G133-F171 WeakPolarHBondContact O-CD1 3.5Å; G133-F171 PolarHBondContact O-N 3.28Å; F134-F171 WeakPolarHBondContact O-CE1 3.41Å; L135-F171 HydrophobicContact CD1-CB 4.14Å; L135-F171 HydrophobicContact CD2-CD1 3.66Å; L135-F171 HydrophobicContact CD2-CE1 4.08Å; L135-F171 HydrophobicContact CD2-CG 4.22Å; L135-F171 HydrophobicContact CG-CB 4.05Å; L135-F171 HydrophobicContact CG-CD1 3.7Å; L135-F171 HydrophobicContact CG-CG 4.14Å; R169-F171 PolarHBondContact O-N 3.49Å; F171-I178 HydrophobicContact CD2-CD1 3.77Å; F171-I178 HydrophobicContact CE2-CD1 3.59Å; F171-R179 WeakPolarHBondContact O-CB 3.49Å; F171-R179 VanDerWaalsContact O-CG 3.25Å; F171-R179 WeakPolarHBondContact O-CG 3.38Å; F171-R179 PolarHBondContact O-N 3.4Å; F171-R206 HydrophobicContact CE1-CG 4.31Å; F171-R206 HydrophobicContact CE2-CG 4.34Å; F171-R206 HydrophobicContact CZ-CG 4.1Å
172	T	98	Very high	96.3	Very high	17 Å²	17	48.6 Å²	48.6	10%	0.104	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-95.8	157.9	176.5	60.6	0	0	0	0	113.9	G133 Q170 G176 D177 R179	G133-T172 WeakPolarHBondContact CA-OG1 3.14Å; G133-T172 PolarHBondContact O-N 3.43Å; Q170-T172 WeakPolarHBondContact CG-O 3.46Å; Q170-T172 PolarHBondContact NE2-O 2.86Å; Q170-T172 PolarHBondContact NE2-OG1 3.42Å; T172-G176 WeakPolarHBondContact CG2-O 3.47Å; T172-D177 CarbonylContact C-O 3.55Å; T172-D177 WeakPolarHBondContact CA-O 3.45Å; T172-R179 VanDerWaalsContact O-CD 3.3Å; T172-R179 WeakPolarHBondContact O-CD 3.36Å
173	T	96.7	Very high	96.2	Very high	46 Å²	46	57.4 Å²	57.4	28%	0.282	32%	0.323	S	S	.	.			trans	-71.2	-176	162.4	64.3	0	0	0	0	110.7	Q170 N175 G176 D177 R179	Q170-T173 PolarHBondContact NE2-O 3.44Å; T173-N175 VanDerWaalsContact C-N 3.28Å; T173-N175 PolarHBondContact OG1-N 3.06Å; T173-G176 PolarHBondContact OG1-N 3.42Å; T173-D177 HydrophobicContact CG2-CB 3.95Å; T173-D177 PolarHBondContact N-O 2.94Å; T173-D177 PolarHBondContact OG1-N 2.91Å; T173-D177 PolarHBondContact OG1-OD2 3.07Å; T173-R179 HydrophobicContact CG2-CG 4.28Å
174	A	91.4	Very high	96.1	Very high	101 Å²	101	62 Å²	62	84%	0.835	35%	0.352	S	S	*	.	S	Bend	trans	-64.4	-35	167.5	0	0	0	0	0	111.9	G176	A174-G176 VanDerWaalsContact C-N 3.3Å; A174-G176 PolarHBondContact O-N 3.49Å
175	N	94	Very high	96.2	Very high	145 Å²	145	61.5 Å²	61.5	78%	0.775	35%	0.35	S	S	*	.	S	Bend	trans	-81.4	-8.4	-177.5	-50	1	0	0	0	113.1	T173 D177	T173-N175 VanDerWaalsContact C-N 3.28Å; T173-N175 PolarHBondContact OG1-N 3.06Å; N175-D177 WeakPolarHBondContact CB-OD2 3.4Å
176	G	93.8	Very high	96	Very high	43 Å²	43	63.1 Å²	63.1	44%	0.443	37%	0.368	S	S	.	.	S	Bend	trans	101.9	-11.7	-179.5	0	0	0	0	0	115.4	T172 T173 A174	T172-G176 WeakPolarHBondContact CG2-O 3.47Å; T173-G176 PolarHBondContact OG1-N 3.42Å; A174-G176 VanDerWaalsContact C-N 3.3Å; A174-G176 PolarHBondContact O-N 3.49Å
177	D	96.5	Very high	96.1	Very high	91 Å²	91	64.2 Å²	64.2	49%	0.487	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-60.8	150.3	-179.4	-35.2	-77	0	0	0	112.3	T172 T173 N175 R179	T172-D177 CarbonylContact C-O 3.55Å; T172-D177 WeakPolarHBondContact CA-O 3.45Å; T173-D177 HydrophobicContact CG2-CB 3.95Å; T173-D177 PolarHBondContact N-O 2.94Å; T173-D177 PolarHBondContact OG1-N 2.91Å; T173-D177 PolarHBondContact OG1-OD2 3.07Å; N175-D177 WeakPolarHBondContact CB-OD2 3.4Å; D177-R179 PolarHBondContact O-N 2.82Å
178	I	97.8	Very high	95.8	Very high	52 Å²	52	69.3 Å²	69.3	27%	0.267	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-68.2	124.3	172.8	-48.1	-57.8	0	0	0	109.5	F171 Y268 F269	F171-I178 HydrophobicContact CD2-CD1 3.77Å; F171-I178 HydrophobicContact CE2-CD1 3.59Å; I178-Y268 HydrophobicContact CG2-CD1 4.27Å; I178-Y268 HydrophobicContact CG2-CE1 3.57Å; I178-F269 HydrophobicContact CG2-CD1 4.12Å
179	R	98	Very high	95.5	Very high	103 Å²	103	69 Å²	69	39%	0.389	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-65.1	146.1	176.2	-63.1	172.5	83.7	140.2	11.5	110.4	Q170 F171 T172 T173 D177 Y268	Q170-R179 WeakPolarHBondContact O-CD 3.45Å; F171-R179 WeakPolarHBondContact O-CB 3.49Å; F171-R179 VanDerWaalsContact O-CG 3.25Å; F171-R179 WeakPolarHBondContact O-CG 3.38Å; F171-R179 PolarHBondContact O-N 3.4Å; T172-R179 VanDerWaalsContact O-CD 3.3Å; T172-R179 WeakPolarHBondContact O-CD 3.36Å; T173-R179 HydrophobicContact CG2-CG 4.28Å; D177-R179 PolarHBondContact O-N 2.82Å; R179-Y268 VanDerWaalsContact O-CE1 3.3Å; R179-Y268 WeakPolarHBondContact O-CE1 3.04Å; R179-Y268 PolarHBondContact O-OH 3.32Å; R179-Y268 VanDerWaalsContact O-OH 3.05Å
180	A	97.4	Very high	95.3	Very high	86 Å²	86	67.2 Å²	67.2	71%	0.711	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-57.7	131.1	171.8	0	0	0	0	0	111.1
181	P	97.8	Very high	95.3	Very high	51 Å²	51	65.5 Å²	65.5	33%	0.331	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-68.3	143.7	-179.2	26.8	-33.4	0	0	0	111.3	E203 Y268 F269	P181-E203 HydrophobicContact CB-CB 3.81Å; P181-E203 HydrophobicContact CB-CG 4.22Å; P181-Y268 HydrophobicContact CB-CD1 3.92Å; P181-Y268 HydrophobicContact CB-CE1 3.8Å; P181-Y268 HydrophobicContact CB-CE2 4.47Å; P181-Y268 HydrophobicContact CB-CG 4.31Å; P181-Y268 HydrophobicContact CG-CD1 4.01Å; P181-Y268 HydrophobicContact CG-CE1 4.07Å; P181-F269 HydrophobicContact CG-CE1 4.44Å; P181-F269 HydrophobicContact CG-CZ 3.82Å
182	R	97.7	Very high	95.3	Very high	104 Å²	104	66.6 Å²	66.6	39%	0.392	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-72.7	133.5	172.8	-68.6	178.2	-67.3	144.3	3	110.3	V184 E203	R182-V184 PolarHBondContact O-N 2.99Å; R182-E203 IonicContact CZ-OE1 2.68Å; R182-E203 IonicContact CZ-OE2 3.14Å; R182-E203 IonicContact NE-OE1 2.77Å; R182-E203 IonicContact NE-OE2 3.41Å; R182-E203 PolarHBondContact NE-OE2 2.83Å; R182-E203 IonicContact NH2-OE1 2.76Å; R182-E203 PolarHBondContact NH2-OE1 3.32Å; R182-E203 IonicContact NH2-OE2 2.66Å; R182-E203 PolarHBondContact NH2-OE2 2.68Å
183	Q	95.5	Very high	95.3	Very high	188 Å²	188	66.7 Å²	66.7	88%	0.879	38%	0.377	S	S	*	.	S	Bend	trans	-52.2	-38.5	176.9	-63.4	-64	-13.5	0	0	112.9
184	V	95.4	Very high	95.4	Very high	106 Å²	106	64.9 Å²	64.9	64%	0.642	37%	0.366	S	S	*	.			trans	-133.5	128.8	167.9	-176.1	0	0	0	0	109.4	R182 N201	R182-V184 PolarHBondContact O-N 2.99Å; V184-N201 HydrophobicContact CG1-CB 4.25Å
185	A	95.6	Very high	95.7	Very high	7 Å²	7	60.1 Å²	60.1	6%	0.058	33%	0.327	C	S	.	.			trans	-123.1	89.9	172.9	0	0	0	0	0	109	F187 N201 E203	A185-F187 PolarHBondContact O-N 3Å; A185-N201 CarbonylContact C-O 3.52Å; A185-N201 PolarHBondContact N-O 2.82Å; A185-N201 CarbonylContact O-C 3.42Å; A185-N201 WeakPolarHBondContact O-CA 3.2Å; A185-E203 HydrophobicContact CB-CB 4.22Å
186	G	93	Very high	95.9	Very high	38 Å²	38	54.8 Å²	54.8	39%	0.392	30%	0.3	S	S	.	.			trans	-50	126.9	-179.5	0	0	0	0	0	112.8	R188	G186-R188 PolarHBondContact O-NH1 3.47Å
187	F	95.1	Very high	96.1	Very high	34 Å²	34	54.2 Å²	54.2	15%	0.149	29%	0.286	C	S	.	.			trans	-36.4	136.9	-172.7	176.5	-87.4	0	0	0	115.5	A185 G189 V191 A194 A198 N201 K233	A185-F187 PolarHBondContact O-N 3Å; F187-G189 WeakPolarHBondContact CE1-O 3.49Å; F187-G189 WeakPolarHBondContact CZ-O 3.23Å; F187-V191 HydrophobicContact CE1-CG2 3.97Å; F187-V191 HydrophobicContact CZ-CB 4.43Å; F187-V191 HydrophobicContact CZ-CG2 3.74Å; F187-A194 HydrophobicContact CE2-CB 3.62Å; F187-A194 HydrophobicContact CZ-CB 3.97Å; F187-A198 HydrophobicContact CD2-CB 4.16Å; F187-A198 WeakPolarHBondContact CD2-O 3.31Å; F187-A198 HydrophobicContact CE2-CB 4.27Å; F187-N201 PolarHBondContact N-OD1 3.01Å; F187-K233 HydrophobicContact CB-CD 4.47Å; F187-K233 HydrophobicContact CD1-CD 4.5Å; F187-K233 HydrophobicContact CD2-CD 4.45Å; F187-K233 HydrophobicContact CG-CD 4.24Å
188	R	87.1	Confident	96.2	Very high	117 Å²	117	50 Å²	50	44%	0.442	27%	0.265	S	S	.	.			trans	-138.8	158.5	171.9	-61.5	-63.4	178.8	-102.1	7.5	109	G186	G186-R188 PolarHBondContact O-NH1 3.47Å
189	G	91.3	Very high	96.2	Very high	4 Å²	4	48.1 Å²	48.1	4%	0.041	25%	0.254	C	S	.	.	S	Bend	trans	84.9	-178	179.9	0	0	0	0	0	114.2	R137 D138 F187 V191 H587	R137-G189 WeakPolarHBondContact O-CA 3.44Å; D138-G189 VanDerWaalsContact OD1-CA 3.24Å; D138-G189 WeakPolarHBondContact OD1-CA 3.17Å; F187-G189 WeakPolarHBondContact CE1-O 3.49Å; F187-G189 WeakPolarHBondContact CZ-O 3.23Å; G189-V191 PolarHBondContact O-N 3.38Å; G189-H587 PolarHBondContact O-CE1 3.19Å; G189-H587 PolarHBondContact O-NE2 3.26Å
190	T	94.2	Very high	96.1	Very high	24 Å²	24	46.8 Å²	46.8	15%	0.147	25%	0.254	C	S	.	.			trans	-86.1	115.5	-165.4	-58.7	0	0	0	0	112.2	D138 K140 R192 Y193 A194 H587	D138-T190 WeakPolarHBondContact OD1-CB 3.39Å; D138-T190 PolarHBondContact OD1-N 3.44Å; D138-T190 PolarHBondContact OD1-OG1 3.37Å; K140-T190 HydrophobicContact CD-CG2 4.34Å; K140-T190 WeakPolarHBondContact CD-OG1 3.47Å; K140-T190 PolarHBondContact NZ-OG1 3Å; T190-R192 PolarHBondContact O-N 2.84Å; T190-Y193 HydrophobicContact CG2-CD2 3.8Å; T190-Y193 HydrophobicContact CG2-CE2 3.95Å; T190-Y193 PolarHBondContact O-N 3.41Å; T190-A194 PolarHBondContact O-N 3.33Å; T190-H587 PolarHBondContact N-NE2 2.95Å; T190-H587 PolarHBondContact OG1-CD2 3.24Å; T190-H587 PolarHBondContact OG1-NE2 3.17Å
191	V	97.1	Very high	96.1	Very high	8 Å²	8	45 Å²	45	5%	0.048	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-40.7	-42.3	-176.7	172.4	0	0	0	0	114.4	F187 G189 Y193 H199 K233 V236 K240 C585	F187-V191 HydrophobicContact CE1-CG2 3.97Å; F187-V191 HydrophobicContact CZ-CB 4.43Å; F187-V191 HydrophobicContact CZ-CG2 3.74Å; G189-V191 PolarHBondContact O-N 3.38Å; V191-Y193 PolarHBondContact O-N 3.05Å; V191-H199 WeakPolarHBondContact CG1-CE1 3.42Å; V191-H199 PolarHBondContact O-NE2 3.11Å; V191-K233 HydrophobicContact CG2-CB 4.47Å; V191-K233 HydrophobicContact CG2-CG 4.46Å; V191-V236 HydrophobicContact CG1-CB 3.92Å; V191-V236 HydrophobicContact CG1-CG1 3.96Å; V191-V236 HydrophobicContact CG1-CG2 3.95Å; V191-K240 PolarHBondContact O-NZ 3.23Å; V191-C585 HydrophobicContact CG2-CB 4.34Å
192	R	97.7	Very high	96.1	Very high	34 Å²	34	47.5 Å²	47.5	13%	0.128	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-41.6	-180	-177.7	171.5	-65.9	163.5	4.3	113.5	T190 E219 L225 W227 R228 K240 D582	T190-R192 PolarHBondContact O-N 2.84Å; R192-E219 VanDerWaalsContact CD-OE1 3.3Å; R192-E219 WeakPolarHBondContact CD-OE1 3.11Å; R192-E219 IonicContact CZ-OE1 2.64Å; R192-E219 IonicContact NE-OE1 2.71Å; R192-E219 IonicContact NH1-OE1 3.23Å; R192-E219 PolarHBondContact NH1-OE1 3.23Å; R192-L225 HydrophobicContact CG-CD1 3.84Å; R192-W227 PolarHBondContact O-NE1 2.72Å; R192-R228 PolarHBondContact NH2-O 2.79Å; R192-K240 PolarHBondContact O-NZ 2.94Å; R192-D582 IonicContact CZ-OD1 3.56Å; R192-D582 IonicContact CZ-OD2 2.91Å; R192-D582 IonicContact NH1-OD1 2.76Å; R192-D582 IonicContact NH1-OD2 3.78Å; R192-D582 PolarHBondContact NH1-OD2 3.1Å; R192-D582 IonicContact NH2-OD1 2.95Å; R192-D582 PolarHBondContact NH2-OD1 3.37Å; R192-D582 IonicContact NH2-OD2 2.75Å; R192-D582 PolarHBondContact NH2-OD2 2.98Å
193	Y	98.3	Very high	96.1	Very high	19 Å²	19	43 Å²	43	8%	0.075	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-20.6	-174.6	-44.5	-77	0	0	0	112.8	K140 P141 T190 V191 S195 S212 Y215 M216 E219 L225	K140-Y193 HydrophobicContact CB-CD2 3.46Å; K140-Y193 VanDerWaalsContact CB-CD2 3.46Å; K140-Y193 HydrophobicContact CB-CE2 3.67Å; K140-Y193 HydrophobicContact CB-CG 4.23Å; P141-Y193 HydrophobicContact CG-CE1 4.15Å; T190-Y193 HydrophobicContact CG2-CD2 3.8Å; T190-Y193 HydrophobicContact CG2-CE2 3.95Å; T190-Y193 PolarHBondContact O-N 3.41Å; V191-Y193 PolarHBondContact O-N 3.05Å; Y193-S195 PolarHBondContact O-N 3.43Å; Y193-S212 WeakPolarHBondContact O-CA 3.47Å; Y193-S212 PolarHBondContact O-OG 3.39Å; Y193-Y215 WeakPolarHBondContact O-CD2 3.49Å; Y193-M216 HydrophobicContact CD1-CG 3.87Å; Y193-M216 HydrophobicContact CE1-CG 4.2Å; Y193-M216 HydrophobicContact CG-CG 4.47Å; Y193-E219 PolarHBondContact OH-OE2 3.39Å; Y193-E219 VanDerWaalsContact OH-OE2 3.11Å; Y193-L225 HydrophobicContact CD1-CD1 4.32Å; Y193-L225 HydrophobicContact CE1-CD1 4.33Å
194	A	98.3	Very high	96.3	Very high	7 Å²	7	34.9 Å²	34.9	6%	0.058	19%	0.185	C	C	.	.			trans	-52.4	138.2	179.6	0	0	0	0	0	113.8	F187 T190 A198 H199 K240	F187-A194 HydrophobicContact CE2-CB 3.62Å; F187-A194 HydrophobicContact CZ-CB 3.97Å; T190-A194 PolarHBondContact O-N 3.33Å; A194-A198 HydrophobicContact CB-CB 4.02Å; A194-H199 PolarHBondContact O-NE2 3.39Å; A194-K240 PolarHBondContact O-NZ 2.77Å
195	S	98.2	Very high	96.4	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.007	16%	0.155	C	C	.	.			trans	-67.2	168.3	-179.6	78.9	0	0	0	0	113.3	Y193 N197 A198 H199 D208	Y193-S195 PolarHBondContact O-N 3.43Å; S195-N197 VanDerWaalsContact C-N 3.26Å; S195-N197 PolarHBondContact O-N 3.36Å; S195-N197 PolarHBondContact OG-N 3.11Å; S195-A198 WeakPolarHBondContact O-CB 3.38Å; S195-A198 PolarHBondContact O-N 3.24Å; S195-A198 PolarHBondContact OG-N 2.83Å; S195-H199 PolarHBondContact O-CD2 2.83Å; S195-H199 VanDerWaalsContact O-CD2 3.28Å; S195-H199 PolarHBondContact O-N 3.31Å; S195-D208 WeakPolarHBondContact CB-OD1 3.06Å; S195-D208 VanDerWaalsContact OG-CG 3.29Å; S195-D208 PolarHBondContact OG-OD1 2.7Å
196	V	98	Very high	96.6	Very high	34 Å²	34	30.7 Å²	30.7	21%	0.206	16%	0.156	C	C	.	.	H	α-helix	trans	-58.8	-38.1	172	168.3	0	0	0	0	111.5	A198 H199 L200 K240 Q241	V196-A198 VanDerWaalsContact C-N 3.32Å; V196-A198 PolarHBondContact O-N 2.97Å; V196-H199 PolarHBondContact O-N 2.7Å; V196-L200 HydrophobicContact CG1-CD1 3.85Å; V196-L200 HydrophobicContact CG1-CG 4.37Å; V196-L200 WeakPolarHBondContact O-CG 3.46Å; V196-L200 PolarHBondContact O-N 2.68Å; V196-K240 HydrophobicContact CG2-CB 3.93Å; V196-K240 WeakPolarHBondContact CG2-O 3.38Å; V196-Q241 HydrophobicContact CG1-CG 3.54Å; V196-Q241 HydrophobicContact CG2-CG 4.24Å
197	N	98.2	Very high	96.8	Very high	30 Å²	30	29.2 Å²	29.2	16%	0.16	14%	0.139	C	C	.	.	H	α-helix	trans	-64.2	-36.8	178.5	-59.8	-52.5	0	0	0	112.2	S195 L200 N201 K202 L204 H207 D208	S195-N197 VanDerWaalsContact C-N 3.26Å; S195-N197 PolarHBondContact O-N 3.36Å; S195-N197 PolarHBondContact OG-N 3.11Å; N197-L200 CarbonylContact O-C 3.55Å; N197-L200 PolarHBondContact O-N 3.38Å; N197-N201 PolarHBondContact O-N 2.83Å; N197-N201 VanDerWaalsContact O-N 3.17Å; N197-K202 HydrophobicContact CB-CB 4.24Å; N197-K202 HydrophobicContact CB-CD 4.19Å; N197-K202 PolarHBondContact O-N 2.66Å; N197-K202 WeakPolarHBondContact OD1-CD 3.38Å; N197-K202 PolarHBondContact OD1-NZ 3.35Å; N197-L204 HydrophobicContact CB-CD2 4.33Å; N197-H207 PolarHBondContact ND2-NE2 3.45Å; N197-D208 WeakPolarHBondContact CB-OD1 3.34Å; N197-D208 PolarHBondContact ND2-OD1 3.26Å
198	A	98	Very high	97	Very high	4 Å²	4	27.8 Å²	27.8	3%	0.033	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-45.7	173.7	0	0	0	0	0	112.1	F187 A194 S195 V196 L200 N201 L204	F187-A198 HydrophobicContact CD2-CB 4.16Å; F187-A198 WeakPolarHBondContact CD2-O 3.31Å; F187-A198 HydrophobicContact CE2-CB 4.27Å; A194-A198 HydrophobicContact CB-CB 4.02Å; S195-A198 WeakPolarHBondContact O-CB 3.38Å; S195-A198 PolarHBondContact O-N 3.24Å; S195-A198 PolarHBondContact OG-N 2.83Å; V196-A198 VanDerWaalsContact C-N 3.32Å; V196-A198 PolarHBondContact O-N 2.97Å; A198-L200 VanDerWaalsContact C-N 3.29Å; A198-L200 PolarHBondContact O-N 3.41Å; A198-N201 WeakPolarHBondContact O-CA 3.44Å; A198-N201 PolarHBondContact O-N 3.33Å; A198-L204 HydrophobicContact CB-CD1 4.21Å; A198-L204 HydrophobicContact CB-CD2 3.71Å
199	H	98	Very high	97.6	Very high	12 Å²	12	22.3 Å²	22.3	6%	0.056	11%	0.113	C	C	.	.	H	α-helix	trans	-58.8	-41.7	176	-82.2	-70.4	0	0	0	112.4	V191 A194 S195 V196 N201 K233 V236 G237 K240	V191-H199 WeakPolarHBondContact CG1-CE1 3.42Å; V191-H199 PolarHBondContact O-NE2 3.11Å; A194-H199 PolarHBondContact O-NE2 3.39Å; S195-H199 PolarHBondContact O-CD2 2.83Å; S195-H199 VanDerWaalsContact O-CD2 3.28Å; S195-H199 PolarHBondContact O-N 3.31Å; V196-H199 PolarHBondContact O-N 2.7Å; H199-N201 PolarHBondContact O-N 3.45Å; H199-N201 PolarHBondContact O-ND2 3.24Å; H199-K233 PolarHBondContact CE1-O 2.85Å; H199-K233 PolarHBondContact ND1-O 2.76Å; H199-K233 VanDerWaalsContact ND1-O 3.15Å; H199-K233 PolarHBondContact O-NZ 3.01Å; H199-V236 WeakPolarHBondContact NE2-CG1 3.43Å; H199-G237 WeakPolarHBondContact ND1-CA 3.2Å; H199-K240 PolarHBondContact NE2-NZ 3.35Å
200	L	97.1	Very high	97.9	Very high	74 Å²	74	22.1 Å²	22.1	39%	0.387	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-1.8	173	-67.8	174.3	0	0	0	114.6	V196 N197 A198 K202	V196-L200 HydrophobicContact CG1-CD1 3.85Å; V196-L200 HydrophobicContact CG1-CG 4.37Å; V196-L200 WeakPolarHBondContact O-CG 3.46Å; V196-L200 PolarHBondContact O-N 2.68Å; N197-L200 CarbonylContact O-C 3.55Å; N197-L200 PolarHBondContact O-N 3.38Å; A198-L200 VanDerWaalsContact C-N 3.29Å; A198-L200 PolarHBondContact O-N 3.41Å; L200-K202 VanDerWaalsContact C-N 3.26Å; L200-K202 HydrophobicContact CB-CG 4.17Å; L200-K202 PolarHBondContact O-N 3.12Å
201	N	97.3	Very high	98.1	Very high	50 Å²	50	22.2 Å²	22.2	27%	0.267	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	31.5	-177	-41	-83.4	0	0	0	114.2	V184 A185 F187 N197 A198 H199 K233	V184-N201 HydrophobicContact CG1-CB 4.25Å; A185-N201 CarbonylContact C-O 3.52Å; A185-N201 PolarHBondContact N-O 2.82Å; A185-N201 CarbonylContact O-C 3.42Å; A185-N201 WeakPolarHBondContact O-CA 3.2Å; F187-N201 PolarHBondContact N-OD1 3.01Å; N197-N201 PolarHBondContact O-N 2.83Å; N197-N201 VanDerWaalsContact O-N 3.17Å; A198-N201 WeakPolarHBondContact O-CA 3.44Å; A198-N201 PolarHBondContact O-N 3.33Å; H199-N201 PolarHBondContact O-N 3.45Å; H199-N201 PolarHBondContact O-ND2 3.24Å; N201-K233 PolarHBondContact OD1-NZ 3.1Å
202	K	97.4	Very high	98.2	Very high	103 Å²	103	22.2 Å²	22.2	45%	0.448	11%	0.109	S	C	.	.	P	Polyproline II helix	trans	-75.5	157.4	168.9	-59.7	-179	-171.5	169.6	0	110.1	N197 L200 L204	N197-K202 HydrophobicContact CB-CB 4.24Å; N197-K202 HydrophobicContact CB-CD 4.19Å; N197-K202 PolarHBondContact O-N 2.66Å; N197-K202 WeakPolarHBondContact OD1-CD 3.38Å; N197-K202 PolarHBondContact OD1-NZ 3.35Å; L200-K202 VanDerWaalsContact C-N 3.26Å; L200-K202 HydrophobicContact CB-CG 4.17Å; L200-K202 PolarHBondContact O-N 3.12Å; K202-L204 PolarHBondContact O-N 3.38Å
203	E	98.1	Very high	98.3	Very high	10 Å²	10	20.6 Å²	20.6	5%	0.047	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-62.7	131.8	167.5	-172.9	76.4	-76	0	0	109.7	R169 P181 R182 A185 Y268	R169-E203 IonicContact CZ-OE2 3.15Å; R169-E203 VanDerWaalsContact CZ-OE2 3.23Å; R169-E203 IonicContact NE-OE1 3.76Å; R169-E203 PolarHBondContact NE-OE1 2.92Å; R169-E203 IonicContact NE-OE2 2.76Å; R169-E203 PolarHBondContact NE-OE2 2.96Å; R169-E203 IonicContact NH2-OE2 2.95Å; R169-E203 PolarHBondContact NH2-OE2 2.83Å; P181-E203 HydrophobicContact CB-CB 3.81Å; P181-E203 HydrophobicContact CB-CG 4.22Å; R182-E203 IonicContact CZ-OE1 2.68Å; R182-E203 IonicContact CZ-OE2 3.14Å; R182-E203 IonicContact NE-OE1 2.77Å; R182-E203 IonicContact NE-OE2 3.41Å; R182-E203 PolarHBondContact NE-OE2 2.83Å; R182-E203 IonicContact NH2-OE1 2.76Å; R182-E203 PolarHBondContact NH2-OE1 3.32Å; R182-E203 IonicContact NH2-OE2 2.66Å; R182-E203 PolarHBondContact NH2-OE2 2.68Å; A185-E203 HydrophobicContact CB-CB 4.22Å; E203-Y268 HydrophobicContact CB-CE2 4.34Å; E203-Y268 HydrophobicContact CG-CD2 4.32Å; E203-Y268 HydrophobicContact CG-CE2 3.65Å
204	L	98.3	Very high	98.3	Very high	16 Å²	16	19.7 Å²	19.7	8%	0.084	10%	0.099	C	C	.	.	P	Polyproline II helix	trans	-82.2	142.1	-175.1	-56.1	-172.9	0	0	0	111.5	L135 R137 N197 A198 K202 D208 Y268	L135-L204 WeakPolarHBondContact CD1-O 3.41Å; R137-L204 HydrophobicContact CB-CD1 3.99Å; R137-L204 HydrophobicContact CG-CB 4.45Å; R137-L204 HydrophobicContact CG-CD1 4.06Å; N197-L204 HydrophobicContact CB-CD2 4.33Å; A198-L204 HydrophobicContact CB-CD1 4.21Å; A198-L204 HydrophobicContact CB-CD2 3.71Å; K202-L204 PolarHBondContact O-N 3.38Å; L204-D208 VanDerWaalsContact CA-OD2 3.24Å; L204-D208 WeakPolarHBondContact CA-OD2 3.39Å; L204-D208 HydrophobicContact CB-CB 4.14Å; L204-D208 HydrophobicContact CD2-CB 4.23Å; L204-Y268 WeakPolarHBondContact O-CD2 3.29Å; L204-Y268 WeakPolarHBondContact O-CE2 3.3Å
205	G	98.4	Very high	98.3	Very high	2 Å²	2	19.4 Å²	19.4	2%	0.021	10%	0.097	C	C	.	.			trans	-110.1	-175.7	174.8	0	0	0	0	0	113.1	H207 D208	G205-H207 WeakPolarHBondContact CA-ND1 3.48Å; G205-H207 PolarHBondContact O-N 3.14Å; G205-D208 PolarHBondContact N-OD2 3.21Å; G205-D208 PolarHBondContact O-N 3.07Å; G205-D208 VanDerWaalsContact O-N 3.14Å
206	R	98.8	Very high	98.3	Very high	24 Å²	24	19.3 Å²	19.3	9%	0.091	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-30.1	179.1	-67.6	173.6	-74.9	-139.3	-8.4	112.9	H130 L135 F171 F269 D270 P272	H130-R206 HydrophobicContact CB-CG 4.38Å; H130-R206 PolarHBondContact CE1-O 3.2Å; L135-R206 HydrophobicContact CD2-CB 4.25Å; L135-R206 HydrophobicContact CD2-CG 3.67Å; F171-R206 HydrophobicContact CE1-CG 4.31Å; F171-R206 HydrophobicContact CE2-CG 4.34Å; F171-R206 HydrophobicContact CZ-CG 4.1Å; R206-F269 PolarHBondContact NH2-O 2.96Å; R206-D270 VanDerWaalsContact CZ-O 3.27Å; R206-D270 PolarHBondContact NE-O 3.21Å; R206-D270 PolarHBondContact NH2-O 3.46Å; R206-P272 HydrophobicContact CB-CG 3.71Å
207	H	98.7	Very high	98.3	Very high	7 Å²	7	17.7 Å²	17.7	3%	0.032	9%	0.086	C	C	.	.	H	α-helix	trans	-69.3	-28.1	176.1	64.5	-44.4	0	0	0	113	N197 G205 L210 W211 L266	N197-H207 PolarHBondContact ND2-NE2 3.45Å; G205-H207 WeakPolarHBondContact CA-ND1 3.48Å; G205-H207 PolarHBondContact O-N 3.14Å; H207-L210 CarbonylContact O-C 3.49Å; H207-L210 WeakPolarHBondContact O-CB 3.45Å; H207-L210 PolarHBondContact O-N 3.3Å; H207-L210 VanDerWaalsContact O-N 3.17Å; H207-W211 VanDerWaalsContact O-CD1 3.23Å; H207-W211 PolarHBondContact O-N 3.36Å; H207-L266 HydrophobicContact CB-CB 3.69Å; H207-L266 HydrophobicContact CB-CD1 4.05Å; H207-L266 PolarHBondContact CD2-O 3.13Å
208	D	98.8	Very high	98.2	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.016	8%	0.079	C	C	.	.	H	α-helix	trans	-72.5	-30.2	-177.3	-67.6	-57.9	0	0	0	113.2	S195 N197 L204 G205 S212	S195-D208 WeakPolarHBondContact CB-OD1 3.06Å; S195-D208 VanDerWaalsContact OG-CG 3.29Å; S195-D208 PolarHBondContact OG-OD1 2.7Å; N197-D208 WeakPolarHBondContact CB-OD1 3.34Å; N197-D208 PolarHBondContact ND2-OD1 3.26Å; L204-D208 VanDerWaalsContact CA-OD2 3.24Å; L204-D208 WeakPolarHBondContact CA-OD2 3.39Å; L204-D208 HydrophobicContact CB-CB 4.14Å; L204-D208 HydrophobicContact CD2-CB 4.23Å; G205-D208 PolarHBondContact N-OD2 3.21Å; G205-D208 PolarHBondContact O-N 3.07Å; G205-D208 VanDerWaalsContact O-N 3.14Å; D208-S212 PolarHBondContact O-N 2.96Å; D208-S212 VanDerWaalsContact O-N 3.15Å; D208-S212 PolarHBondContact O-OG 3.49Å
209	D	98.9	Very high	98.2	Very high	3 Å²	3	16.1 Å²	16.1	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-73.1	-30.3	169.7	-81.4	-30.3	0	0	0	111.4	I126 H130 H136 R137 I139 S212 L213	I126-D209 HydrophobicContact CG2-CB 4.42Å; H130-D209 IonicContact NE2-OD2 3.6Å; H136-D209 PolarHBondContact N-OD2 3.42Å; R137-D209 WeakPolarHBondContact CA-OD1 3.4Å; R137-D209 VanDerWaalsContact N-CG 3.35Å; R137-D209 PolarHBondContact N-OD1 2.93Å; R137-D209 PolarHBondContact N-OD2 2.91Å; I139-D209 HydrophobicContact CG1-CB 3.84Å; I139-D209 WeakPolarHBondContact CG1-OD1 3.15Å; D209-S212 WeakPolarHBondContact O-CB 3.47Å; D209-S212 PolarHBondContact O-N 3.13Å; D209-L213 PolarHBondContact O-N 3.45Å
210	L	98.8	Very high	98.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-74.1	-33.7	171.5	-63.8	174.7	0	0	0	113.2	L123 I126 H207 S212 L213 Y214 I263 P272 Y274 L277	L123-L210 HydrophobicContact CD1-CD2 3.61Å; I126-L210 HydrophobicContact CG2-CD2 4.06Å; H207-L210 CarbonylContact O-C 3.49Å; H207-L210 WeakPolarHBondContact O-CB 3.45Å; H207-L210 PolarHBondContact O-N 3.3Å; H207-L210 VanDerWaalsContact O-N 3.17Å; L210-S212 VanDerWaalsContact C-N 3.28Å; L210-S212 PolarHBondContact O-N 3.14Å; L210-L213 HydrophobicContact CD2-CD2 4.31Å; L210-L213 WeakPolarHBondContact O-CB 3.41Å; L210-L213 PolarHBondContact O-N 3.18Å; L210-Y214 PolarHBondContact O-N 2.94Å; L210-I263 HydrophobicContact CB-CG2 4.06Å; L210-I263 HydrophobicContact CD1-CG2 4.42Å; L210-P272 HydrophobicContact CD1-CB 3.45Å; L210-P272 VanDerWaalsContact CD1-CB 3.45Å; L210-P272 HydrophobicContact CD1-CG 3.61Å; L210-Y274 HydrophobicContact CD1-CE1 4.2Å; L210-Y274 HydrophobicContact CD2-CE1 4.44Å; L210-L277 HydrophobicContact CD1-CD1 3.89Å; L210-L277 HydrophobicContact CD2-CD1 4.38Å
211	W	98.7	Very high	98.2	Very high	25 Å²	25	13 Å²	13	10%	0.095	6%	0.061	C	C	.	.	H	α-helix	trans	-59.1	-42.8	167.7	-89.9	106	0	0	0	111.4	H207 Y214 Y215 H245 L260 I263 Q264	H207-W211 VanDerWaalsContact O-CD1 3.23Å; H207-W211 PolarHBondContact O-N 3.36Å; W211-Y214 HydrophobicContact CE3-CD1 4.38Å; W211-Y214 HydrophobicContact CZ3-CD1 4.23Å; W211-Y214 PolarHBondContact O-N 3.2Å; W211-Y215 HydrophobicContact CB-CE2 4.41Å; W211-Y215 HydrophobicContact CE3-CE1 4.47Å; W211-Y215 AromaticContact CE3-CE2 3.97Å; W211-Y215 HydrophobicContact CE3-CE2 3.97Å; W211-Y215 AromaticContact CE3-CZ 3.79Å; W211-Y215 WeakPolarHBondContact O-CD2 3.24Å; W211-Y215 PolarHBondContact O-N 3.35Å; W211-Y215 VanDerWaalsContact O-N 3.1Å; W211-H245 AromaticContact CZ3-CD2 3.56Å; W211-H245 AromaticContact CZ3-NE2 3.84Å; W211-L260 HydrophobicContact CH2-CD1 3.71Å; W211-L260 HydrophobicContact CZ3-CD1 3.9Å; W211-I263 HydrophobicContact CD2-CD1 3.85Å; W211-I263 HydrophobicContact CD2-CG1 4.34Å; W211-I263 HydrophobicContact CE3-CD1 3.94Å; W211-I263 HydrophobicContact CG-CD1 4.25Å; W211-I263 HydrophobicContact CZ2-CD1 4.5Å; W211-I263 HydrophobicContact CZ2-CG1 4.23Å; W211-I263 HydrophobicContact CZ3-CD1 4.3Å; W211-I263 PolarHBondContact NE1-O 3.39Å; W211-Q264 HydrophobicContact CH2-CG 3.65Å; W211-Q264 HydrophobicContact CZ2-CB 4.39Å; W211-Q264 HydrophobicContact CZ2-CG 3.57Å
212	S	98.7	Very high	98.1	Very high	8 Å²	8	13.4 Å²	13.4	6%	0.056	7%	0.065	C	C	.	.	H	α-helix	trans	-63.2	-41.9	176.8	-55.6	0	0	0	0	111.4	Y193 D208 D209 L210 Y215 M216	Y193-S212 WeakPolarHBondContact O-CA 3.47Å; Y193-S212 PolarHBondContact O-OG 3.39Å; D208-S212 PolarHBondContact O-N 2.96Å; D208-S212 VanDerWaalsContact O-N 3.15Å; D208-S212 PolarHBondContact O-OG 3.49Å; D209-S212 WeakPolarHBondContact O-CB 3.47Å; D209-S212 PolarHBondContact O-N 3.13Å; L210-S212 VanDerWaalsContact C-N 3.28Å; L210-S212 PolarHBondContact O-N 3.14Å; S212-Y215 PolarHBondContact O-N 3.03Å; S212-M216 WeakPolarHBondContact O-CG 3.19Å; S212-M216 PolarHBondContact O-N 2.96Å
213	L	98.7	Very high	97.9	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-58.8	-48.5	170.1	173.9	62.6	0	0	0	112.3	M122 L123 I126 I139 D209 L210 Y215 M216 L217 F259	M122-L213 HydrophobicContact CB-CD1 3.98Å; M122-L213 HydrophobicContact CE-CD1 3.65Å; M122-L213 HydrophobicContact SD-CD1 4.24Å; L123-L213 HydrophobicContact CD1-CD2 4.33Å; I126-L213 HydrophobicContact CD1-CB 4.08Å; I126-L213 HydrophobicContact CD1-CD2 4.11Å; I139-L213 HydrophobicContact CG2-CB 4.47Å; D209-L213 PolarHBondContact O-N 3.45Å; L210-L213 HydrophobicContact CD2-CD2 4.31Å; L210-L213 WeakPolarHBondContact O-CB 3.41Å; L210-L213 PolarHBondContact O-N 3.18Å; L213-Y215 VanDerWaalsContact C-N 3.31Å; L213-Y215 PolarHBondContact O-N 2.9Å; L213-M216 WeakPolarHBondContact O-CA 3.27Å; L213-M216 WeakPolarHBondContact O-CB 3.37Å; L213-M216 PolarHBondContact O-N 3.41Å; L213-L217 HydrophobicContact CD1-CD1 4.03Å; L213-L217 HydrophobicContact CD1-CD2 4.19Å; L213-L217 HydrophobicContact CD1-CG 3.98Å; L213-L217 HydrophobicContact CG-CD1 4.1Å; L213-L217 HydrophobicContact CG-CG 4.41Å; L213-L217 WeakPolarHBondContact O-CG 3.42Å; L213-L217 PolarHBondContact O-N 3.13Å; L213-F259 HydrophobicContact CD2-CZ 4.19Å
214	Y	98.3	Very high	97.8	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-56.3	-43.9	178.8	177.4	-104.4	0	0	0	112.2	L210 W211 M216 L217 G218 H245 L248 L249 M252 F259 L260 I263	L210-Y214 PolarHBondContact O-N 2.94Å; W211-Y214 HydrophobicContact CE3-CD1 4.38Å; W211-Y214 HydrophobicContact CZ3-CD1 4.23Å; W211-Y214 PolarHBondContact O-N 3.2Å; Y214-M216 PolarHBondContact O-N 3.5Å; Y214-L217 PolarHBondContact O-N 2.88Å; Y214-G218 PolarHBondContact O-N 3.45Å; Y214-H245 PolarHBondContact OH-O 3.19Å; Y214-H245 VanDerWaalsContact OH-O 3.09Å; Y214-L248 HydrophobicContact CE1-CD1 3.84Å; Y214-L249 HydrophobicContact CE2-CD2 4.33Å; Y214-L249 WeakPolarHBondContact OH-CD2 3.19Å; Y214-M252 HydrophobicContact CE2-CE 4.03Å; Y214-M252 HydrophobicContact CE2-SD 3.86Å; Y214-F259 HydrophobicContact CD2-CD1 4.25Å; Y214-L260 HydrophobicContact CD1-CD1 4.3Å; Y214-L260 HydrophobicContact CE1-CD1 3.83Å; Y214-L260 HydrophobicContact CE2-CB 4.11Å; Y214-L260 HydrophobicContact CE2-CD1 4.4Å; Y214-I263 HydrophobicContact CG-CD1 4.06Å
215	Y	98.4	Very high	97.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-66.1	-34.5	175	-62.5	-54.8	0	0	0	113.2	Y193 W211 S212 L213 G218 E219 L225 W227 H245 L248	Y193-Y215 WeakPolarHBondContact O-CD2 3.49Å; W211-Y215 HydrophobicContact CB-CE2 4.41Å; W211-Y215 HydrophobicContact CE3-CE1 4.47Å; W211-Y215 AromaticContact CE3-CE2 3.97Å; W211-Y215 HydrophobicContact CE3-CE2 3.97Å; W211-Y215 AromaticContact CE3-CZ 3.79Å; W211-Y215 WeakPolarHBondContact O-CD2 3.24Å; W211-Y215 PolarHBondContact O-N 3.35Å; W211-Y215 VanDerWaalsContact O-N 3.1Å; S212-Y215 PolarHBondContact O-N 3.03Å; L213-Y215 VanDerWaalsContact C-N 3.31Å; L213-Y215 PolarHBondContact O-N 2.9Å; Y215-G218 PolarHBondContact O-N 2.87Å; Y215-E219 PolarHBondContact O-N 2.99Å; Y215-L225 HydrophobicContact CD1-CD2 4.43Å; Y215-W227 AromaticContact CD1-CH2 3.75Å; Y215-W227 HydrophobicContact CD1-CH2 3.75Å; Y215-W227 AromaticContact CD1-CZ2 3.5Å; Y215-W227 HydrophobicContact CD1-CZ2 3.5Å; Y215-W227 VanDerWaalsContact CD1-CZ2 3.5Å; Y215-W227 AromaticContact CE1-CH2 3.47Å; Y215-W227 HydrophobicContact CE1-CH2 3.47Å; Y215-W227 VanDerWaalsContact CE1-CH2 3.47Å; Y215-W227 AromaticContact CE1-CZ2 3.58Å; Y215-W227 HydrophobicContact CE1-CZ2 3.58Å; Y215-W227 HydrophobicContact CG-CZ2 4.16Å; Y215-H245 AromaticContact CE1-CD2 3.81Å; Y215-H245 AromaticContact CE1-NE2 3.96Å; Y215-H245 AromaticContact CZ-NE2 3.9Å; Y215-H245 PolarHBondContact OH-NE2 3.06Å; Y215-L248 HydrophobicContact CD1-CD1 4.31Å
216	M	98.3	Very high	97.6	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63	-46.5	172.8	-72.5	175.6	48.9	0	0	111.8	M122 I139 K140 P141 F144 Y193 S212 L213 Y214 G218 E219 F220	M122-M216 HydrophobicContact CE-CE 4.17Å; M122-M216 HydrophobicContact SD-CE 3.38Å; M122-M216 WeakPolarHBondContact SD-CE 3.43Å; I139-M216 HydrophobicContact CG2-SD 3.77Å; K140-M216 VanDerWaalsContact C-SD 3.52Å; K140-M216 WeakPolarHBondContact CA-SD 3.43Å; P141-M216 HydrophobicContact CB-CE 4.34Å; P141-M216 HydrophobicContact CG-CE 4Å; P141-M216 HydrophobicContact CG-CG 3.98Å; P141-M216 HydrophobicContact CG-SD 4.36Å; F144-M216 HydrophobicContact CD2-CE 3.75Å; F144-M216 HydrophobicContact CD2-SD 4.48Å; F144-M216 HydrophobicContact CE2-CE 3.73Å; F144-M216 HydrophobicContact CE2-SD 4.04Å; Y193-M216 HydrophobicContact CD1-CG 3.87Å; Y193-M216 HydrophobicContact CE1-CG 4.2Å; Y193-M216 HydrophobicContact CG-CG 4.47Å; S212-M216 WeakPolarHBondContact O-CG 3.19Å; S212-M216 PolarHBondContact O-N 2.96Å; L213-M216 WeakPolarHBondContact O-CA 3.27Å; L213-M216 WeakPolarHBondContact O-CB 3.37Å; L213-M216 PolarHBondContact O-N 3.41Å; Y214-M216 PolarHBondContact O-N 3.5Å; M216-G218 VanDerWaalsContact C-N 3.26Å; M216-G218 PolarHBondContact O-N 3.35Å; M216-E219 CarbonylContact O-C 3.52Å; M216-E219 PolarHBondContact O-N 3.19Å; M216-E219 VanDerWaalsContact O-N 3.11Å; M216-F220 HydrophobicContact CE-CE1 4.49Å; M216-F220 HydrophobicContact CE-CE2 4.38Å; M216-F220 HydrophobicContact CE-CZ 3.83Å; M216-F220 WeakPolarHBondContact O-CB 3.28Å; M216-F220 WeakPolarHBondContact O-CD1 3.31Å; M216-F220 VanDerWaalsContact O-CG 3.23Å; M216-F220 WeakPolarHBondContact O-CG 3.26Å; M216-F220 PolarHBondContact O-N 3.38Å
217	L	98.1	Very high	97.6	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64.9	-32.7	-179.9	-58.3	176.2	0	0	0	111.7	T115 A119 M122 L213 Y214 F220 I221 F256	T115-L217 HydrophobicContact CG2-CB 4.31Å; T115-L217 HydrophobicContact CG2-CD2 3.71Å; A119-L217 HydrophobicContact CB-CD1 3.73Å; A119-L217 HydrophobicContact CB-CD2 3.65Å; A119-L217 HydrophobicContact CB-CG 4.36Å; M122-L217 HydrophobicContact CE-CD2 3.7Å; L213-L217 HydrophobicContact CD1-CD1 4.03Å; L213-L217 HydrophobicContact CD1-CD2 4.19Å; L213-L217 HydrophobicContact CD1-CG 3.98Å; L213-L217 HydrophobicContact CG-CD1 4.1Å; L213-L217 HydrophobicContact CG-CG 4.41Å; L213-L217 WeakPolarHBondContact O-CG 3.42Å; L213-L217 PolarHBondContact O-N 3.13Å; Y214-L217 PolarHBondContact O-N 2.88Å; L217-F220 HydrophobicContact CD2-CD2 4.3Å; L217-F220 PolarHBondContact O-N 3.49Å; L217-I221 PolarHBondContact O-N 3.36Å; L217-I221 VanDerWaalsContact O-N 3.12Å; L217-F256 HydrophobicContact CB-CE1 3.79Å; L217-F256 HydrophobicContact CD1-CE1 3.63Å; L217-F256 HydrophobicContact CD1-CZ 4.04Å; L217-F256 HydrophobicContact CG-CE1 4.32Å
218	G	97.1	Very high	97.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.4	-49.7	167.5	0	0	0	0	0	113.3	Y214 Y215 M216 F220 I221 V222	Y214-G218 PolarHBondContact O-N 3.45Å; Y215-G218 PolarHBondContact O-N 2.87Å; M216-G218 VanDerWaalsContact C-N 3.26Å; M216-G218 PolarHBondContact O-N 3.35Å; G218-F220 PolarHBondContact O-N 3.21Å; G218-I221 PolarHBondContact O-N 2.88Å; G218-V222 WeakPolarHBondContact O-CB 3.11Å; G218-V222 WeakPolarHBondContact O-CG2 3.33Å; G218-V222 PolarHBondContact O-N 3.11Å
219	E	97.6	Very high	97.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65	-27.6	176.6	-150.4	-167.4	-143.9	0	0	112.4	R102 R192 Y193 Y215 M216 G223 L225	R102-E219 IonicContact CZ-OE2 2.79Å; R102-E219 IonicContact NE-OE2 2.87Å; R102-E219 IonicContact NH2-OE1 3.79Å; R102-E219 PolarHBondContact NH2-OE1 2.88Å; R102-E219 IonicContact NH2-OE2 2.88Å; R102-E219 PolarHBondContact NH2-OE2 3.4Å; R192-E219 VanDerWaalsContact CD-OE1 3.3Å; R192-E219 WeakPolarHBondContact CD-OE1 3.11Å; R192-E219 IonicContact CZ-OE1 2.64Å; R192-E219 IonicContact NE-OE1 2.71Å; R192-E219 IonicContact NH1-OE1 3.23Å; R192-E219 PolarHBondContact NH1-OE1 3.23Å; Y193-E219 PolarHBondContact OH-OE2 3.39Å; Y193-E219 VanDerWaalsContact OH-OE2 3.11Å; Y215-E219 PolarHBondContact O-N 2.99Å; M216-E219 CarbonylContact O-C 3.52Å; M216-E219 PolarHBondContact O-N 3.19Å; M216-E219 VanDerWaalsContact O-N 3.11Å; E219-G223 CarbonylContact O-C 3.58Å; E219-G223 WeakPolarHBondContact O-CA 3.4Å; E219-G223 PolarHBondContact O-N 3.24Å; E219-L225 HydrophobicContact CB-CD1 4.2Å; E219-L225 HydrophobicContact CB-CG 3.99Å; E219-L225 HydrophobicContact CG-CD1 4.45Å; E219-L225 HydrophobicContact CG-CG 4.17Å
220	F	98	Very high	96.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71	-46.2	177.3	-73.7	7.3	0	0	0	111.7	L98 C109 F110 T115 L118 M122 P141 M216 L217 G218	L98-F220 HydrophobicContact CB-CZ 4.04Å; L98-F220 HydrophobicContact CD1-CE2 4.18Å; L98-F220 HydrophobicContact CD1-CZ 4.05Å; C109-F220 CarbonylContact C-O 3.58Å; C109-F220 VanDerWaalsContact CA-O 3.31Å; C109-F220 WeakPolarHBondContact CA-O 3.12Å; C109-F220 WeakPolarHBondContact CB-O 3.17Å; F110-F220 HydrophobicContact CD2-CB 4Å; F110-F220 HydrophobicContact CD2-CD1 4.17Å; F110-F220 AromaticContact CD2-CD2 3.74Å; F110-F220 HydrophobicContact CD2-CD2 3.74Å; F110-F220 HydrophobicContact CD2-CE2 4.2Å; F110-F220 AromaticContact CD2-CG 3.71Å; F110-F220 HydrophobicContact CD2-CG 3.71Å; F110-F220 HydrophobicContact CE2-CD1 4.24Å; F110-F220 HydrophobicContact CE2-CD2 4.05Å; F110-F220 HydrophobicContact CE2-CE1 4.21Å; F110-F220 HydrophobicContact CE2-CE2 4.04Å; F110-F220 HydrophobicContact CE2-CG 4.15Å; F110-F220 HydrophobicContact CE2-CZ 4.12Å; F110-F220 PolarHBondContact N-O 3.33Å; T115-F220 HydrophobicContact CG2-CB 3.96Å; T115-F220 HydrophobicContact CG2-CD2 4.27Å; L118-F220 HydrophobicContact CD1-CD2 4.46Å; L118-F220 HydrophobicContact CD1-CE2 4.12Å; M122-F220 HydrophobicContact CE-CE2 3.89Å; M122-F220 HydrophobicContact SD-CE2 4.48Å; P141-F220 HydrophobicContact CB-CE1 3.84Å; P141-F220 HydrophobicContact CB-CZ 4.07Å; P141-F220 HydrophobicContact CG-CE1 3.65Å; P141-F220 HydrophobicContact CG-CZ 4.15Å; M216-F220 HydrophobicContact CE-CE1 4.49Å; M216-F220 HydrophobicContact CE-CE2 4.38Å; M216-F220 HydrophobicContact CE-CZ 3.83Å; M216-F220 WeakPolarHBondContact O-CB 3.28Å; M216-F220 WeakPolarHBondContact O-CD1 3.31Å; M216-F220 VanDerWaalsContact O-CG 3.23Å; M216-F220 WeakPolarHBondContact O-CG 3.26Å; M216-F220 PolarHBondContact O-N 3.38Å; L217-F220 HydrophobicContact CD2-CD2 4.3Å; L217-F220 PolarHBondContact O-N 3.49Å; G218-F220 PolarHBondContact O-N 3.21Å
221	I	96.9	Very high	96.5	Very high	22 Å²	22	30.4 Å²	30.4	11%	0.113	15%	0.149	C	C	.	.	H	α-helix	trans	-78.2	-41.9	-179	-67.7	165.7	0	0	0	112	I112 T115 L217 G218 F251 M252	I112-I221 HydrophobicContact CG1-CG1 4.49Å; I112-I221 HydrophobicContact CG2-CD1 4.49Å; T115-I221 HydrophobicContact CG2-CD1 4.03Å; T115-I221 HydrophobicContact CG2-CG1 3.9Å; L217-I221 PolarHBondContact O-N 3.36Å; L217-I221 VanDerWaalsContact O-N 3.12Å; G218-I221 PolarHBondContact O-N 2.88Å; I221-F251 HydrophobicContact CG2-CB 4.24Å; I221-F251 WeakPolarHBondContact CG2-O 3.38Å; I221-M252 HydrophobicContact CD1-CG 4.18Å
222	V	94.4	Very high	96.4	Very high	57 Å²	57	33 Å²	33	35%	0.345	17%	0.165	S	C	.	.	H	α-helix	trans	-91.9	-19.5	-173.2	-174.8	0	0	0	0	112.4	G218 E224 F251	G218-V222 WeakPolarHBondContact O-CB 3.11Å; G218-V222 WeakPolarHBondContact O-CG2 3.33Å; G218-V222 PolarHBondContact O-N 3.11Å; V222-E224 PolarHBondContact O-N 3.36Å; V222-F251 HydrophobicContact CG2-CB 4.23Å; V222-F251 HydrophobicContact CG2-CD2 4.1Å
223	G	94.8	Very high	96.2	Very high	13 Å²	13	34.7 Å²	34.7	13%	0.134	17%	0.171	C	C	.	.	S	Bend	trans	83.8	-28.2	-177.1	0	0	0	0	0	114.6	R102 G108 E219	R102-G223 PolarHBondContact NH1-O 2.96Å; G108-G223 WeakPolarHBondContact O-CA 3.3Å; E219-G223 CarbonylContact O-C 3.58Å; E219-G223 WeakPolarHBondContact O-CA 3.4Å; E219-G223 PolarHBondContact O-N 3.24Å
224	E	94.9	Very high	96.1	Very high	76 Å²	76	41.5 Å²	41.5	36%	0.355	20%	0.203	S	C	.	.	S	Bend	trans	-138.6	156.8	169.1	64.1	174.1	-163.1	0	0	114	V222 R228 K229	V222-E224 PolarHBondContact O-N 3.36Å; E224-R228 HydrophobicContact CB-CB 4.16Å; E224-R228 HydrophobicContact CB-CG 4.32Å; E224-R228 WeakPolarHBondContact OE2-CD 3.46Å; E224-R228 IonicContact OE2-NE 3.5Å; E224-K229 VanDerWaalsContact CD-NZ 3.31Å; E224-K229 IonicContact OE1-NZ 3Å; E224-K229 PolarHBondContact OE1-NZ 3.35Å; E224-K229 VanDerWaalsContact OE2-CE 3.27Å; E224-K229 WeakPolarHBondContact OE2-CE 3.41Å; E224-K229 IonicContact OE2-NZ 2.68Å; E224-K229 PolarHBondContact OE2-NZ 2.8Å
225	L	96.7	Very high	96.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.228	C	C	.	.			trans	-96.5	152.5	167	-73.8	165.4	0	0	0	110.1	R192 Y193 Y215 E219 W227 R228 L248	R192-L225 HydrophobicContact CG-CD1 3.84Å; Y193-L225 HydrophobicContact CD1-CD1 4.32Å; Y193-L225 HydrophobicContact CE1-CD1 4.33Å; Y215-L225 HydrophobicContact CD1-CD2 4.43Å; E219-L225 HydrophobicContact CB-CD1 4.2Å; E219-L225 HydrophobicContact CB-CG 3.99Å; E219-L225 HydrophobicContact CG-CD1 4.45Å; E219-L225 HydrophobicContact CG-CG 4.17Å; L225-W227 VanDerWaalsContact C-N 3.25Å; L225-W227 HydrophobicContact CB-CZ2 4.25Å; L225-W227 HydrophobicContact CD1-CZ2 4.19Å; L225-W227 HydrophobicContact CD2-CH2 4.49Å; L225-W227 HydrophobicContact CD2-CZ2 3.97Å; L225-W227 HydrophobicContact CG-CZ2 4.37Å; L225-W227 PolarHBondContact O-N 3.17Å; L225-W227 VanDerWaalsContact O-N 3.13Å; L225-R228 WeakPolarHBondContact O-CB 3.5Å; L225-R228 PolarHBondContact O-N 2.88Å; L225-L248 HydrophobicContact CD2-CD1 4.48Å; L225-L248 HydrophobicContact CD2-CD2 4.17Å
226	P	96.7	Very high	96	Very high	61 Å²	61	46.9 Å²	46.9	40%	0.396	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-38.3	-177.1	-28.2	35	0	0	0	114.4	M239 F243	P226-M239 HydrophobicContact CB-CE 3.57Å; P226-F243 HydrophobicContact CB-CE2 4.24Å; P226-F243 HydrophobicContact CG-CD2 4.41Å; P226-F243 HydrophobicContact CG-CE1 4.42Å; P226-F243 HydrophobicContact CG-CE2 3.68Å; P226-F243 HydrophobicContact CG-CZ 3.68Å
227	W	97.6	Very high	96	Very high	2 Å²	2	47 Å²	47	1%	0.008	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	8.9	177.6	48.2	83.7	0	0	0	114.4	R192 Y215 L225 K229 I230 V236 M239 K240 F243	R192-W227 PolarHBondContact O-NE1 2.72Å; Y215-W227 AromaticContact CD1-CH2 3.75Å; Y215-W227 HydrophobicContact CD1-CH2 3.75Å; Y215-W227 AromaticContact CD1-CZ2 3.5Å; Y215-W227 HydrophobicContact CD1-CZ2 3.5Å; Y215-W227 VanDerWaalsContact CD1-CZ2 3.5Å; Y215-W227 AromaticContact CE1-CH2 3.47Å; Y215-W227 HydrophobicContact CE1-CH2 3.47Å; Y215-W227 VanDerWaalsContact CE1-CH2 3.47Å; Y215-W227 AromaticContact CE1-CZ2 3.58Å; Y215-W227 HydrophobicContact CE1-CZ2 3.58Å; Y215-W227 HydrophobicContact CG-CZ2 4.16Å; L225-W227 VanDerWaalsContact C-N 3.25Å; L225-W227 HydrophobicContact CB-CZ2 4.25Å; L225-W227 HydrophobicContact CD1-CZ2 4.19Å; L225-W227 HydrophobicContact CD2-CH2 4.49Å; L225-W227 HydrophobicContact CD2-CZ2 3.97Å; L225-W227 HydrophobicContact CG-CZ2 4.37Å; L225-W227 PolarHBondContact O-N 3.17Å; L225-W227 VanDerWaalsContact O-N 3.13Å; W227-K229 PolarHBondContact O-N 3.43Å; W227-I230 HydrophobicContact CB-CD1 4.38Å; W227-I230 PolarHBondContact O-N 2.74Å; W227-V236 HydrophobicContact CB-CG1 4.21Å; W227-V236 HydrophobicContact CB-CG2 4.19Å; W227-V236 HydrophobicContact CG-CG1 4.01Å; W227-M239 HydrophobicContact CB-SD 3.76Å; W227-M239 HydrophobicContact CE3-CG 4.5Å; W227-M239 HydrophobicContact CE3-SD 4.38Å; W227-K240 HydrophobicContact CD2-CG 4.07Å; W227-K240 HydrophobicContact CE3-CG 3.94Å; W227-K240 HydrophobicContact CH2-CG 4.08Å; W227-K240 HydrophobicContact CZ2-CD 4.42Å; W227-K240 VanDerWaalsContact CZ2-CE 3.41Å; W227-K240 HydrophobicContact CZ2-CG 4.18Å; W227-K240 HydrophobicContact CZ3-CG 3.94Å; W227-K240 VanDerWaalsContact NE1-CE 3.29Å; W227-F243 HydrophobicContact CH2-CD1 4.48Å; W227-F243 AromaticContact CZ3-CD1 3.96Å; W227-F243 HydrophobicContact CZ3-CD1 3.96Å; W227-F243 HydrophobicContact CZ3-CE1 4.29Å; W227-F243 HydrophobicContact CZ3-CG 4.22Å
228	R	94.1	Very high	96	Very high	57 Å²	57	52.1 Å²	52.1	22%	0.215	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-41.4	-173.5	170.6	175.8	166.4	63.2	18.1	113.5	R192 E224 L225 D582	R192-R228 PolarHBondContact NH2-O 2.79Å; E224-R228 HydrophobicContact CB-CB 4.16Å; E224-R228 HydrophobicContact CB-CG 4.32Å; E224-R228 WeakPolarHBondContact OE2-CD 3.46Å; E224-R228 IonicContact OE2-NE 3.5Å; L225-R228 WeakPolarHBondContact O-CB 3.5Å; L225-R228 PolarHBondContact O-N 2.88Å; R228-D582 IonicContact CZ-OD1 3.68Å; R228-D582 IonicContact CZ-OD2 3.61Å; R228-D582 IonicContact NH1-OD1 2.83Å; R228-D582 IonicContact NH1-OD2 3.25Å; R228-D582 PolarHBondContact NH1-OD2 3.28Å; R228-D582 IonicContact NH2-OD1 2.63Å; R228-D582 PolarHBondContact NH2-OD1 3.12Å; R228-D582 IonicContact NH2-OD2 2.92Å; R228-D582 PolarHBondContact NH2-OD2 3.39Å
229	K	93.7	Very high	96	Very high	157 Å²	157	54.9 Å²	54.9	68%	0.683	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-7.9	-171.9	-65.3	155.2	-169.9	144.2	0	113.4	E224 W227	E224-K229 VanDerWaalsContact CD-NZ 3.31Å; E224-K229 IonicContact OE1-NZ 3Å; E224-K229 PolarHBondContact OE1-NZ 3.35Å; E224-K229 VanDerWaalsContact OE2-CE 3.27Å; E224-K229 WeakPolarHBondContact OE2-CE 3.41Å; E224-K229 IonicContact OE2-NZ 2.68Å; E224-K229 PolarHBondContact OE2-NZ 2.8Å; W227-K229 PolarHBondContact O-N 3.43Å
230	I	94.6	Very high	96.1	Very high	42 Å²	42	54.9 Å²	54.9	22%	0.215	27%	0.27	C	S	.	.			trans	-91.1	125.2	-178.5	-53.5	177.8	0	0	0	109.2	W227 Q235 V236 M239	W227-I230 HydrophobicContact CB-CD1 4.38Å; W227-I230 PolarHBondContact O-N 2.74Å; I230-Q235 HydrophobicContact CD1-CG 4.4Å; I230-Q235 HydrophobicContact CG2-CB 3.99Å; I230-Q235 HydrophobicContact CG2-CG 3.96Å; I230-Q235 VanDerWaalsContact CG2-OE1 3.32Å; I230-V236 HydrophobicContact CB-CG2 3.76Å; I230-V236 HydrophobicContact CG2-CG2 3.65Å; I230-M239 HydrophobicContact CD1-SD 3.7Å
231	K	91.2	Very high	96	Very high	116 Å²	116	59.4 Å²	59.4	50%	0.504	29%	0.291	S	S	.	.			trans	-96.2	-22.7	179.7	-68.2	-170.8	172.8	-162.2	0	113.9	T583	K231-T583 VanDerWaalsContact CE-O 3.31Å; K231-T583 WeakPolarHBondContact CE-O 3.4Å; K231-T583 PolarHBondContact NZ-O 3.41Å
232	D	95.7	Very high	96	Very high	81 Å²	81	63.6 Å²	63.6	43%	0.433	32%	0.318	S	S	.	.			trans	-73.8	135.9	-179.1	178.7	57.3	0	0	0	111.9	E234 Q235 V236	D232-E234 WeakPolarHBondContact OD2-CA 3.18Å; D232-E234 PolarHBondContact OD2-N 3.47Å; D232-Q235 HydrophobicContact CB-CB 4.09Å; D232-Q235 WeakPolarHBondContact OD2-CB 3.24Å; D232-Q235 PolarHBondContact OD2-N 3.26Å; D232-V236 WeakPolarHBondContact O-CB 3.32Å; D232-V236 WeakPolarHBondContact O-CG2 3.43Å; D232-V236 PolarHBondContact O-N 3.49Å
233	K	94.8	Very high	96.1	Very high	42 Å²	42	62.2 Å²	62.2	18%	0.183	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-46.6	-177.5	-178.4	-145.8	163.7	-162.1	0	110.8	F187 V191 H199 N201 V236 G237	F187-K233 HydrophobicContact CB-CD 4.47Å; F187-K233 HydrophobicContact CD1-CD 4.5Å; F187-K233 HydrophobicContact CD2-CD 4.45Å; F187-K233 HydrophobicContact CG-CD 4.24Å; V191-K233 HydrophobicContact CG2-CB 4.47Å; V191-K233 HydrophobicContact CG2-CG 4.46Å; H199-K233 PolarHBondContact CE1-O 2.85Å; H199-K233 PolarHBondContact ND1-O 2.76Å; H199-K233 VanDerWaalsContact ND1-O 3.15Å; H199-K233 PolarHBondContact O-NZ 3.01Å; N201-K233 PolarHBondContact OD1-NZ 3.1Å; K233-V236 PolarHBondContact O-N 3.44Å; K233-G237 PolarHBondContact O-N 3.37Å
234	E	96.2	Very high	96.2	Very high	144 Å²	144	65 Å²	65	67%	0.673	32%	0.319	S	S	*	.	H	α-helix	trans	-76.1	-37.9	-169.4	-59.1	-173	172.7	0	0	111	D232 G237 L238	D232-E234 WeakPolarHBondContact OD2-CA 3.18Å; D232-E234 PolarHBondContact OD2-N 3.47Å; E234-G237 PolarHBondContact O-N 3.45Å; E234-L238 WeakPolarHBondContact O-CB 3.43Å; E234-L238 PolarHBondContact O-N 3.36Å
235	Q	97.4	Very high	96.2	Very high	112 Å²	112	62.3 Å²	62.3	52%	0.523	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-43.1	170.9	-168.3	-179.2	11.7	0	0	112.2	I230 D232 G237 M239	I230-Q235 HydrophobicContact CD1-CG 4.4Å; I230-Q235 HydrophobicContact CG2-CB 3.99Å; I230-Q235 HydrophobicContact CG2-CG 3.96Å; I230-Q235 VanDerWaalsContact CG2-OE1 3.32Å; D232-Q235 HydrophobicContact CB-CB 4.09Å; D232-Q235 WeakPolarHBondContact OD2-CB 3.24Å; D232-Q235 PolarHBondContact OD2-N 3.26Å; Q235-G237 VanDerWaalsContact C-N 3.34Å; Q235-M239 VanDerWaalsContact O-CB 3.3Å; Q235-M239 WeakPolarHBondContact O-CB 3.48Å; Q235-M239 PolarHBondContact O-N 3.23Å
236	V	98.1	Very high	96.1	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-39.9	173.4	173.6	0	0	0	0	111	V191 H199 W227 I230 D232 K233 M239 K240	V191-V236 HydrophobicContact CG1-CB 3.92Å; V191-V236 HydrophobicContact CG1-CG1 3.96Å; V191-V236 HydrophobicContact CG1-CG2 3.95Å; H199-V236 WeakPolarHBondContact NE2-CG1 3.43Å; W227-V236 HydrophobicContact CB-CG1 4.21Å; W227-V236 HydrophobicContact CB-CG2 4.19Å; W227-V236 HydrophobicContact CG-CG1 4.01Å; I230-V236 HydrophobicContact CB-CG2 3.76Å; I230-V236 HydrophobicContact CG2-CG2 3.65Å; D232-V236 WeakPolarHBondContact O-CB 3.32Å; D232-V236 WeakPolarHBondContact O-CG2 3.43Å; D232-V236 PolarHBondContact O-N 3.49Å; K233-V236 PolarHBondContact O-N 3.44Å; V236-M239 PolarHBondContact O-N 3.24Å; V236-K240 HydrophobicContact CG1-CD 4Å; V236-K240 HydrophobicContact CG1-CG 4.45Å; V236-K240 WeakPolarHBondContact O-CB 3.4Å; V236-K240 WeakPolarHBondContact O-CG 3.37Å; V236-K240 PolarHBondContact O-N 3.06Å
237	G	97.7	Very high	95.9	Very high	3 Å²	3	67.3 Å²	67.3	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-64.8	-41.7	177.5	0	0	0	0	0	113.5	H199 K233 E234 Q235 Q241	H199-G237 WeakPolarHBondContact ND1-CA 3.2Å; K233-G237 PolarHBondContact O-N 3.37Å; E234-G237 PolarHBondContact O-N 3.45Å; Q235-G237 VanDerWaalsContact C-N 3.34Å; G237-Q241 WeakPolarHBondContact O-CG 3.46Å; G237-Q241 PolarHBondContact O-N 2.93Å; G237-Q241 PolarHBondContact O-NE2 3.06Å
238	L	97.6	Very high	95.7	Very high	108 Å²	108	67.7 Å²	67.7	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-66.2	-48.2	173.9	178.6	60.5	0	0	0	110.9	E234 K240 Q241 T242	E234-L238 WeakPolarHBondContact O-CB 3.43Å; E234-L238 PolarHBondContact O-N 3.36Å; L238-K240 VanDerWaalsContact C-N 3.28Å; L238-K240 PolarHBondContact O-N 2.92Å; L238-Q241 WeakPolarHBondContact O-CB 3.43Å; L238-Q241 PolarHBondContact O-N 3.47Å; L238-T242 HydrophobicContact CD1-CG2 4.22Å; L238-T242 PolarHBondContact O-N 3.11Å; L238-T242 VanDerWaalsContact O-N 3.08Å; L238-T242 PolarHBondContact O-OG1 2.97Å
239	M	98	Very high	95.7	Very high	57 Å²	57	66.3 Å²	66.3	28%	0.281	33%	0.325	S	S	.	.	H	α-helix	trans	-57.6	-40.7	177.7	-172.3	-180	-176.9	0	0	111.6	P226 W227 I230 Q235 V236 Q241 T242 F243	P226-M239 HydrophobicContact CB-CE 3.57Å; W227-M239 HydrophobicContact CB-SD 3.76Å; W227-M239 HydrophobicContact CE3-CG 4.5Å; W227-M239 HydrophobicContact CE3-SD 4.38Å; I230-M239 HydrophobicContact CD1-SD 3.7Å; Q235-M239 VanDerWaalsContact O-CB 3.3Å; Q235-M239 WeakPolarHBondContact O-CB 3.48Å; Q235-M239 PolarHBondContact O-N 3.23Å; V236-M239 PolarHBondContact O-N 3.24Å; M239-Q241 VanDerWaalsContact C-N 3.27Å; M239-Q241 PolarHBondContact O-N 2.99Å; M239-T242 PolarHBondContact O-N 3.48Å; M239-T242 PolarHBondContact O-OG1 3.26Å; M239-F243 WeakPolarHBondContact O-CB 3.29Å; M239-F243 PolarHBondContact O-N 3.02Å
240	K	98.1	Very high	95.6	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-68	-20.4	175.5	-77.9	175.7	171.3	-178	0	114.8	V191 R192 A194 V196 H199 W227 V236 L238 H245	V191-K240 PolarHBondContact O-NZ 3.23Å; R192-K240 PolarHBondContact O-NZ 2.94Å; A194-K240 PolarHBondContact O-NZ 2.77Å; V196-K240 HydrophobicContact CG2-CB 3.93Å; V196-K240 WeakPolarHBondContact CG2-O 3.38Å; H199-K240 PolarHBondContact NE2-NZ 3.35Å; W227-K240 HydrophobicContact CD2-CG 4.07Å; W227-K240 HydrophobicContact CE3-CG 3.94Å; W227-K240 HydrophobicContact CH2-CG 4.08Å; W227-K240 HydrophobicContact CZ2-CD 4.42Å; W227-K240 VanDerWaalsContact CZ2-CE 3.41Å; W227-K240 HydrophobicContact CZ2-CG 4.18Å; W227-K240 HydrophobicContact CZ3-CG 3.94Å; W227-K240 VanDerWaalsContact NE1-CE 3.29Å; V236-K240 HydrophobicContact CG1-CD 4Å; V236-K240 HydrophobicContact CG1-CG 4.45Å; V236-K240 WeakPolarHBondContact O-CB 3.4Å; V236-K240 WeakPolarHBondContact O-CG 3.37Å; V236-K240 PolarHBondContact O-N 3.06Å; L238-K240 VanDerWaalsContact C-N 3.28Å; L238-K240 PolarHBondContact O-N 2.92Å; K240-H245 PolarHBondContact O-CE1 2.7Å
241	Q	97.3	Very high	95.3	Very high	96 Å²	96	70.3 Å²	70.3	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-85.7	-31.8	175.1	-76	167.7	92.3	0	0	112.4	V196 G237 L238 M239	V196-Q241 HydrophobicContact CG1-CG 3.54Å; V196-Q241 HydrophobicContact CG2-CG 4.24Å; G237-Q241 WeakPolarHBondContact O-CG 3.46Å; G237-Q241 PolarHBondContact O-N 2.93Å; G237-Q241 PolarHBondContact O-NE2 3.06Å; L238-Q241 WeakPolarHBondContact O-CB 3.43Å; L238-Q241 PolarHBondContact O-N 3.47Å; M239-Q241 VanDerWaalsContact C-N 3.27Å; M239-Q241 PolarHBondContact O-N 2.99Å
242	T	96.8	Very high	95.5	Very high	109 Å²	109	65.6 Å²	65.6	67%	0.669	32%	0.321	S	S	*	.	H	α-helix	trans	-94.9	-12.4	-179.3	56.9	0	0	0	0	114.1	L238 M239	L238-T242 HydrophobicContact CD1-CG2 4.22Å; L238-T242 PolarHBondContact O-N 3.11Å; L238-T242 VanDerWaalsContact O-N 3.08Å; L238-T242 PolarHBondContact O-OG1 2.97Å; M239-T242 PolarHBondContact O-N 3.48Å; M239-T242 PolarHBondContact O-OG1 3.26Å
243	F	96.6	Very high	95.5	Very high	28 Å²	28	62.2 Å²	62.2	12%	0.123	30%	0.304	C	S	.	.	S	Bend	trans	-80.8	128.7	179.4	178.2	-98.5	0	0	0	111.9	P226 W227 M239 H245 Q247 L248	P226-F243 HydrophobicContact CB-CE2 4.24Å; P226-F243 HydrophobicContact CG-CD2 4.41Å; P226-F243 HydrophobicContact CG-CE1 4.42Å; P226-F243 HydrophobicContact CG-CE2 3.68Å; P226-F243 HydrophobicContact CG-CZ 3.68Å; W227-F243 HydrophobicContact CH2-CD1 4.48Å; W227-F243 AromaticContact CZ3-CD1 3.96Å; W227-F243 HydrophobicContact CZ3-CD1 3.96Å; W227-F243 HydrophobicContact CZ3-CE1 4.29Å; W227-F243 HydrophobicContact CZ3-CG 4.22Å; M239-F243 WeakPolarHBondContact O-CB 3.29Å; M239-F243 PolarHBondContact O-N 3.02Å; F243-H245 PolarHBondContact O-N 3.3Å; F243-H245 PolarHBondContact O-ND1 2.9Å; F243-Q247 HydrophobicContact CE2-CB 4.1Å; F243-Q247 HydrophobicContact CZ-CB 3.74Å; F243-L248 HydrophobicContact CE1-CD1 4.06Å; F243-L248 HydrophobicContact CE1-CG 3.9Å; F243-L248 HydrophobicContact CZ-CG 4.09Å
244	D	96.1	Very high	95.5	Very high	72 Å²	72	68.7 Å²	68.7	39%	0.385	33%	0.327	S	S	.	.			trans	-72.2	107.9	169.7	166.5	33.6	0	0	0	110.8	N246 Q247	D244-N246 PolarHBondContact O-N 3.32Å; D244-N246 VanDerWaalsContact O-N 3.1Å; D244-N246 VanDerWaalsContact OD1-CB 3.26Å; D244-N246 WeakPolarHBondContact OD1-CB 3.07Å; D244-N246 PolarHBondContact OD1-N 3.44Å; D244-N246 PolarHBondContact OD1-ND2 2.86Å; D244-Q247 HydrophobicContact CB-CG 4.17Å; D244-Q247 WeakPolarHBondContact O-CB 3.45Å; D244-Q247 WeakPolarHBondContact O-CG 3.39Å; D244-Q247 PolarHBondContact O-N 2.86Å
245	H	94.9	Very high	95.5	Very high	19 Å²	19	62.5 Å²	62.5	9%	0.088	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-60.1	-18.5	179.1	-62.9	86.3	0	0	0	114.5	W211 Y214 Y215 K240 F243 Q247 L248 L260	W211-H245 AromaticContact CZ3-CD2 3.56Å; W211-H245 AromaticContact CZ3-NE2 3.84Å; Y214-H245 PolarHBondContact OH-O 3.19Å; Y214-H245 VanDerWaalsContact OH-O 3.09Å; Y215-H245 AromaticContact CE1-CD2 3.81Å; Y215-H245 AromaticContact CE1-NE2 3.96Å; Y215-H245 AromaticContact CZ-NE2 3.9Å; Y215-H245 PolarHBondContact OH-NE2 3.06Å; K240-H245 PolarHBondContact O-CE1 2.7Å; F243-H245 PolarHBondContact O-N 3.3Å; F243-H245 PolarHBondContact O-ND1 2.9Å; H245-Q247 PolarHBondContact O-N 3.21Å; H245-L248 PolarHBondContact O-N 3.01Å; H245-L260 HydrophobicContact CB-CD1 3.84Å; H245-L260 HydrophobicContact CB-CD2 3.8Å; H245-L260 HydrophobicContact CB-CG 4.45Å
246	N	94.6	Very high	95.5	Very high	51 Å²	51	57.2 Å²	57.2	27%	0.273	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-66.9	-22.6	173.5	-62.6	-87	0	0	0	112.3	D244 L248 L249	D244-N246 PolarHBondContact O-N 3.32Å; D244-N246 VanDerWaalsContact O-N 3.1Å; D244-N246 VanDerWaalsContact OD1-CB 3.26Å; D244-N246 WeakPolarHBondContact OD1-CB 3.07Å; D244-N246 PolarHBondContact OD1-N 3.44Å; D244-N246 PolarHBondContact OD1-ND2 2.86Å; N246-L248 PolarHBondContact O-N 2.73Å; N246-L249 HydrophobicContact CB-CD1 4.16Å; N246-L249 VanDerWaalsContact O-CB 3.24Å; N246-L249 WeakPolarHBondContact O-CB 3.45Å; N246-L249 PolarHBondContact O-N 2.94Å
247	Q	93.8	Very high	95.5	Very high	117 Å²	117	63.5 Å²	63.5	55%	0.547	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-63.1	-26.7	176.8	-62.9	-177.6	19.4	0	0	112.8	F243 D244 H245 L249 K250	F243-Q247 HydrophobicContact CE2-CB 4.1Å; F243-Q247 HydrophobicContact CZ-CB 3.74Å; D244-Q247 HydrophobicContact CB-CG 4.17Å; D244-Q247 WeakPolarHBondContact O-CB 3.45Å; D244-Q247 WeakPolarHBondContact O-CG 3.39Å; D244-Q247 PolarHBondContact O-N 2.86Å; H245-Q247 PolarHBondContact O-N 3.21Å; Q247-L249 VanDerWaalsContact C-N 3.32Å; Q247-K250 WeakPolarHBondContact O-CB 3.38Å
248	L	92.7	Very high	95.5	Very high	10 Å²	10	64.8 Å²	64.8	5%	0.052	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-70.3	-28.8	172.7	-69.3	169.2	0	0	0	112.2	Y214 Y215 L225 F243 H245 N246 K250 M252	Y214-L248 HydrophobicContact CE1-CD1 3.84Å; Y215-L248 HydrophobicContact CD1-CD1 4.31Å; L225-L248 HydrophobicContact CD2-CD1 4.48Å; L225-L248 HydrophobicContact CD2-CD2 4.17Å; F243-L248 HydrophobicContact CE1-CD1 4.06Å; F243-L248 HydrophobicContact CE1-CG 3.9Å; F243-L248 HydrophobicContact CZ-CG 4.09Å; H245-L248 PolarHBondContact O-N 3.01Å; N246-L248 PolarHBondContact O-N 2.73Å; L248-K250 PolarHBondContact O-N 2.91Å; L248-M252 HydrophobicContact CB-CE 4.03Å; L248-M252 WeakPolarHBondContact O-CG 3.35Å
249	L	93.4	Very high	95.6	Very high	27 Å²	27	59.7 Å²	59.7	14%	0.141	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-65.8	-18.5	179.7	-57.1	174.4	0	0	0	112.8	Y214 N246 Q247 F251 M252 F256 R257 L260	Y214-L249 HydrophobicContact CE2-CD2 4.33Å; Y214-L249 WeakPolarHBondContact OH-CD2 3.19Å; N246-L249 HydrophobicContact CB-CD1 4.16Å; N246-L249 VanDerWaalsContact O-CB 3.24Å; N246-L249 WeakPolarHBondContact O-CB 3.45Å; N246-L249 PolarHBondContact O-N 2.94Å; Q247-L249 VanDerWaalsContact C-N 3.32Å; L249-F251 PolarHBondContact O-N 2.75Å; L249-M252 HydrophobicContact CD2-SD 3.87Å; L249-M252 PolarHBondContact O-N 3.17Å; L249-F256 HydrophobicContact CD2-CB 3.82Å; L249-R257 HydrophobicContact CD1-CB 3.88Å; L249-R257 HydrophobicContact CD1-CG 3.97Å; L249-L260 HydrophobicContact CD1-CD2 4.1Å; L249-L260 HydrophobicContact CG-CD2 4.38Å
250	K	92.6	Very high	95.6	Very high	163 Å²	163	57 Å²	57	71%	0.709	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-51.3	-28.7	-178.5	-178.8	171.9	179	173.3	0	114.2	Q247 L248	Q247-K250 WeakPolarHBondContact O-CB 3.38Å; L248-K250 PolarHBondContact O-N 2.91Å
251	F	88.4	Confident	95.6	Very high	120 Å²	120	60.2 Å²	60.2	53%	0.526	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-118.8	-0.6	179.1	-55.3	-69.5	0	0	0	113.5	I221 V222 L249	I221-F251 HydrophobicContact CG2-CB 4.24Å; I221-F251 WeakPolarHBondContact CG2-O 3.38Å; V222-F251 HydrophobicContact CG2-CB 4.23Å; V222-F251 HydrophobicContact CG2-CD2 4.1Å; L249-F251 PolarHBondContact O-N 2.75Å
252	M	94.3	Very high	95.7	Very high	18 Å²	18	57.5 Å²	57.5	9%	0.089	27%	0.267	C	S	.	.	S	Bend	trans	-88.1	162.8	178.3	-65	176.6	171.9	0	0	111.5	Y214 I221 L248 L249 F256	Y214-M252 HydrophobicContact CE2-CE 4.03Å; Y214-M252 HydrophobicContact CE2-SD 3.86Å; I221-M252 HydrophobicContact CD1-CG 4.18Å; L248-M252 HydrophobicContact CB-CE 4.03Å; L248-M252 WeakPolarHBondContact O-CG 3.35Å; L249-M252 HydrophobicContact CD2-SD 3.87Å; L249-M252 PolarHBondContact O-N 3.17Å; M252-F256 HydrophobicContact CB-CB 3.92Å; M252-F256 HydrophobicContact CB-CD1 4.32Å; M252-F256 HydrophobicContact CB-CG 4.02Å; M252-F256 HydrophobicContact CE-CD1 4.39Å; M252-F256 HydrophobicContact CG-CD1 4.22Å; M252-F256 HydrophobicContact CG-CG 4.41Å; M252-F256 HydrophobicContact SD-CB 3.92Å; M252-F256 HydrophobicContact SD-CD1 3.58Å; M252-F256 VanDerWaalsContact SD-CD1 3.58Å; M252-F256 HydrophobicContact SD-CE1 4.44Å; M252-F256 HydrophobicContact SD-CG 4.04Å
253	P	95.4	Very high	95.7	Very high	10 Å²	10	52.3 Å²	52.3	7%	0.065	24%	0.235	C	C	.	.			trans	-56.3	147.9	163.4	-25.4	35.6	0	0	0	113.1	I112 E255 F256 Y284	I112-P253 HydrophobicContact CG2-CG 3.73Å; P253-E255 WeakPolarHBondContact CB-OE2 3.29Å; P253-E255 PolarHBondContact O-N 2.97Å; P253-E255 VanDerWaalsContact O-N 3.1Å; P253-F256 HydrophobicContact CB-CD2 3.88Å; P253-F256 HydrophobicContact CB-CE2 4.27Å; P253-F256 HydrophobicContact CG-CD2 3.89Å; P253-F256 HydrophobicContact CG-CE2 3.85Å; P253-F256 WeakPolarHBondContact O-CB 3.29Å; P253-F256 PolarHBondContact O-N 2.86Å; P253-Y284 HydrophobicContact CB-CD2 3.42Å; P253-Y284 VanDerWaalsContact CB-CD2 3.42Å; P253-Y284 HydrophobicContact CB-CE2 3.53Å; P253-Y284 HydrophobicContact CB-CG 4.03Å; P253-Y284 HydrophobicContact CG-CD1 4.23Å; P253-Y284 HydrophobicContact CG-CD2 3.72Å; P253-Y284 HydrophobicContact CG-CE1 4.06Å; P253-Y284 HydrophobicContact CG-CE2 3.53Å; P253-Y284 HydrophobicContact CG-CG 4.05Å
254	R	95.7	Very high	95.8	Very high	177 Å²	177	54.8 Å²	54.8	67%	0.668	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.1	175	66.2	-179.8	-172.8	172.5	11.1	112.9	F256 R257 P258 R287	R254-F256 PolarHBondContact O-N 3.25Å; R254-R257 WeakPolarHBondContact O-CB 3.46Å; R254-R257 PolarHBondContact O-N 2.78Å; R254-R257 VanDerWaalsContact O-N 3.11Å; R254-P258 WeakPolarHBondContact O-CD 3.4Å; R254-R287 VanDerWaalsContact NH2-CD 3.25Å
255	E	97	Very high	95.9	Very high	15 Å²	15	57.7 Å²	57.7	7%	0.07	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.3	177.3	-64.5	75.2	-165.3	0	0	113.1	P253 R257 P258 L280 Y284 R287	P253-E255 WeakPolarHBondContact CB-OE2 3.29Å; P253-E255 PolarHBondContact O-N 2.97Å; P253-E255 VanDerWaalsContact O-N 3.1Å; E255-R257 VanDerWaalsContact C-N 3.31Å; E255-P258 WeakPolarHBondContact O-CG 3.39Å; E255-L280 HydrophobicContact CB-CB 4.5Å; E255-Y284 WeakPolarHBondContact OE2-CD2 3.49Å; E255-R287 IonicContact OE1-CZ 3.22Å; E255-R287 VanDerWaalsContact OE1-CZ 3.25Å; E255-R287 IonicContact OE1-NE 2.66Å; E255-R287 PolarHBondContact OE1-NE 3.38Å; E255-R287 IonicContact OE1-NH2 2.63Å; E255-R287 PolarHBondContact OE1-NH2 2.71Å; E255-R287 IonicContact OE2-CZ 3.22Å; E255-R287 IonicContact OE2-NH2 3.37Å; E255-R287 PolarHBondContact OE2-NH2 3.25Å
256	F	97	Very high	96	Very high	1 Å²	1	58 Å²	58	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-78.3	-15	173	-79.8	-119.8	0	0	0	113	V116 L217 L249 M252 P253 R254 F259 L260 L281	V116-F256 HydrophobicContact CG2-CE2 4.18Å; V116-F256 HydrophobicContact CG2-CZ 4.36Å; L217-F256 HydrophobicContact CB-CE1 3.79Å; L217-F256 HydrophobicContact CD1-CE1 3.63Å; L217-F256 HydrophobicContact CD1-CZ 4.04Å; L217-F256 HydrophobicContact CG-CE1 4.32Å; L249-F256 HydrophobicContact CD2-CB 3.82Å; M252-F256 HydrophobicContact CB-CB 3.92Å; M252-F256 HydrophobicContact CB-CD1 4.32Å; M252-F256 HydrophobicContact CB-CG 4.02Å; M252-F256 HydrophobicContact CE-CD1 4.39Å; M252-F256 HydrophobicContact CG-CD1 4.22Å; M252-F256 HydrophobicContact CG-CG 4.41Å; M252-F256 HydrophobicContact SD-CB 3.92Å; M252-F256 HydrophobicContact SD-CD1 3.58Å; M252-F256 VanDerWaalsContact SD-CD1 3.58Å; M252-F256 HydrophobicContact SD-CE1 4.44Å; M252-F256 HydrophobicContact SD-CG 4.04Å; P253-F256 HydrophobicContact CB-CD2 3.88Å; P253-F256 HydrophobicContact CB-CE2 4.27Å; P253-F256 HydrophobicContact CG-CD2 3.89Å; P253-F256 HydrophobicContact CG-CE2 3.85Å; P253-F256 WeakPolarHBondContact O-CB 3.29Å; P253-F256 PolarHBondContact O-N 2.86Å; R254-F256 PolarHBondContact O-N 3.25Å; F256-F259 WeakPolarHBondContact O-CB 3.44Å; F256-F259 PolarHBondContact O-N 2.79Å; F256-L260 WeakPolarHBondContact O-CB 3.25Å; F256-L260 PolarHBondContact O-N 2.89Å; F256-L281 HydrophobicContact CE2-CD2 4.19Å; F256-L281 HydrophobicContact CZ-CD2 4.22Å
257	R	97.9	Very high	96.2	Very high	133 Å²	133	59 Å²	59	50%	0.502	27%	0.272	S	S	.	.	H	α-helix	trans	-65.3	-56.9	174.3	-178.1	173.7	179.5	130.7	17.7	111.9	L249 R254 E255 F259 L260 E261	L249-R257 HydrophobicContact CD1-CB 3.88Å; L249-R257 HydrophobicContact CD1-CG 3.97Å; R254-R257 WeakPolarHBondContact O-CB 3.46Å; R254-R257 PolarHBondContact O-N 2.78Å; R254-R257 VanDerWaalsContact O-N 3.11Å; E255-R257 VanDerWaalsContact C-N 3.31Å; R257-F259 PolarHBondContact O-N 3.36Å; R257-L260 WeakPolarHBondContact O-CB 3.33Å; R257-L260 PolarHBondContact O-N 3.46Å; R257-L260 VanDerWaalsContact O-N 3.1Å; R257-E261 HydrophobicContact CG-CG 4.45Å; R257-E261 WeakPolarHBondContact CG-OE1 3.45Å; R257-E261 IonicContact CZ-OE1 3.61Å; R257-E261 IonicContact NE-OE1 3.76Å; R257-E261 PolarHBondContact NE-OE1 3.15Å; R257-E261 IonicContact NH2-OE1 3.36Å; R257-E261 PolarHBondContact NH2-OE1 3.49Å; R257-E261 VanDerWaalsContact NH2-OE1 3.15Å; R257-E261 WeakPolarHBondContact O-CG 3.19Å; R257-E261 PolarHBondContact O-N 3.15Å
258	P	98.2	Very high	96.4	Very high	29 Å²	29	54.6 Å²	54.6	19%	0.188	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-27.1	172.8	20.7	-31.1	0	0	0	113.5	R254 E255 H262 Y276 L280	R254-P258 WeakPolarHBondContact O-CD 3.4Å; E255-P258 WeakPolarHBondContact O-CG 3.39Å; P258-H262 VanDerWaalsContact O-CB 3.28Å; P258-H262 WeakPolarHBondContact O-CB 3.15Å; P258-H262 PolarHBondContact O-N 2.81Å; P258-Y276 HydrophobicContact CB-CE1 4.44Å; P258-Y276 VanDerWaalsContact CB-OH 3.25Å; P258-Y276 WeakPolarHBondContact CB-OH 3.19Å; P258-L280 HydrophobicContact CB-CD1 4Å; P258-L280 HydrophobicContact CB-CD2 4.15Å; P258-L280 HydrophobicContact CG-CD1 3.98Å; P258-L280 HydrophobicContact CG-CD2 3.6Å; P258-L280 HydrophobicContact CG-CG 4.45Å
259	F	98.5	Very high	96.7	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.009	27%	0.273	C	S	.	.	H	α-helix	trans	-60.7	-48.6	171.1	-168.7	-65.4	0	0	0	110.8	L213 Y214 F256 R257 I263 L277 L280	L213-F259 HydrophobicContact CD2-CZ 4.19Å; Y214-F259 HydrophobicContact CD2-CD1 4.25Å; F256-F259 WeakPolarHBondContact O-CB 3.44Å; F256-F259 PolarHBondContact O-N 2.79Å; R257-F259 PolarHBondContact O-N 3.36Å; F259-I263 HydrophobicContact CD1-CD1 4.4Å; F259-I263 HydrophobicContact CD1-CG2 4.44Å; F259-I263 HydrophobicContact CE1-CD1 4.31Å; F259-I263 HydrophobicContact CE1-CG2 4.24Å; F259-I263 PolarHBondContact O-N 3.26Å; F259-L277 HydrophobicContact CB-CD2 4.27Å; F259-L277 HydrophobicContact CD1-CD2 4.18Å; F259-L277 HydrophobicContact CD2-CD2 3.55Å; F259-L277 HydrophobicContact CE1-CD2 4.39Å; F259-L277 HydrophobicContact CE2-CB 4.22Å; F259-L277 HydrophobicContact CE2-CD1 4.38Å; F259-L277 HydrophobicContact CE2-CD2 3.79Å; F259-L277 HydrophobicContact CE2-CG 4.35Å; F259-L277 HydrophobicContact CG-CD2 3.72Å; F259-L277 HydrophobicContact CZ-CD1 4.28Å; F259-L277 HydrophobicContact CZ-CD2 4.21Å; F259-L280 HydrophobicContact CB-CD1 4.09Å
260	L	98.2	Very high	96.9	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-49.7	176.6	174.7	63.8	0	0	0	111.5	W211 Y214 H245 L249 F256 R257 H262 I263 Q264	W211-L260 HydrophobicContact CH2-CD1 3.71Å; W211-L260 HydrophobicContact CZ3-CD1 3.9Å; Y214-L260 HydrophobicContact CD1-CD1 4.3Å; Y214-L260 HydrophobicContact CE1-CD1 3.83Å; Y214-L260 HydrophobicContact CE2-CB 4.11Å; Y214-L260 HydrophobicContact CE2-CD1 4.4Å; H245-L260 HydrophobicContact CB-CD1 3.84Å; H245-L260 HydrophobicContact CB-CD2 3.8Å; H245-L260 HydrophobicContact CB-CG 4.45Å; L249-L260 HydrophobicContact CD1-CD2 4.1Å; L249-L260 HydrophobicContact CG-CD2 4.38Å; F256-L260 WeakPolarHBondContact O-CB 3.25Å; F256-L260 PolarHBondContact O-N 2.89Å; R257-L260 WeakPolarHBondContact O-CB 3.33Å; R257-L260 PolarHBondContact O-N 3.46Å; R257-L260 VanDerWaalsContact O-N 3.1Å; L260-H262 VanDerWaalsContact C-N 3.25Å; L260-H262 PolarHBondContact O-N 3.13Å; L260-I263 HydrophobicContact CD1-CG1 4.49Å; L260-I263 WeakPolarHBondContact O-CG1 3.48Å; L260-I263 PolarHBondContact O-N 2.98Å; L260-Q264 HydrophobicContact CD1-CG 3.94Å; L260-Q264 HydrophobicContact CG-CG 4.28Å; L260-Q264 WeakPolarHBondContact O-CB 3.15Å; L260-Q264 WeakPolarHBondContact O-CG 3.33Å; L260-Q264 PolarHBondContact O-N 3.25Å
261	E	98.2	Very high	97.2	Very high	68 Å²	68	59.9 Å²	59.9	32%	0.318	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-35.5	-178.6	-69.3	164.7	165.4	0	0	111.1	R257 N265	R257-E261 HydrophobicContact CG-CG 4.45Å; R257-E261 WeakPolarHBondContact CG-OE1 3.45Å; R257-E261 IonicContact CZ-OE1 3.61Å; R257-E261 IonicContact NE-OE1 3.76Å; R257-E261 PolarHBondContact NE-OE1 3.15Å; R257-E261 IonicContact NH2-OE1 3.36Å; R257-E261 PolarHBondContact NH2-OE1 3.49Å; R257-E261 VanDerWaalsContact NH2-OE1 3.15Å; R257-E261 WeakPolarHBondContact O-CG 3.19Å; R257-E261 PolarHBondContact O-N 3.15Å; E261-N265 PolarHBondContact O-N 2.93Å; E261-N265 PolarHBondContact O-ND2 3.31Å
262	H	98.6	Very high	97.7	Very high	38 Å²	38	54.1 Å²	54.1	18%	0.176	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-56.1	170.9	-175.8	64	0	0	0	112.5	P258 L260 Q264 N265 D273 Y276 L277	P258-H262 VanDerWaalsContact O-CB 3.28Å; P258-H262 WeakPolarHBondContact O-CB 3.15Å; P258-H262 PolarHBondContact O-N 2.81Å; L260-H262 VanDerWaalsContact C-N 3.25Å; L260-H262 PolarHBondContact O-N 3.13Å; H262-Q264 PolarHBondContact O-N 2.88Å; H262-N265 PolarHBondContact O-N 3.41Å; H262-N265 VanDerWaalsContact O-N 3.08Å; H262-D273 PolarHBondContact NE2-N 2.84Å; H262-D273 PolarHBondContact NE2-O 3.34Å; H262-Y276 HydrophobicContact CB-CD1 4.42Å; H262-Y276 HydrophobicContact CB-CE1 4.26Å; H262-L277 HydrophobicContact CB-CD2 4.45Å
263	I	98.4	Very high	97.9	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70	-17.3	-176	67.7	172.2	0	0	0	114.1	L210 W211 Y214 F259 L260	L210-I263 HydrophobicContact CB-CG2 4.06Å; L210-I263 HydrophobicContact CD1-CG2 4.42Å; W211-I263 HydrophobicContact CD2-CD1 3.85Å; W211-I263 HydrophobicContact CD2-CG1 4.34Å; W211-I263 HydrophobicContact CE3-CD1 3.94Å; W211-I263 HydrophobicContact CG-CD1 4.25Å; W211-I263 HydrophobicContact CZ2-CD1 4.5Å; W211-I263 HydrophobicContact CZ2-CG1 4.23Å; W211-I263 HydrophobicContact CZ3-CD1 4.3Å; W211-I263 PolarHBondContact NE1-O 3.39Å; Y214-I263 HydrophobicContact CG-CD1 4.06Å; F259-I263 HydrophobicContact CD1-CD1 4.4Å; F259-I263 HydrophobicContact CD1-CG2 4.44Å; F259-I263 HydrophobicContact CE1-CD1 4.31Å; F259-I263 HydrophobicContact CE1-CG2 4.24Å; F259-I263 PolarHBondContact O-N 3.26Å; L260-I263 HydrophobicContact CD1-CG1 4.49Å; L260-I263 WeakPolarHBondContact O-CG1 3.48Å; L260-I263 PolarHBondContact O-N 2.98Å
264	Q	97.7	Very high	98	Very high	80 Å²	80	56.6 Å²	56.6	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-72.3	-32.9	170.5	-79.8	175.6	-31.1	0	0	112.9	W211 L260 H262	W211-Q264 HydrophobicContact CH2-CG 3.65Å; W211-Q264 HydrophobicContact CZ2-CB 4.39Å; W211-Q264 HydrophobicContact CZ2-CG 3.57Å; L260-Q264 HydrophobicContact CD1-CG 3.94Å; L260-Q264 HydrophobicContact CG-CG 4.28Å; L260-Q264 WeakPolarHBondContact O-CB 3.15Å; L260-Q264 WeakPolarHBondContact O-CG 3.33Å; L260-Q264 PolarHBondContact O-N 3.25Å; H262-Q264 PolarHBondContact O-N 2.88Å
265	N	97.7	Very high	98.2	Very high	133 Å²	133	53.8 Å²	53.8	71%	0.711	26%	0.256	S	S	*	.	H	α-helix	trans	-85.6	-9.4	-177.1	-71.7	-39.6	0	0	0	114.1	E261 H262	E261-N265 PolarHBondContact O-N 2.93Å; E261-N265 PolarHBondContact O-ND2 3.31Å; H262-N265 PolarHBondContact O-N 3.41Å; H262-N265 VanDerWaalsContact O-N 3.08Å
266	L	98.6	Very high	98.3	Very high	26 Å²	26	57.5 Å²	57.5	14%	0.136	27%	0.27	C	S	.	.			trans	-84.2	137.1	-177.8	-64.4	172	0	0	0	113.1	H207 D270 P272	H207-L266 HydrophobicContact CB-CB 3.69Å; H207-L266 HydrophobicContact CB-CD1 4.05Å; H207-L266 PolarHBondContact CD2-O 3.13Å; L266-D270 HydrophobicContact CD2-CB 3.72Å; L266-P272 HydrophobicContact CD1-CB 3.72Å; L266-P272 HydrophobicContact CD1-CG 3.94Å
267	T	98.3	Very high	98.3	Very high	71 Å²	71	57.4 Å²	57.4	44%	0.436	27%	0.27	S	S	.	.			trans	-101.5	-178.5	170.5	81.5	0	0	0	0	111.9	F269 D270	T267-F269 PolarHBondContact O-N 3.09Å; T267-F269 PolarHBondContact OG1-N 3.2Å; T267-D270 WeakPolarHBondContact CA-OD2 3.34Å; T267-D270 WeakPolarHBondContact CB-OD2 3.27Å; T267-D270 WeakPolarHBondContact CG2-OD2 3.15Å; T267-D270 PolarHBondContact N-OD2 2.91Å; T267-D270 PolarHBondContact O-N 2.76Å; T267-D270 PolarHBondContact OG1-OD2 3.36Å
268	Y	98.3	Very high	98.4	Very high	26 Å²	26	52.3 Å²	52.3	10%	0.102	25%	0.252	C	S	.	.	S	Bend	trans	-55.8	-35.5	174.3	173.8	-98.4	0	0	0	113.8	I178 R179 P181 E203 L204	I178-Y268 HydrophobicContact CG2-CD1 4.27Å; I178-Y268 HydrophobicContact CG2-CE1 3.57Å; R179-Y268 VanDerWaalsContact O-CE1 3.3Å; R179-Y268 WeakPolarHBondContact O-CE1 3.04Å; R179-Y268 PolarHBondContact O-OH 3.32Å; R179-Y268 VanDerWaalsContact O-OH 3.05Å; P181-Y268 HydrophobicContact CB-CD1 3.92Å; P181-Y268 HydrophobicContact CB-CE1 3.8Å; P181-Y268 HydrophobicContact CB-CE2 4.47Å; P181-Y268 HydrophobicContact CB-CG 4.31Å; P181-Y268 HydrophobicContact CG-CD1 4.01Å; P181-Y268 HydrophobicContact CG-CE1 4.07Å; E203-Y268 HydrophobicContact CB-CE2 4.34Å; E203-Y268 HydrophobicContact CG-CD2 4.32Å; E203-Y268 HydrophobicContact CG-CE2 3.65Å; L204-Y268 WeakPolarHBondContact O-CD2 3.29Å; L204-Y268 WeakPolarHBondContact O-CE2 3.3Å
269	F	98.3	Very high	98.4	Very high	114 Å²	114	53.8 Å²	53.8	50%	0.5	26%	0.262	S	S	.	.	S	Bend	trans	-84.1	-25.9	-172.8	-61.7	-75.8	0	0	0	113.2	I178 P181 R206 T267	I178-F269 HydrophobicContact CG2-CD1 4.12Å; P181-F269 HydrophobicContact CG-CE1 4.44Å; P181-F269 HydrophobicContact CG-CZ 3.82Å; R206-F269 PolarHBondContact NH2-O 2.96Å; T267-F269 PolarHBondContact O-N 3.09Å; T267-F269 PolarHBondContact OG1-N 3.2Å
270	D	98.2	Very high	98.4	Very high	67 Å²	67	54.6 Å²	54.6	36%	0.358	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-71.6	146.3	-171.6	-57	-61.5	0	0	0	112.2	R206 L266 T267	R206-D270 VanDerWaalsContact CZ-O 3.27Å; R206-D270 PolarHBondContact NE-O 3.21Å; R206-D270 PolarHBondContact NH2-O 3.46Å; L266-D270 HydrophobicContact CD2-CB 3.72Å; T267-D270 WeakPolarHBondContact CA-OD2 3.34Å; T267-D270 WeakPolarHBondContact CB-OD2 3.27Å; T267-D270 WeakPolarHBondContact CG2-OD2 3.15Å; T267-D270 PolarHBondContact N-OD2 2.91Å; T267-D270 PolarHBondContact O-N 2.76Å; T267-D270 PolarHBondContact OG1-OD2 3.36Å
271	R	98.2	Very high	98.4	Very high	129 Å²	129	54.7 Å²	54.7	49%	0.487	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-87.8	119.2	166.5	176.8	173.5	166.7	87.5	8.9	107.1	E127 N131 D273 Y274	E127-R271 IonicContact OE1-CZ 3.38Å; E127-R271 IonicContact OE1-NH2 2.71Å; E127-R271 PolarHBondContact OE1-NH2 2.71Å; N131-R271 PolarHBondContact OD1-NH1 3.22Å; R271-D273 PolarHBondContact O-N 3.25Å; R271-Y274 HydrophobicContact CG-CE2 4.35Å
272	P	98.7	Very high	98.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-57.9	136.2	170.5	-18	28.1	0	0	0	110.2	R206 L210 L266 Y274	R206-P272 HydrophobicContact CB-CG 3.71Å; L210-P272 HydrophobicContact CD1-CB 3.45Å; L210-P272 VanDerWaalsContact CD1-CB 3.45Å; L210-P272 HydrophobicContact CD1-CG 3.61Å; L266-P272 HydrophobicContact CD1-CB 3.72Å; L266-P272 HydrophobicContact CD1-CG 3.94Å; P272-Y274 HydrophobicContact CB-CE1 4.07Å; P272-Y274 HydrophobicContact CB-CE2 4.29Å; P272-Y274 HydrophobicContact CG-CE1 4.28Å; P272-Y274 WeakPolarHBondContact O-CD2 3.18Å; P272-Y274 WeakPolarHBondContact O-CE2 2.98Å; P272-Y274 PolarHBondContact O-N 3.16Å; P272-Y274 VanDerWaalsContact O-N 3.09Å
273	D	98.6	Very high	98.3	Very high	77 Å²	77	53.5 Å²	53.5	41%	0.412	27%	0.27	S	S	.	.			trans	-74.8	95.8	167.2	-171.6	-16	0	0	0	109.7	H262 R271 M275 Y276 L277	H262-D273 PolarHBondContact NE2-N 2.84Å; H262-D273 PolarHBondContact NE2-O 3.34Å; R271-D273 PolarHBondContact O-N 3.25Å; D273-M275 VanDerWaalsContact C-N 3.32Å; D273-M275 WeakPolarHBondContact OD1-CA 3.47Å; D273-M275 WeakPolarHBondContact OD1-CB 3.44Å; D273-M275 PolarHBondContact OD1-N 2.97Å; D273-Y276 VanDerWaalsContact CG-CB 3.46Å; D273-Y276 PolarHBondContact OD1-N 2.96Å; D273-Y276 WeakPolarHBondContact OD2-CB 3.42Å; D273-L277 WeakPolarHBondContact O-CG 3.47Å; D273-L277 PolarHBondContact O-N 2.87Å
274	Y	98.7	Very high	98.3	Very high	2 Å²	2	54 Å²	54	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-70.9	-26.9	175.7	-52.9	-83	0	0	0	112.4	L123 E127 H130 L210 R271 P272 L277 H278	L123-Y274 HydrophobicContact CD1-CD1 4.01Å; E127-Y274 HydrophobicContact CB-CD1 3.89Å; E127-Y274 HydrophobicContact CB-CD2 4.43Å; E127-Y274 HydrophobicContact CB-CE1 4.14Å; E127-Y274 HydrophobicContact CB-CG 4.06Å; E127-Y274 VanDerWaalsContact CD-CD2 3.48Å; E127-Y274 HydrophobicContact CG-CD1 4.43Å; E127-Y274 HydrophobicContact CG-CD2 4.08Å; E127-Y274 HydrophobicContact CG-CE2 4.34Å; E127-Y274 HydrophobicContact CG-CG 4.14Å; E127-Y274 WeakPolarHBondContact OE1-CD2 3.43Å; E127-Y274 WeakPolarHBondContact OE2-CB 3.29Å; H130-Y274 AromaticContact ND1-CE1 3.99Å; H130-Y274 AromaticContact ND1-CZ 3.76Å; H130-Y274 PolarHBondContact ND1-OH 2.85Å; L210-Y274 HydrophobicContact CD1-CE1 4.2Å; L210-Y274 HydrophobicContact CD2-CE1 4.44Å; R271-Y274 HydrophobicContact CG-CE2 4.35Å; P272-Y274 HydrophobicContact CB-CE1 4.07Å; P272-Y274 HydrophobicContact CB-CE2 4.29Å; P272-Y274 HydrophobicContact CG-CE1 4.28Å; P272-Y274 WeakPolarHBondContact O-CD2 3.18Å; P272-Y274 WeakPolarHBondContact O-CE2 2.98Å; P272-Y274 PolarHBondContact O-N 3.16Å; P272-Y274 VanDerWaalsContact O-N 3.09Å; Y274-L277 PolarHBondContact O-N 3.49Å; Y274-H278 WeakPolarHBondContact O-CB 3.19Å; Y274-H278 PolarHBondContact O-CD2 3.13Å; Y274-H278 PolarHBondContact O-N 2.86Å
275	M	98.4	Very high	98.3	Very high	119 Å²	119	50.6 Å²	50.6	59%	0.586	26%	0.256	S	S	*	.	H	α-helix	trans	-71.5	-39.4	179.7	-62.9	-62.6	100.1	0	0	110.6	D273 H278 S279	D273-M275 VanDerWaalsContact C-N 3.32Å; D273-M275 WeakPolarHBondContact OD1-CA 3.47Å; D273-M275 WeakPolarHBondContact OD1-CB 3.44Å; D273-M275 PolarHBondContact OD1-N 2.97Å; M275-H278 PolarHBondContact O-N 3Å; M275-S279 PolarHBondContact O-N 2.97Å
276	Y	98.7	Very high	98.3	Very high	92 Å²	92	50.8 Å²	50.8	36%	0.361	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-48.8	168.8	-177.2	-118.3	0	0	0	111.9	P258 H262 D273 H278 S279 L280	P258-Y276 HydrophobicContact CB-CE1 4.44Å; P258-Y276 VanDerWaalsContact CB-OH 3.25Å; P258-Y276 WeakPolarHBondContact CB-OH 3.19Å; H262-Y276 HydrophobicContact CB-CD1 4.42Å; H262-Y276 HydrophobicContact CB-CE1 4.26Å; D273-Y276 VanDerWaalsContact CG-CB 3.46Å; D273-Y276 PolarHBondContact OD1-N 2.96Å; D273-Y276 WeakPolarHBondContact OD2-CB 3.42Å; Y276-H278 VanDerWaalsContact C-N 3.27Å; Y276-H278 PolarHBondContact O-N 2.88Å; Y276-S279 PolarHBondContact O-N 2.47Å; Y276-S279 VanDerWaalsContact O-N 3.15Å; Y276-S279 PolarHBondContact O-OG 3.01Å; Y276-L280 HydrophobicContact CD1-CD1 4.23Å; Y276-L280 HydrophobicContact CE1-CD1 3.85Å; Y276-L280 HydrophobicContact CE2-CD2 4.36Å; Y276-L280 HydrophobicContact CE2-CG 4.46Å; Y276-L280 WeakPolarHBondContact O-CG 3.33Å; Y276-L280 PolarHBondContact O-N 3.5Å; Y276-L280 VanDerWaalsContact O-N 3.13Å
277	L	98.7	Very high	98.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-34.6	177.6	-68.4	-177.8	0	0	0	112.7	L123 L210 F259 H262 D273 Y274 L280 L281	L123-L277 HydrophobicContact CD1-CD1 4.29Å; L123-L277 HydrophobicContact CD2-CB 3.67Å; L210-L277 HydrophobicContact CD1-CD1 3.89Å; L210-L277 HydrophobicContact CD2-CD1 4.38Å; F259-L277 HydrophobicContact CB-CD2 4.27Å; F259-L277 HydrophobicContact CD1-CD2 4.18Å; F259-L277 HydrophobicContact CD2-CD2 3.55Å; F259-L277 HydrophobicContact CE1-CD2 4.39Å; F259-L277 HydrophobicContact CE2-CB 4.22Å; F259-L277 HydrophobicContact CE2-CD1 4.38Å; F259-L277 HydrophobicContact CE2-CD2 3.79Å; F259-L277 HydrophobicContact CE2-CG 4.35Å; F259-L277 HydrophobicContact CG-CD2 3.72Å; F259-L277 HydrophobicContact CZ-CD1 4.28Å; F259-L277 HydrophobicContact CZ-CD2 4.21Å; H262-L277 HydrophobicContact CB-CD2 4.45Å; D273-L277 WeakPolarHBondContact O-CG 3.47Å; D273-L277 PolarHBondContact O-N 2.87Å; Y274-L277 PolarHBondContact O-N 3.49Å; L277-L280 HydrophobicContact CD2-CD1 4.41Å; L277-L281 WeakPolarHBondContact O-CG 3.39Å
278	H	98.5	Very high	98.2	Very high	26 Å²	26	58.3 Å²	58.3	12%	0.12	27%	0.271	C	S	.	.	H	α-helix	trans	-67.6	-44.1	172.1	-88	-63	0	0	0	112.7	R120 Y274 M275 Y276 L280 L281 N282	R120-H278 PolarHBondContact O-CE1 2.86Å; Y274-H278 WeakPolarHBondContact O-CB 3.19Å; Y274-H278 PolarHBondContact O-CD2 3.13Å; Y274-H278 PolarHBondContact O-N 2.86Å; M275-H278 PolarHBondContact O-N 3Å; Y276-H278 VanDerWaalsContact C-N 3.27Å; Y276-H278 PolarHBondContact O-N 2.88Å; H278-L280 VanDerWaalsContact C-N 3.29Å; H278-L280 PolarHBondContact O-N 3.02Å; H278-L281 PolarHBondContact O-N 2.99Å; H278-L281 VanDerWaalsContact O-N 3.15Å; H278-N282 PolarHBondContact O-N 3.03Å; H278-N282 PolarHBondContact O-OD1 3.35Å; H278-N282 VanDerWaalsContact O-OD1 3.11Å
279	S	98.5	Very high	98.1	Very high	59 Å²	59	67.6 Å²	67.6	41%	0.413	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-34.6	-179	75.2	0	0	0	0	112.5	M275 Y276 L281 N282 A283	M275-S279 PolarHBondContact O-N 2.97Å; Y276-S279 PolarHBondContact O-N 2.47Å; Y276-S279 VanDerWaalsContact O-N 3.15Å; Y276-S279 PolarHBondContact O-OG 3.01Å; S279-L281 PolarHBondContact O-N 3.19Å; S279-N282 PolarHBondContact O-N 2.74Å; S279-A283 VanDerWaalsContact O-CB 3.25Å; S279-A283 WeakPolarHBondContact O-CB 3.43Å; S279-A283 PolarHBondContact O-N 3.39Å
280	L	98.6	Very high	98.1	Very high	19 Å²	19	63.2 Å²	63.2	10%	0.099	29%	0.287	C	S	.	.	H	α-helix	trans	-61.5	-41.2	172.9	-66.7	177.1	0	0	0	113	E255 P258 F259 Y276 L277 H278 Y284	E255-L280 HydrophobicContact CB-CB 4.5Å; P258-L280 HydrophobicContact CB-CD1 4Å; P258-L280 HydrophobicContact CB-CD2 4.15Å; P258-L280 HydrophobicContact CG-CD1 3.98Å; P258-L280 HydrophobicContact CG-CD2 3.6Å; P258-L280 HydrophobicContact CG-CG 4.45Å; F259-L280 HydrophobicContact CB-CD1 4.09Å; Y276-L280 HydrophobicContact CD1-CD1 4.23Å; Y276-L280 HydrophobicContact CE1-CD1 3.85Å; Y276-L280 HydrophobicContact CE2-CD2 4.36Å; Y276-L280 HydrophobicContact CE2-CG 4.46Å; Y276-L280 WeakPolarHBondContact O-CG 3.33Å; Y276-L280 PolarHBondContact O-N 3.5Å; Y276-L280 VanDerWaalsContact O-N 3.13Å; L277-L280 HydrophobicContact CD2-CD1 4.41Å; H278-L280 VanDerWaalsContact C-N 3.29Å; H278-L280 PolarHBondContact O-N 3.02Å; L280-Y284 PolarHBondContact O-N 3.17Å
281	L	98.2	Very high	98	Very high	2 Å²	2	64 Å²	64	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-71.1	-41.7	177.5	-63.2	172.6	0	0	0	111.4	V116 A119 R120 L123 F256 L277 H278 S279 Y284 M285	V116-L281 HydrophobicContact CG1-CB 4.21Å; V116-L281 HydrophobicContact CG1-CD2 4.15Å; A119-L281 HydrophobicContact CB-CD1 3.95Å; A119-L281 HydrophobicContact CB-CD2 3.92Å; R120-L281 HydrophobicContact CG-CB 3.74Å; R120-L281 HydrophobicContact CG-CD1 3.82Å; R120-L281 HydrophobicContact CG-CG 4.42Å; L123-L281 HydrophobicContact CD2-CD1 4.11Å; F256-L281 HydrophobicContact CE2-CD2 4.19Å; F256-L281 HydrophobicContact CZ-CD2 4.22Å; L277-L281 WeakPolarHBondContact O-CG 3.39Å; H278-L281 PolarHBondContact O-N 2.99Å; H278-L281 VanDerWaalsContact O-N 3.15Å; S279-L281 PolarHBondContact O-N 3.19Å; L281-Y284 PolarHBondContact O-N 2.79Å; L281-M285 PolarHBondContact O-N 3.02Å
282	N	98	Very high	97.9	Very high	42 Å²	42	61.8 Å²	61.8	23%	0.225	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-48.5	177.2	-63.5	1.6	0	0	0	111.2	R120 H278 S279 Y284 M285 E286	R120-N282 PolarHBondContact NE-OD1 3.28Å; H278-N282 PolarHBondContact O-N 3.03Å; H278-N282 PolarHBondContact O-OD1 3.35Å; H278-N282 VanDerWaalsContact O-OD1 3.11Å; S279-N282 PolarHBondContact O-N 2.74Å; N282-Y284 PolarHBondContact O-N 3.5Å; N282-M285 WeakPolarHBondContact O-CA 3.36Å; N282-M285 WeakPolarHBondContact O-CB 3.48Å; N282-M285 PolarHBondContact O-N 2.95Å; N282-E286 WeakPolarHBondContact O-CG 3.37Å; N282-E286 PolarHBondContact O-N 3.1Å
283	A	97.8	Very high	97.7	Very high	40 Å²	40	66.3 Å²	66.3	33%	0.331	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-30.7	179	0	0	0	0	0	112.9	S279 R287	S279-A283 VanDerWaalsContact O-CB 3.25Å; S279-A283 WeakPolarHBondContact O-CB 3.43Å; S279-A283 PolarHBondContact O-N 3.39Å; A283-R287 WeakPolarHBondContact O-CB 3.19Å; A283-R287 PolarHBondContact O-N 3.49Å
284	Y	97.5	Very high	97.6	Very high	11 Å²	11	64.4 Å²	64.4	4%	0.043	31%	0.309	C	S	.	.	H	α-helix	trans	-69.3	-45.4	170.2	-178.5	-101.9	0	0	0	112.5	I112 V116 P253 E255 L280 L281 N282 R287 R288 I290	I112-Y284 HydrophobicContact CB-CE1 4.43Å; I112-Y284 HydrophobicContact CG2-CD1 4.5Å; I112-Y284 HydrophobicContact CG2-CE1 3.54Å; V116-Y284 HydrophobicContact CB-CD1 4.26Å; V116-Y284 HydrophobicContact CG1-CD1 4.18Å; V116-Y284 HydrophobicContact CG2-CD1 3.76Å; V116-Y284 HydrophobicContact CG2-CE1 4.1Å; P253-Y284 HydrophobicContact CB-CD2 3.42Å; P253-Y284 VanDerWaalsContact CB-CD2 3.42Å; P253-Y284 HydrophobicContact CB-CE2 3.53Å; P253-Y284 HydrophobicContact CB-CG 4.03Å; P253-Y284 HydrophobicContact CG-CD1 4.23Å; P253-Y284 HydrophobicContact CG-CD2 3.72Å; P253-Y284 HydrophobicContact CG-CE1 4.06Å; P253-Y284 HydrophobicContact CG-CE2 3.53Å; P253-Y284 HydrophobicContact CG-CG 4.05Å; E255-Y284 WeakPolarHBondContact OE2-CD2 3.49Å; L280-Y284 PolarHBondContact O-N 3.17Å; L281-Y284 PolarHBondContact O-N 2.79Å; N282-Y284 PolarHBondContact O-N 3.5Å; Y284-R287 PolarHBondContact O-N 3.39Å; Y284-R288 HydrophobicContact CD1-CG 4.44Å; Y284-R288 HydrophobicContact CD2-CG 4.2Å; Y284-R288 HydrophobicContact CE1-CB 4.48Å; Y284-R288 HydrophobicContact CE1-CG 3.9Å; Y284-R288 HydrophobicContact CE2-CG 3.63Å; Y284-R288 VanDerWaalsContact CZ-CG 3.47Å; Y284-R288 WeakPolarHBondContact O-CB 3.45Å; Y284-R288 PolarHBondContact O-N 2.94Å; Y284-R288 PolarHBondContact OH-NE 3.1Å; Y284-I290 HydrophobicContact CD1-CD1 4.01Å; Y284-I290 HydrophobicContact CE1-CD1 3.57Å
285	M	98	Very high	97.6	Very high	8 Å²	8	67.7 Å²	67.7	4%	0.039	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-49.5	-179.7	-71.2	178.4	60.8	0	0	111.4	V116 R117 R120 L281 N282 R287 R288 R289 I290 E292	V116-M285 HydrophobicContact CG1-CG 3.67Å; V116-M285 HydrophobicContact CG1-SD 4.03Å; R117-M285 HydrophobicContact CG-CE 3.77Å; R117-M285 HydrophobicContact CG-SD 4.19Å; R120-M285 WeakPolarHBondContact CD-SD 3.45Å; R120-M285 PolarHBondContact NH1-SD 3.09Å; L281-M285 PolarHBondContact O-N 3.02Å; N282-M285 WeakPolarHBondContact O-CA 3.36Å; N282-M285 WeakPolarHBondContact O-CB 3.48Å; N282-M285 PolarHBondContact O-N 2.95Å; M285-R287 PolarHBondContact O-N 3.15Å; M285-R288 CarbonylContact O-C 3.46Å; M285-R288 PolarHBondContact O-N 3.1Å; M285-R288 VanDerWaalsContact O-N 3.14Å; M285-R289 WeakPolarHBondContact O-CA 3.24Å; M285-R289 PolarHBondContact O-N 3.46Å; M285-I290 HydrophobicContact CB-CB 4.19Å; M285-I290 HydrophobicContact CE-CG2 4.11Å; M285-I290 WeakPolarHBondContact CE-O 3.42Å; M285-I290 HydrophobicContact CG-CB 4.21Å; M285-I290 HydrophobicContact CG-CG2 4.29Å; M285-I290 PolarHBondContact O-N 2.81Å; M285-E292 HydrophobicContact CE-CG 4.47Å; M285-E292 WeakPolarHBondContact CE-OE1 2.93Å
286	E	97.3	Very high	97.5	Very high	137 Å²	137	62.2 Å²	62.2	64%	0.64	30%	0.303	S	S	*	.	H	α-helix	trans	-55.9	-52.1	175.6	-68.7	158.9	-153.6	0	0	111.2	N282 R288 R289	N282-E286 WeakPolarHBondContact O-CG 3.37Å; N282-E286 PolarHBondContact O-N 3.1Å; E286-R288 PolarHBondContact O-N 3.11Å; E286-R288 VanDerWaalsContact O-N 3.13Å; E286-R289 PolarHBondContact O-N 3.2Å; E286-R289 VanDerWaalsContact O-N 3.07Å
287	R	97.1	Very high	97.4	Very high	103 Å²	103	59.2 Å²	59.2	39%	0.389	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-19.3	179.4	-172.9	173.5	66.7	72.7	-8.8	113.9	R254 E255 A283 Y284 M285	R254-R287 VanDerWaalsContact NH2-CD 3.25Å; E255-R287 IonicContact OE1-CZ 3.22Å; E255-R287 VanDerWaalsContact OE1-CZ 3.25Å; E255-R287 IonicContact OE1-NE 2.66Å; E255-R287 PolarHBondContact OE1-NE 3.38Å; E255-R287 IonicContact OE1-NH2 2.63Å; E255-R287 PolarHBondContact OE1-NH2 2.71Å; E255-R287 IonicContact OE2-CZ 3.22Å; E255-R287 IonicContact OE2-NH2 3.37Å; E255-R287 PolarHBondContact OE2-NH2 3.25Å; A283-R287 WeakPolarHBondContact O-CB 3.19Å; A283-R287 PolarHBondContact O-N 3.49Å; Y284-R287 PolarHBondContact O-N 3.39Å; M285-R287 PolarHBondContact O-N 3.15Å
288	R	97.2	Very high	97.2	Very high	152 Å²	152	62.4 Å²	62.4	57%	0.574	31%	0.305	S	S	*	.	H	α-helix	trans	-107.5	-2.9	175.6	-73	-58.4	-152.3	176.3	4.8	114.4	Y284 M285 E286 I290	Y284-R288 HydrophobicContact CD1-CG 4.44Å; Y284-R288 HydrophobicContact CD2-CG 4.2Å; Y284-R288 HydrophobicContact CE1-CB 4.48Å; Y284-R288 HydrophobicContact CE1-CG 3.9Å; Y284-R288 HydrophobicContact CE2-CG 3.63Å; Y284-R288 VanDerWaalsContact CZ-CG 3.47Å; Y284-R288 WeakPolarHBondContact O-CB 3.45Å; Y284-R288 PolarHBondContact O-N 2.94Å; Y284-R288 PolarHBondContact OH-NE 3.1Å; M285-R288 CarbonylContact O-C 3.46Å; M285-R288 PolarHBondContact O-N 3.1Å; M285-R288 VanDerWaalsContact O-N 3.14Å; E286-R288 PolarHBondContact O-N 3.11Å; E286-R288 VanDerWaalsContact O-N 3.13Å; R288-I290 VanDerWaalsContact C-N 3.26Å; R288-I290 HydrophobicContact CB-CD1 3.58Å; R288-I290 HydrophobicContact CB-CG1 3.74Å; R288-I290 HydrophobicContact CG-CD1 4.26Å; R288-I290 PolarHBondContact O-N 2.97Å
289	R	97.3	Very high	97.1	Very high	221 Å²	221	64.3 Å²	64.3	83%	0.834	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	39.7	-172.1	-53.6	-179.5	-178.9	179.8	-1.4	113.1	M285 E286 N291	M285-R289 WeakPolarHBondContact O-CA 3.24Å; M285-R289 PolarHBondContact O-N 3.46Å; E286-R289 PolarHBondContact O-N 3.2Å; E286-R289 VanDerWaalsContact O-N 3.07Å; R289-N291 PolarHBondContact O-ND2 3.19Å
290	I	97.9	Very high	96.7	Very high	21 Å²	21	66 Å²	66	11%	0.108	32%	0.317	C	S	.	.			trans	-84.7	125.1	175.1	-63.1	161.5	0	0	0	108.5	S113 R117 Y284 M285 R288 D294	S113-I290 WeakPolarHBondContact OG-CG2 3.42Å; R117-I290 HydrophobicContact CG-CG2 4.25Å; Y284-I290 HydrophobicContact CD1-CD1 4.01Å; Y284-I290 HydrophobicContact CE1-CD1 3.57Å; M285-I290 HydrophobicContact CB-CB 4.19Å; M285-I290 HydrophobicContact CE-CG2 4.11Å; M285-I290 WeakPolarHBondContact CE-O 3.42Å; M285-I290 HydrophobicContact CG-CB 4.21Å; M285-I290 HydrophobicContact CG-CG2 4.29Å; M285-I290 PolarHBondContact O-N 2.81Å; R288-I290 VanDerWaalsContact C-N 3.26Å; R288-I290 HydrophobicContact CB-CD1 3.58Å; R288-I290 HydrophobicContact CB-CG1 3.74Å; R288-I290 HydrophobicContact CG-CD1 4.26Å; R288-I290 PolarHBondContact O-N 2.97Å; I290-D294 WeakPolarHBondContact CA-OD2 3.5Å; I290-D294 WeakPolarHBondContact CG2-OD2 3.43Å
291	N	96.8	Very high	95.2	Very high	83 Å²	83	69.7 Å²	69.7	44%	0.444	34%	0.341	S	S	.	.			trans	-107.3	152.6	-177.3	-41.7	-81.2	0	0	0	110.6	R117 R289 S293 D294	R117-N291 WeakPolarHBondContact CD-O 3.38Å; R289-N291 PolarHBondContact O-ND2 3.19Å; N291-S293 WeakPolarHBondContact CB-OG 3.25Å; N291-S293 PolarHBondContact O-N 3.14Å; N291-D294 WeakPolarHBondContact CB-OD1 3.3Å; N291-D294 VanDerWaalsContact N-CG 3.29Å; N291-D294 PolarHBondContact N-OD1 2.76Å; N291-D294 PolarHBondContact N-OD2 3.22Å; N291-D294 PolarHBondContact ND2-OD1 2.71Å; N291-D294 VanDerWaalsContact O-CB 3.32Å; N291-D294 WeakPolarHBondContact O-CB 3.43Å; N291-D294 VanDerWaalsContact O-CG 3.25Å; N291-D294 PolarHBondContact O-N 2.86Å
292	E	94.8	Very high	93.3	Very high	83 Å²	83	76.2 Å²	76.2	39%	0.388	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.7	173.3	-56.3	-65.1	178.6	0	0	112.4	R120 R158 M285	R120-E292 IonicContact CZ-OE1 3.85Å; R120-E292 IonicContact NE-OE1 3.85Å; R120-E292 IonicContact NH1-OE1 3.23Å; R120-E292 PolarHBondContact NH1-OE1 3.31Å; R120-E292 IonicContact NH2-OE1 3.95Å; R158-E292 PolarHBondContact NH1-O 3.26Å; M285-E292 HydrophobicContact CE-CG 4.47Å; M285-E292 WeakPolarHBondContact CE-OE1 2.93Å
293	S	96	Very high	90.9	Very high	95 Å²	95	82.3 Å²	82.3	66%	0.664	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.4	173	48.7	0	0	0	0	114.4	N291	N291-S293 WeakPolarHBondContact CB-OG 3.25Å; N291-S293 PolarHBondContact O-N 3.14Å
294	D	96.6	Very high	88.1	Confident	38 Å²	38	84.7 Å²	84.7	20%	0.203	42%	0.423	C	S	.	.	S	Bend	trans	-57.7	142.8	179.2	-65.7	-5.8	0	0	0	110.3	R117 R158 I290 N291 F296	R117-D294 PolarHBondContact NH1-O 2.95Å; R158-D294 PolarHBondContact NH2-O 3.36Å; I290-D294 WeakPolarHBondContact CA-OD2 3.5Å; I290-D294 WeakPolarHBondContact CG2-OD2 3.43Å; N291-D294 WeakPolarHBondContact CB-OD1 3.3Å; N291-D294 VanDerWaalsContact N-CG 3.29Å; N291-D294 PolarHBondContact N-OD1 2.76Å; N291-D294 PolarHBondContact N-OD2 3.22Å; N291-D294 PolarHBondContact ND2-OD1 2.71Å; N291-D294 VanDerWaalsContact O-CB 3.32Å; N291-D294 WeakPolarHBondContact O-CB 3.43Å; N291-D294 VanDerWaalsContact O-CG 3.25Å; N291-D294 PolarHBondContact O-N 2.86Å; D294-F296 PolarHBondContact O-N 2.9Å
295	P	97	Very high	84.8	Confident	71 Å²	71	89 Å²	89	46%	0.461	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-61.1	140.9	176.2	25.2	-33.6	0	0	0	111.2	R117 E299 I300	R117-P295 PolarHBondContact NH2-O 3.05Å; P295-E299 VanDerWaalsContact CA-OE2 3.29Å; P295-E299 WeakPolarHBondContact CA-OE2 3.3Å; P295-E299 HydrophobicContact CB-CB 4.14Å; P295-I300 HydrophobicContact CB-CG1 4.15Å; P295-I300 HydrophobicContact CG-CG1 4.35Å
296	F	97.3	Very high	81.5	Confident	3 Å²	3	95.1 Å²	95.1	1%	0.013	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-75.3	160.8	163.8	-71.6	-72.1	0	0	0	110.3	T114 R117 L118 R158 D294 W298 E299	T114-F296 HydrophobicContact CG2-CD1 3.94Å; T114-F296 WeakPolarHBondContact OG1-CA 3.2Å; R117-F296 HydrophobicContact CB-CE1 3.87Å; R117-F296 HydrophobicContact CB-CZ 4.23Å; L118-F296 HydrophobicContact CD2-CE1 4.46Å; L118-F296 HydrophobicContact CG-CE1 4.24Å; R158-F296 HydrophobicContact CB-CE2 4.2Å; D294-F296 PolarHBondContact O-N 2.9Å; F296-W298 HydrophobicContact CB-CD2 3.86Å; F296-W298 VanDerWaalsContact CB-CE2 3.4Å; F296-W298 HydrophobicContact CB-CE3 4.21Å; F296-W298 HydrophobicContact CB-CH2 3.76Å; F296-W298 HydrophobicContact CB-CZ2 3.36Å; F296-W298 HydrophobicContact CB-CZ3 4.17Å; F296-W298 AromaticContact CD1-CH2 3.67Å; F296-W298 HydrophobicContact CD1-CH2 3.67Å; F296-W298 AromaticContact CD1-CZ2 3.81Å; F296-W298 HydrophobicContact CD1-CZ2 3.81Å; F296-W298 HydrophobicContact CD1-CZ3 4.45Å; F296-W298 HydrophobicContact CD2-CH2 4.44Å; F296-W298 AromaticContact CD2-CZ2 3.75Å; F296-W298 HydrophobicContact CD2-CZ2 3.75Å; F296-W298 HydrophobicContact CE1-CH2 4.32Å; F296-W298 HydrophobicContact CE1-CZ2 4.48Å; F296-W298 HydrophobicContact CE2-CZ2 4.44Å; F296-W298 AromaticContact CG-CE2 3.94Å; F296-W298 AromaticContact CG-CH2 3.73Å; F296-W298 HydrophobicContact CG-CH2 3.73Å; F296-W298 AromaticContact CG-CZ2 3.37Å; F296-W298 HydrophobicContact CG-CZ2 3.37Å; F296-W298 PolarHBondContact O-N 2.83Å; F296-E299 HydrophobicContact CB-CG 4.1Å; F296-E299 PolarHBondContact N-OE2 3.39Å; F296-E299 WeakPolarHBondContact O-CB 3.4Å; F296-E299 PolarHBondContact O-N 3.34Å
297	D	97	Very high	78.8	Confident	30 Å²	30	93.8 Å²	93.8	16%	0.16	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.8	-170.9	-53.2	-20	0	0	0	114.2	F110 T111 T114	F110-D297 WeakPolarHBondContact CA-OD2 3.47Å; F110-D297 VanDerWaalsContact CB-OD2 3.26Å; F110-D297 WeakPolarHBondContact CB-OD2 3.32Å; F110-D297 HydrophobicContact CD1-CB 4.39Å; F110-D297 WeakPolarHBondContact CD1-OD2 3.39Å; T111-D297 WeakPolarHBondContact CB-OD1 3.5Å; T111-D297 WeakPolarHBondContact CG2-OD1 3.49Å; T111-D297 PolarHBondContact N-OD2 3.04Å; T111-D297 PolarHBondContact OG1-OD1 3.21Å; T114-D297 WeakPolarHBondContact CB-OD1 3.5Å; T114-D297 WeakPolarHBondContact CB-OD2 3.4Å; T114-D297 PolarHBondContact OG1-N 3.37Å; T114-D297 VanDerWaalsContact OG1-N 3.09Å; T114-D297 PolarHBondContact OG1-OD1 3.42Å; T114-D297 PolarHBondContact OG1-OD2 2.78Å
298	W	95	Very high	75.8	Confident	66 Å²	66	94.8 Å²	94.8	25%	0.25	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-6.1	175.1	58.1	78.7	0	0	0	113.7	L101 F110 T114 L118 L146 F296	L101-W298 HydrophobicContact CB-CE3 4.15Å; L101-W298 HydrophobicContact CD1-CD2 4.43Å; L101-W298 HydrophobicContact CD1-CE3 4.44Å; L101-W298 HydrophobicContact CD2-CB 4.11Å; L101-W298 HydrophobicContact CD2-CD2 4.05Å; L101-W298 HydrophobicContact CD2-CE3 4.35Å; L101-W298 HydrophobicContact CD2-CG 3.93Å; F110-W298 HydrophobicContact CD1-CZ3 4.31Å; F110-W298 AromaticContact CE1-CE3 3.83Å; F110-W298 HydrophobicContact CE1-CE3 3.83Å; F110-W298 AromaticContact CE1-CZ3 3.68Å; F110-W298 HydrophobicContact CE1-CZ3 3.68Å; F110-W298 HydrophobicContact CZ-CE3 4.33Å; F110-W298 AromaticContact CZ-CZ3 3.86Å; F110-W298 HydrophobicContact CZ-CZ3 3.86Å; T114-W298 HydrophobicContact CG2-CH2 4.07Å; T114-W298 HydrophobicContact CG2-CZ3 3.66Å; L118-W298 HydrophobicContact CD1-CH2 4.07Å; L118-W298 HydrophobicContact CD1-CZ3 4.27Å; L118-W298 HydrophobicContact CD2-CH2 4.16Å; L118-W298 HydrophobicContact CG-CH2 4.38Å; L146-W298 HydrophobicContact CD1-CZ2 3.84Å; L146-W298 HydrophobicContact CD2-CH2 4.49Å; L146-W298 HydrophobicContact CD2-CZ2 3.83Å; L146-W298 HydrophobicContact CG-CZ2 4.39Å; F296-W298 HydrophobicContact CB-CD2 3.86Å; F296-W298 VanDerWaalsContact CB-CE2 3.4Å; F296-W298 HydrophobicContact CB-CE3 4.21Å; F296-W298 HydrophobicContact CB-CH2 3.76Å; F296-W298 HydrophobicContact CB-CZ2 3.36Å; F296-W298 HydrophobicContact CB-CZ3 4.17Å; F296-W298 AromaticContact CD1-CH2 3.67Å; F296-W298 HydrophobicContact CD1-CH2 3.67Å; F296-W298 AromaticContact CD1-CZ2 3.81Å; F296-W298 HydrophobicContact CD1-CZ2 3.81Å; F296-W298 HydrophobicContact CD1-CZ3 4.45Å; F296-W298 HydrophobicContact CD2-CH2 4.44Å; F296-W298 AromaticContact CD2-CZ2 3.75Å; F296-W298 HydrophobicContact CD2-CZ2 3.75Å; F296-W298 HydrophobicContact CE1-CH2 4.32Å; F296-W298 HydrophobicContact CE1-CZ2 4.48Å; F296-W298 HydrophobicContact CE2-CZ2 4.44Å; F296-W298 AromaticContact CG-CE2 3.94Å; F296-W298 AromaticContact CG-CH2 3.73Å; F296-W298 HydrophobicContact CG-CH2 3.73Å; F296-W298 AromaticContact CG-CZ2 3.37Å; F296-W298 HydrophobicContact CG-CZ2 3.37Å; F296-W298 PolarHBondContact O-N 2.83Å
299	E	95	Very high	72.6	Confident	66 Å²	66	91.4 Å²	91.4	31%	0.308	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-7.3	173.9	-59.8	176.2	153.6	0	0	111.6	R158 P295 F296 T301	R158-E299 WeakPolarHBondContact CG-OE1 3.37Å; R158-E299 IonicContact CZ-OE1 2.72Å; R158-E299 IonicContact CZ-OE2 2.66Å; R158-E299 IonicContact NE-OE1 3.64Å; R158-E299 PolarHBondContact NE-OE1 2.82Å; R158-E299 IonicContact NE-OE2 3.82Å; R158-E299 PolarHBondContact NE-OE2 3.02Å; R158-E299 IonicContact NH2-OE1 4Å; R158-E299 IonicContact NH2-OE2 3.75Å; R158-E299 PolarHBondContact NH2-OE2 2.7Å; P295-E299 VanDerWaalsContact CA-OE2 3.29Å; P295-E299 WeakPolarHBondContact CA-OE2 3.3Å; P295-E299 HydrophobicContact CB-CB 4.14Å; F296-E299 HydrophobicContact CB-CG 4.1Å; F296-E299 PolarHBondContact N-OE2 3.39Å; F296-E299 WeakPolarHBondContact O-CB 3.4Å; F296-E299 PolarHBondContact O-N 3.34Å; E299-T301 PolarHBondContact O-N 2.99Å
300	I	89.5	Confident	69.4	Low	94 Å²	94	85.1 Å²	85.1	48%	0.482	52%	0.522	S	S	.	.			trans	-84.8	89.6	-177.6	-54.2	174.1	0	0	0	110.2	P295	P295-I300 HydrophobicContact CB-CG1 4.15Å; P295-I300 HydrophobicContact CG-CG1 4.35Å
301	T	68.9	Low	66.2	Low	97 Å²	97	90.9 Å²	90.9	60%	0.595	55%	0.553	S	S	*	*			trans	-67.4	135.6	168.5	-54	0	0	0	0	110.7	E299 E303 S304	E299-T301 PolarHBondContact O-N 2.99Å; T301-E303 HydrophobicContact CG2-CB 4.46Å; T301-E303 HydrophobicContact CG2-CG 4.21Å; T301-E303 PolarHBondContact O-N 2.94Å; T301-S304 PolarHBondContact O-OG 3.43Å
302	T	58.5	Low	63.3	Low	139 Å²	139	96.7 Å²	96.7	85%	0.853	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	10	-171.2	40.1	0	0	0	0	116
303	E	47.2	Very low	60.4	Low	170 Å²	170	97.5 Å²	97.5	79%	0.794	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-1.1	-175.6	-64	-177.4	173.6	0	0	113.6	T301 T305	T301-E303 HydrophobicContact CG2-CB 4.46Å; T301-E303 HydrophobicContact CG2-CG 4.21Å; T301-E303 PolarHBondContact O-N 2.94Å; E303-T305 PolarHBondContact O-N 3.22Å
304	S	39.3	Very low	57.4	Low	90 Å²	90	101.2 Å²	101.2	63%	0.629	60%	0.601	S	S	*	*	S	Bend	trans	-75	69.5	174	45.2	0	0	0	0	113.1	T301	T301-S304 PolarHBondContact O-OG 3.43Å
305	T	27.9	Very low	54.7	Low	102 Å²	102	105.4 Å²	105.4	63%	0.626	62%	0.619	S	S	*	*			trans	57.2	97.3	151.3	54.3	0	0	0	0	119.2	E303 V307	E303-T305 PolarHBondContact O-N 3.22Å; T305-V307 HydrophobicContact CG2-CG2 3.78Å; T305-V307 PolarHBondContact O-N 2.79Å
306	P	29.1	Very low	51.8	Low	137 Å²	137	108.9 Å²	108.9	89%	0.89	63%	0.629	S	S	*	*			trans	-82.1	68.2	150	35.4	-32.5	0	0	0	110.1
307	V	40.2	Very low	49	Very low	109 Å²	109	117.2 Å²	117.2	66%	0.661	67%	0.667	S	S	*	*			trans	-96.5	140.2	-178.3	172.6	0	0	0	0	110.8	T305	T305-V307 HydrophobicContact CG2-CG2 3.78Å; T305-V307 PolarHBondContact O-N 2.79Å
308	S	33.2	Very low	45.8	Very low	124 Å²	124	121 Å²	121	87%	0.867	69%	0.692	S	S	*	*	S	Bend	trans	66.4	76.6	-176.6	-57.2	0	0	0	0	115
309	G	29.3	Very low	42.8	Very low	80 Å²	80	123 Å²	123	83%	0.825	71%	0.711	S	S	*	*	S	Bend	trans	-162.1	-14.4	176.2	0	0	0	0	0	118.3
310	A	30.8	Very low	40.1	Very low	90 Å²	90	127.7 Å²	127.7	74%	0.744	73%	0.733	S	S	*	*	S	Bend	trans	-155.9	159.9	175.4	0	0	0	0	0	111.7
311	N	31.8	Very low	37.2	Very low	142 Å²	142	129.2 Å²	129.2	76%	0.759	75%	0.747	S	S	*	*			trans	81.9	56.7	173.7	-56.8	-11.4	0	0	0	118.4	T313	N311-T313 HydrophobicContact CB-CG2 4.25Å
312	E	34.8	Very low	35.6	Very low	205 Å²	205	129.7 Å²	129.7	96%	0.958	75%	0.752	S	S	*	*				-80.4	125.7	129.4	-73.7	-169	145.8	0	0	107.7
313	T	35.2	Very low	34.2	Very low	99 Å²	99	130.4 Å²	130.4	61%	0.607	75%	0.749	S	S	*	*			trans	-119.9	123.2	-175.7	51.3	0	0	0	0	110.2	N311	N311-T313 HydrophobicContact CB-CG2 4.25Å
314	N	32.5	Very low	33.7	Very low	173 Å²	173	128 Å²	128	93%	0.925	75%	0.746	S	S	*	*			trans	-79.1	129.4	178.7	-88.6	-45.7	0	0	0	111.1
315	Q	40	Very low	33.4	Very low	127 Å²	127	129 Å²	129	59%	0.593	75%	0.748	S	S	*	*			trans	-114.3	137	168.7	-57.3	-171.8	26.5	0	0	109.1	R376	Q315-R376 VanDerWaalsContact CD-NH1 3.31Å; Q315-R376 VanDerWaalsContact OE1-CZ 3.23Å
316	H	35.6	Very low	33.9	Very low	143 Å²	143	132.1 Å²	132.1	66%	0.662	76%	0.755	S	S	*	*			trans	-75.1	140.3	177.7	-63.7	-89.1	0	0	0	112.1	S380	H316-S380 PolarHBondContact NE2-O 2.9Å
317	H	38.1	Very low	34	Very low	178 Å²	178	134.2 Å²	134.2	82%	0.824	75%	0.753	S	S	*	*				-166.9	159.1	117.6	-107.8	69.1	0	0	0	115.1
318	T	29.2	Very low	33.8	Very low	111 Å²	111	134 Å²	134	68%	0.681	76%	0.763	S	S	*	*			trans	-42.5	151.6	165.5	-19.4	0	0	0	0	112.4
319	T	33.6	Very low	33.9	Very low	106 Å²	106	132.3 Å²	132.3	65%	0.65	76%	0.756	S	S	*	*				-173.5	161.1	55	-40.9	0	0	0	0	112.8
320	Q	37.9	Very low	34.2	Very low	166 Å²	166	137.2 Å²	137.2	78%	0.776	76%	0.758	S	S	*	*			trans	68.8	101.4	156.3	-84.7	144.6	26.6	0	0	121.6
321	T	28.7	Very low	34.4	Very low	126 Å²	126	138.7 Å²	138.7	77%	0.773	76%	0.758	S	S	*	*				25.3	149.3	120.3	51.9	0	0	0	0	121.8
322	P	35.3	Very low	34.3	Very low	106 Å²	106	138 Å²	138	69%	0.688	76%	0.759	S	S	*	*			cis	-147.1	170.9	34.2	42.7	-23.8	0	0	0	119.2
323	I	27.7	Very low	34.5	Very low	154 Å²	154	135.3 Å²	135.3	79%	0.79	76%	0.756	S	S	*	*			trans	56.3	126.4	145.3	-69.2	162.6	0	0	0	117.6
324	V	38.4	Very low	34.6	Very low	121 Å²	121	135.7 Å²	135.7	73%	0.733	77%	0.769	S	S	*	*			cis	-144.5	135	49.4	-168.8	0	0	0	0	112.7
325	T	31.8	Very low	34.7	Very low	109 Å²	109	130.8 Å²	130.8	67%	0.669	76%	0.759	S	S	*	*			trans	2.8	149.3	130.5	-9	0	0	0	0	118.5
326	Q	37.9	Very low	34.7	Very low	169 Å²	169	129.5 Å²	129.5	79%	0.79	77%	0.771	S	S	*	*			cis	-139	159.1	19.3	-66.5	164.9	-17.7	0	0	108.5
327	Q	32.4	Very low	34.8	Very low	180 Å²	180	132.2 Å²	132.2	84%	0.841	78%	0.783	S	S	*	*				56.5	137.6	56.2	-59.4	-174	7.8	0	0	113.3
328	A	35.8	Very low	34.7	Very low	104 Å²	104	126.6 Å²	126.6	86%	0.86	77%	0.774	S	S	*	*			cis	-146.9	-166.4	8.6	0	0	0	0	0	113.6
329	A	34.2	Very low	35.2	Very low	89 Å²	89	127.4 Å²	127.4	74%	0.736	78%	0.779	S	S	*	*			trans	-85.4	-164.4	-167.4	0	0	0	0	0	117.4
330	Q	36.9	Very low	35.3	Very low	183 Å²	183	129.7 Å²	129.7	86%	0.855	79%	0.786	S	S	*	*			trans	91.5	145.8	169.6	-54.4	-168.1	109.1	0	0	116
331	V	35.7	Very low	35.1	Very low	122 Å²	122	128.6 Å²	128.6	74%	0.739	79%	0.786	S	S	*	*			cis	-150.3	172.3	-2.4	102.3	0	0	0	0	113
332	T	29.4	Very low	35.5	Very low	127 Å²	127	127.9 Å²	127.9	78%	0.779	78%	0.781	S	S	*	*			trans	-76.6	150.9	177.2	47	0	0	0	0	116.8
333	V	38	Very low	35.5	Very low	149 Å²	149	126.9 Å²	126.9	90%	0.903	78%	0.776	S	S	*	*			trans	-138.9	157.7	160.2	-172.8	0	0	0	0	107.8
334	A	36.8	Very low	35.9	Very low	107 Å²	107	127.8 Å²	127.8	88%	0.884	78%	0.775	S	S	*	*			trans	-128.9	161.3	-166.5	0	0	0	0	0	116.7
335	G	36.2	Very low	35.7	Very low	70 Å²	70	128.4 Å²	128.4	72%	0.722	77%	0.773	S	S	*	*			trans	151.2	95.5	178.7	0	0	0	0	0	110.1
336	A	38.4	Very low	35.7	Very low	100 Å²	100	133.1 Å²	133.1	83%	0.826	78%	0.779	S	S	*	*				69.6	119.6	77	0	0	0	0	0	113.3
337	Q	38.7	Very low	35.6	Very low	199 Å²	199	133.8 Å²	133.8	93%	0.93	78%	0.779	S	S	*	*			cis	-152.1	177.3	-1.2	-101	-160.9	86.8	0	0	109.8
338	G	36.8	Very low	35.7	Very low	61 Å²	61	128.3 Å²	128.3	63%	0.629	77%	0.771	S	S	*	*			cis	-175.4	-111.6	8.8	0	0	0	0	0	115.1
339	T	38.4	Very low	36	Very low	128 Å²	128	130.7 Å²	130.7	79%	0.785	77%	0.768	S	S	*	*			trans	-43.8	132.5	-173.4	49.7	0	0	0	0	116.7
340	L	35.2	Very low	36.4	Very low	154 Å²	154	132.1 Å²	132.1	81%	0.806	77%	0.769	S	S	*	*			cis	74.9	145.1	45.8	-57.3	169.4	0	0	0	113.5
341	D	35.3	Very low	36.5	Very low	143 Å²	143	128.7 Å²	128.7	77%	0.765	77%	0.765	S	S	*	*			cis	-144	171.8	15.8	-162.6	18.4	0	0	0	115.4
342	V	35.4	Very low	36.5	Very low	110 Å²	110	126.1 Å²	126.1	67%	0.667	76%	0.764	S	S	*	*			trans	-106.1	143.5	-177.4	171.8	0	0	0	0	111.5
343	S	35.6	Very low	36.8	Very low	85 Å²	85	126.6 Å²	126.6	59%	0.594	77%	0.766	S	S	*	*			trans	-172	136	150.9	-90.6	0	0	0	0	113.1
344	K	36.8	Very low	36.6	Very low	173 Å²	173	125.4 Å²	125.4	75%	0.752	76%	0.755	S	S	*	*				70.8	146.4	75.1	-60.3	171	-157.2	143.7	0	112.8
345	L	34	Very low	36.5	Very low	134 Å²	134	127 Å²	127	70%	0.702	74%	0.744	S	S	*	*			cis	-161	168.9	1.4	-144.4	69.5	0	0	0	112.1
346	R	32	Very low	36.4	Very low	208 Å²	208	128.9 Å²	128.9	79%	0.785	74%	0.737	S	S	*	*			trans	10.6	150.3	142.9	-76.6	171.7	160.8	176.1	-6.3	120
347	K	35.8	Very low	36	Very low	184 Å²	184	134.1 Å²	134.1	80%	0.8	74%	0.736	S	S	*	*			cis	177.5	162.1	47.7	-136.6	168.4	179.9	-170.2	0	111.9
348	G	34.4	Very low	36.1	Very low	65 Å²	65	129 Å²	129	67%	0.67	72%	0.719	S	S	*	*			trans	110.2	120.8	167	0	0	0	0	0	114.4
349	I	43	Very low	35.8	Very low	154 Å²	154	133 Å²	133	79%	0.79	73%	0.727	S	S	*	*			cis	87	129.1	26.1	-54	165.7	0	0	0	112.9
350	P	42	Very low	35.5	Very low	118 Å²	118	133 Å²	133	77%	0.766	73%	0.726	S	S	*	*			cis	-98.8	-152	-8.1	29.1	-9.6	0	0	0	111.1
351	S	38.5	Very low	35.3	Very low	111 Å²	111	129 Å²	129	78%	0.776	72%	0.722	S	S	*	*			cis	-141.9	-167.5	5.9	-57.9	0	0	0	0	108.8
352	G	35.1	Very low	35.3	Very low	69 Å²	69	127.4 Å²	127.4	71%	0.711	73%	0.729	S	S	*	*			cis	104.8	126.2	6.8	0	0	0	0	0	112.4
353	V	37.2	Very low	35	Very low	136 Å²	136	125.9 Å²	125.9	82%	0.824	74%	0.736	S	S	*	*			cis	-148.5	119.4	3	163.5	0	0	0	0	106.2
354	D	32.1	Very low	34.8	Very low	124 Å²	124	125.1 Å²	125.1	66%	0.663	74%	0.741	S	S	*	*				88.8	133.3	75.3	-122.3	-31	0	0	0	115
355	Q	35.5	Very low	34.5	Very low	142 Å²	142	123.6 Å²	123.6	66%	0.664	75%	0.747	S	S	*	*			trans	66.6	160.6	148.6	-76.3	165.4	63.6	0	0	120.9
356	N	34.1	Very low	34.5	Very low	108 Å²	108	121.1 Å²	121.1	58%	0.578	75%	0.745	S	S	*	*			cis	-148	146	-3.1	-114.3	-32.2	0	0	0	108.9
357	R	30.9	Very low	34.6	Very low	211 Å²	211	112.4 Å²	112.4	80%	0.796	72%	0.72	S	S	*	*				54.6	156.6	90	-73.6	-168.3	98.9	-156.3	9.7	116.4
358	P	40.3	Very low	34.5	Very low	90 Å²	90	108.6 Å²	108.6	58%	0.584	71%	0.712	S	S	*	*			cis	-150.4	-176.7	-37.6	43.7	-26.7	0	0	0	115
359	N	31.1	Very low	34.5	Very low	146 Å²	146	107.1 Å²	107.1	78%	0.781	69%	0.692	S	S	*	*			trans	58.1	171.9	141	-113.2	13.1	0	0	0	119.7
360	V	31.7	Very low	33.9	Very low	127 Å²	127	102.8 Å²	102.8	77%	0.77	69%	0.685	S	S	*	*			cis	-140.9	144	6.8	-172.4	0	0	0	0	110.3
361	G	31.5	Very low	33.5	Very low	71 Å²	71	107.2 Å²	107.2	73%	0.732	69%	0.688	S	S	*	*			trans	71.6	170.6	150.8	0	0	0	0	0	117.6
362	A	34.5	Very low	33.2	Very low	109 Å²	109	109.2 Å²	109.2	90%	0.901	69%	0.688	S	S	*	*			cis	-157.3	161.7	-15.9	0	0	0	0	0	107.4
363	G	29.8	Very low	33.1	Very low	79 Å²	79	111.7 Å²	111.7	81%	0.814	70%	0.695	S	S	*	*			cis	145.8	104.1	-1	0	0	0	0	0	111.1
364	G	30.4	Very low	32.9	Very low	68 Å²	68	109 Å²	109	70%	0.701	69%	0.694	S	S	*	*			trans	107.5	153.1	177.2	0	0	0	0	0	114.8
365	T	31.8	Very low	32.8	Very low	142 Å²	142	109.3 Å²	109.3	87%	0.871	70%	0.701	S	S	*	*			cis	-161.4	138	-5.3	7	0	0	0	0	112
366	A	33.1	Very low	32.6	Very low	82 Å²	82	111.3 Å²	111.3	68%	0.678	70%	0.702	S	S	*	*			trans	50.5	138	151.7	0	0	0	0	0	121.6	Q988	A366-Q988 PolarHBondContact O-NE2 2.95Å
367	G	33.8	Very low	32.5	Very low	24 Å²	24	113.4 Å²	113.4	25%	0.247	71%	0.713	C	S	.	*			cis	130.9	156.6	-14.9	0	0	0	0	0	115.8	S987 Q988	G367-S987 PolarHBondContact O-OG 3.18Å; G367-Q988 VanDerWaalsContact N-OE1 3.13Å
368	T	33.3	Very low	32.6	Very low	105 Å²	105	107.9 Å²	107.9	64%	0.644	71%	0.712	S	S	*	*			trans	67.9	152.1	179.1	77	0	0	0	0	113.7	L986 S987	T368-L986 CarbonylContact C-O 3.54Å; T368-L986 CarbonylContact O-C 3.19Å; T368-L986 WeakPolarHBondContact O-CB 3.2Å; T368-L986 VanDerWaalsContact O-O 3.05Å; T368-S987 WeakPolarHBondContact O-CA 3.39Å; T368-S987 WeakPolarHBondContact O-CB 3.4Å; T368-S987 PolarHBondContact O-N 2.94Å; T368-S987 PolarHBondContact O-OG 3.3Å
369	S	34.8	Very low	32.3	Very low	33 Å²	33	106.2 Å²	106.2	23%	0.231	71%	0.712	C	S	.	*			cis	-158.9	125.8	11	159.9	0	0	0	0	107.2	Y371 L986	S369-Y371 WeakPolarHBondContact OG-CE2 3.38Å; S369-L986 CarbonylContact C-O 3.49Å; S369-L986 PolarHBondContact N-O 3.49Å
370	G	31.4	Very low	32.2	Very low	63 Å²	63	103.9 Å²	103.9	65%	0.649	71%	0.706	S	S	*	*				82.4	150.7	82.1	0	0	0	0	0	111.3
371	Y	32.2	Very low	32.4	Very low	211 Å²	211	102.7 Å²	102.7	83%	0.827	70%	0.704	S	S	*	*			cis	-145.3	-165.7	6	-72.3	-89.7	0	0	0	106.9	S369	S369-Y371 WeakPolarHBondContact OG-CE2 3.38Å
372	I	32.5	Very low	32.7	Very low	154 Å²	154	103.8 Å²	103.8	79%	0.79	70%	0.7	S	S	*	*			cis	-156.5	162.6	33.3	-63.5	173.5	0	0	0	108.6
373	S	32.9	Very low	32.7	Very low	121 Å²	121	105.1 Å²	105.1	85%	0.846	69%	0.692	S	S	*	*			trans	76.8	130.8	173	-63.9	0	0	0	0	116.7
374	G	33.8	Very low	33	Very low	78 Å²	78	106.8 Å²	106.8	80%	0.804	68%	0.682	S	S	*	*			cis	-167.4	131.6	-6.7	0	0	0	0	0	112.8
375	T	30.1	Very low	33.1	Very low	132 Å²	132	107 Å²	107	81%	0.81	68%	0.677	S	S	*	*			trans	-95.7	134.2	-175.2	42.7	0	0	0	0	113.1
376	R	31.5	Very low	33.2	Very low	183 Å²	183	108.2 Å²	108.2	69%	0.691	67%	0.67	S	S	*	*			trans	-139.5	132.6	149.4	-64.5	-169.1	-177.8	-165.1	8	107.6	Q315	Q315-R376 VanDerWaalsContact CD-NH1 3.31Å; Q315-R376 VanDerWaalsContact OE1-CZ 3.23Å
377	L	32.2	Very low	33.3	Very low	152 Å²	152	107.5 Å²	107.5	80%	0.796	67%	0.665	S	S	*	*			cis	79	113.1	38.9	-66	172.7	0	0	0	115.3
378	A	33.2	Very low	33.1	Very low	96 Å²	96	109.2 Å²	109.2	79%	0.793	68%	0.682	S	S	*	*			trans	66.4	156.4	144.8	0	0	0	0	0	120.8
379	G	32.1	Very low	33.5	Very low	55 Å²	55	110.1 Å²	110.1	57%	0.567	69%	0.69	S	S	*	*			trans	89.2	129.9	177.2	0	0	0	0	0	113
380	S	30.7	Very low	33.4	Very low	96 Å²	96	115.1 Å²	115.1	67%	0.671	72%	0.719	S	S	*	*			cis	56.8	113.9	20.4	-52.9	0	0	0	0	113.6	H316	H316-S380 PolarHBondContact NE2-O 2.9Å
381	S	34.3	Very low	33.4	Very low	103 Å²	103	115.9 Å²	115.9	72%	0.72	72%	0.719	S	S	*	*			cis	-156.1	179.7	0.5	-65.5	0	0	0	0	107.7
382	S	37.6	Very low	33.3	Very low	94 Å²	94	111.5 Å²	111.5	66%	0.657	71%	0.714	S	S	*	*			cis	-161.2	164.9	19	-32	0	0	0	0	111.9
383	N	36.4	Very low	33.2	Very low	136 Å²	136	110 Å²	110	73%	0.727	71%	0.712	S	S	*	*			trans	60.5	132.5	142.3	-61.1	-7.6	0	0	0	121.1
384	L	36	Very low	33.1	Very low	115 Å²	115	108.7 Å²	108.7	60%	0.602	70%	0.704	S	S	*	*			cis	-142.9	133.3	-13.7	-93.8	162.9	0	0	0	105.7	Q788	L384-Q788 PolarHBondContact O-OE1 3.48Å
385	A	32.6	Very low	33	Very low	72 Å²	72	113.4 Å²	113.4	60%	0.595	71%	0.707	S	S	*	*				61.6	145.8	93.2	0	0	0	0	0	115.1
386	F	32	Very low	33	Very low	167 Å²	167	110.3 Å²	110.3	73%	0.732	70%	0.695	S	S	*	*			cis	-148.5	169.4	18.2	-172.9	-112.4	0	0	0	112.9	F790	F386-F790 WeakPolarHBondContact O-CE1 3.46Å; F386-F790 WeakPolarHBondContact O-CZ 3.45Å
387	A	35.4	Very low	33	Very low	68 Å²	68	109.1 Å²	109.1	56%	0.562	70%	0.702	S	S	*	*			trans	-39.9	168.6	177.8	0	0	0	0	0	117.9
388	G	31.2	Very low	33	Very low	59 Å²	59	107.8 Å²	107.8	61%	0.608	70%	0.7	S	S	*	*			cis	162.8	-172.5	4.2	0	0	0	0	0	111.9
389	P	40.7	Very low	32.9	Very low	125 Å²	125	106.7 Å²	106.7	81%	0.812	70%	0.697	S	S	*	*			trans	-101.3	-151.2	-172.7	40.4	-34.2	0	0	0	112.9
390	V	32.2	Very low	33.1	Very low	137 Å²	137	113 Å²	113	83%	0.83	71%	0.709	S	S	*	*			trans	77.4	146.1	178.3	-164.7	0	0	0	0	114.5
391	A	30.9	Very low	33.2	Very low	79 Å²	79	112.9 Å²	112.9	65%	0.653	71%	0.708	S	S	*	*				-178.1	179.6	-53.8	0	0	0	0	0	108.6
392	T	30.1	Very low	33.2	Very low	120 Å²	120	116.7 Å²	116.7	74%	0.736	71%	0.712	S	S	*	*			trans	78.9	152	154	-20.1	0	0	0	0	119.4
393	T	31.8	Very low	33	Very low	121 Å²	121	118.4 Å²	118.4	74%	0.742	71%	0.714	S	S	*	*			trans	58.5	110.7	167.1	38.3	0	0	0	0	117
394	S	29.9	Very low	32.8	Very low	95 Å²	95	115.4 Å²	115.4	66%	0.664	71%	0.708	S	S	*	*			cis	87.5	164.5	34.7	90.4	0	0	0	0	115.4
395	M	31.1	Very low	32.7	Very low	177 Å²	177	117.2 Å²	117.2	87%	0.872	72%	0.717	S	S	*	*			trans	74.9	147.6	-177.2	-54.9	-75.8	-178	0	0	116.3
396	A	31.4	Very low	32.9	Very low	67 Å²	67	119 Å²	119	55%	0.554	72%	0.723	S	S	*	*			cis	-170.4	148.3	-25.3	0	0	0	0	0	111.3
397	N	30.8	Very low	32.8	Very low	158 Å²	158	116.4 Å²	116.4	85%	0.845	72%	0.724	S	S	*	*			trans	60.5	170.3	152.7	-56.8	-16.6	0	0	0	117
398	V	32.9	Very low	32.6	Very low	124 Å²	124	122.1 Å²	122.1	75%	0.752	74%	0.739	S	S	*	*			cis	-126	123.3	3.7	175.1	0	0	0	0	106.8	K400	V398-K400 HydrophobicContact CG1-CG 4.49Å
399	G	31.5	Very low	32.6	Very low	72 Å²	72	123 Å²	123	74%	0.742	75%	0.747	S	S	*	*				96.7	159.1	86.1	0	0	0	0	0	110.6
400	K	35.2	Very low	32	Very low	188 Å²	188	120.3 Å²	120.3	82%	0.817	74%	0.743	S	S	*	*			cis	-151	168.8	3.2	-55.6	175.2	179.1	178	0	108.6	V398	V398-K400 HydrophobicContact CG1-CG 4.49Å
401	S	33.5	Very low	31.8	Very low	93 Å²	93	119 Å²	119	65%	0.65	74%	0.74	S	S	*	*			trans	69.1	138.6	145.4	-165.9	0	0	0	0	117.3
402	F	33.3	Very low	31.7	Very low	184 Å²	184	123.5 Å²	123.5	81%	0.807	75%	0.752	S	S	*	*			cis	-163.2	156.7	-10.4	-103.3	171.3	0	0	0	106.4
403	D	33.4	Very low	31.7	Very low	129 Å²	129	120.8 Å²	120.8	69%	0.69	75%	0.748	S	S	*	*			cis	-169.3	177.9	-34.8	-143.3	-41.3	0	0	0	108.4
404	A	32.8	Very low	31.6	Very low	74 Å²	74	121 Å²	121	61%	0.612	76%	0.755	S	S	*	*			trans	65.4	145.9	140.1	0	0	0	0	0	121.2
405	I	34.1	Very low	31.7	Very low	153 Å²	153	120.8 Å²	120.8	79%	0.785	76%	0.759	S	S	*	*			cis	-152.8	151.6	-14.1	-117.2	163.8	0	0	0	108.7
406	P	35.8	Very low	31.6	Very low	109 Å²	109	119.3 Å²	119.3	71%	0.708	75%	0.754	S	S	*	*			trans	-101.9	161.5	179.1	38.9	-34.2	0	0	0	114.8
407	C	31	Very low	31.6	Very low	112 Å²	112	122.7 Å²	122.7	76%	0.757	76%	0.762	S	S	*	*			trans	-140	139.1	163.4	-80.4	0	0	0	0	108.3
408	H	30.7	Very low	31.8	Very low	189 Å²	189	120.5 Å²	120.5	88%	0.875	76%	0.76	S	S	*	*				62.9	132.8	63.1	-64.4	-67	0	0	0	113
409	G	31.4	Very low	31.8	Very low	77 Å²	77	126.3 Å²	126.3	79%	0.794	77%	0.768	S	S	*	*			cis	-127.1	-165.4	-2.4	0	0	0	0	0	112.2
410	G	28.1	Very low	31.9	Very low	69 Å²	69	128.4 Å²	128.4	71%	0.711	77%	0.772	S	S	*	*			cis	92.5	78.8	36.6	0	0	0	0	0	109.3
411	S	28.7	Very low	31.7	Very low	110 Å²	110	122.2 Å²	122.2	77%	0.769	76%	0.761	S	S	*	*				87	148.6	93.4	-66.4	0	0	0	0	114.1
412	N	28.6	Very low	31.5	Very low	172 Å²	172	124.5 Å²	124.5	92%	0.92	77%	0.771	S	S	*	*			trans	75.5	138.7	-178.2	-42.4	-38.8	0	0	0	114.5
413	G	30.3	Very low	31.3	Very low	63 Å²	63	122 Å²	122	65%	0.649	77%	0.77	S	S	*	*			cis	171.4	173.1	-6.6	0	0	0	0	0	112.1
414	S	30	Very low	31.1	Very low	125 Å²	125	119.9 Å²	119.9	87%	0.874	77%	0.766	S	S	*	*			trans	42.8	114.7	162.8	57.3	0	0	0	0	118
415	A	30.4	Very low	31.1	Very low	91 Å²	91	123.8 Å²	123.8	75%	0.752	77%	0.771	S	S	*	*				162.9	167.6	77.9	0	0	0	0	0	107.5
416	L	30.8	Very low	30.9	Very low	146 Å²	146	124.8 Å²	124.8	76%	0.764	77%	0.772	S	S	*	*			cis	-159.8	152.5	0.3	-124.2	162.4	0	0	0	107.6
417	N	31.4	Very low	30.6	Very low	138 Å²	138	130.4 Å²	130.4	74%	0.738	78%	0.779	S	S	*	*			trans	37.5	126.7	161.4	-65.3	-16.3	0	0	0	120.3
418	S	34	Very low	30.5	Very low	113 Å²	113	132 Å²	132	79%	0.79	78%	0.78	S	S	*	*				-161.3	134.6	59.4	-65.4	0	0	0	0	115.8
419	R	32.5	Very low	30.5	Very low	245 Å²	245	128.8 Å²	128.8	93%	0.925	77%	0.774	S	S	*	*			trans	6.7	150.7	141.2	-73.1	179.6	171.2	175.7	-3.7	120.4
420	S	33.1	Very low	30.5	Very low	117 Å²	117	130.8 Å²	130.8	82%	0.818	77%	0.77	S	S	*	*			cis	-179.1	159.3	-5.3	176.6	0	0	0	0	111.3
421	G	31.8	Very low	30.7	Very low	58 Å²	58	133.6 Å²	133.6	60%	0.598	77%	0.769	S	S	*	*			trans	80.9	117.3	163.9	0	0	0	0	0	114.9
422	V	28.8	Very low	30.8	Very low	141 Å²	141	136.9 Å²	136.9	86%	0.855	77%	0.772	S	S	*	*			cis	76.9	140.2	17	-157.4	0	0	0	0	115.6
423	V	30.6	Very low	30.9	Very low	130 Å²	130	134.8 Å²	134.8	79%	0.788	76%	0.76	S	S	*	*			trans	102.2	142.9	166.4	-169.3	0	0	0	0	116.7
424	S	28.6	Very low	31.1	Very low	86 Å²	86	139.3 Å²	139.3	60%	0.601	77%	0.768	S	S	*	*			trans	-96.7	-172.7	-173.7	41.7	0	0	0	0	113.9
425	H	32.4	Very low	31.1	Very low	156 Å²	156	137.9 Å²	137.9	72%	0.722	76%	0.758	S	S	*	*			trans	109.3	115.2	155.9	-58.1	-67.8	0	0	0	118.7
426	H	29.4	Very low	31.1	Very low	173 Å²	173	139.7 Å²	139.7	80%	0.801	76%	0.755	S	S	*	*				41.1	134.2	120.3	-99.1	-47	0	0	0	121.6
427	R	30.5	Very low	31.3	Very low	228 Å²	228	140.5 Å²	140.5	86%	0.86	76%	0.755	S	S	*	*			trans	105.2	97.5	156	-66.2	174.4	174.5	174.9	-2.7	116.5
428	N	29.3	Very low	31.1	Very low	146 Å²	146	140.4 Å²	140.4	78%	0.781	75%	0.754	S	S	*	*				29.6	153.5	119.4	-57.9	21.8	0	0	0	121.7
429	T	29.6	Very low	30.8	Very low	120 Å²	120	138.5 Å²	138.5	74%	0.736	74%	0.741	S	S	*	*			trans	82.5	121.3	145.3	21.8	0	0	0	0	119
430	V	31.4	Very low	30.6	Very low	119 Å²	119	134.5 Å²	134.5	72%	0.721	73%	0.733	S	S	*	*			trans	29.9	145.6	144.4	-55.7	0	0	0	0	119.6
431	D	33.4	Very low	30.4	Very low	128 Å²	128	135.2 Å²	135.2	68%	0.684	72%	0.723	S	S	*	*			cis	-119.9	150.9	31.6	-59.2	-49.4	0	0	0	112
432	E	29.2	Very low	30.5	Very low	180 Å²	180	139.5 Å²	139.5	84%	0.841	73%	0.728	S	S	*	*				67.6	160.9	57.3	-166.3	165.2	-115.4	0	0	113.9
433	I	32.1	Very low	30.6	Very low	128 Å²	128	138.6 Å²	138.6	66%	0.656	71%	0.714	S	S	*	*			trans	98.9	100.9	168.4	-54.9	-179.2	0	0	0	116.7
434	L	33.4	Very low	30.7	Very low	157 Å²	157	135.1 Å²	135.1	82%	0.822	71%	0.705	S	S	*	*			trans	68.1	148.4	151.6	-59.9	169.8	0	0	0	120.4
435	S	31.2	Very low	30.8	Very low	96 Å²	96	135.9 Å²	135.9	67%	0.671	70%	0.702	S	S	*	*			cis	-170	160.5	-28.5	50.2	0	0	0	0	111.8
436	N	28.6	Very low	30.8	Very low	129 Å²	129	132.1 Å²	132.1	69%	0.69	69%	0.687	S	S	*	*			trans	-48.6	138.5	166.2	-53.9	-45.8	0	0	0	113.8
437	H	35.2	Very low	31	Very low	162 Å²	162	128.6 Å²	128.6	75%	0.75	68%	0.678	S	S	*	*				169.7	129.1	103	-81.7	-54.9	0	0	0	108.8
438	N	27.1	Very low	31.3	Very low	136 Å²	136	119.3 Å²	119.3	73%	0.727	65%	0.647	S	S	*	*			cis	83.7	136.7	49.7	-169	35.2	0	0	0	113.8
439	S	27.5	Very low	31.4	Very low	74 Å²	74	123.8 Å²	123.8	52%	0.517	65%	0.653	S	S	.	*			trans	79.5	136.2	165.5	-3.8	0	0	0	0	119.4
440	Q	29.5	Very low	31.5	Very low	160 Å²	160	125.2 Å²	125.2	75%	0.748	65%	0.649	S	S	*	*			trans	75.4	142.5	147.4	-61	177.3	55.9	0	0	117.1
441	Q	29.6	Very low	31.5	Very low	132 Å²	132	124.6 Å²	124.6	62%	0.617	65%	0.65	S	S	*	*			cis	-164.2	164.2	-4	-127.2	-176.5	68.4	0	0	112.3
442	Q	33	Very low	31.4	Very low	148 Å²	148	128 Å²	128	69%	0.692	66%	0.659	S	S	*	*			trans	68.4	160.5	157.3	-60.8	168	39.1	0	0	118.4
443	Q	30.7	Very low	31.4	Very low	122 Å²	122	124 Å²	124	57%	0.57	65%	0.651	S	S	*	*			cis	-163.1	157.3	-28.2	-103.4	-175.2	37.2	0	0	109.2	F954	Q443-F954 HydrophobicContact CG-CE1 4.4Å; Q443-F954 HydrophobicContact CG-CE2 3.48Å; Q443-F954 VanDerWaalsContact CG-CE2 3.48Å; Q443-F954 HydrophobicContact CG-CZ 3.42Å; Q443-F954 VanDerWaalsContact CG-CZ 3.42Å; Q443-F954 VanDerWaalsContact NE2-CZ 3.3Å
444	G	32.2	Very low	31.3	Very low	57 Å²	57	125.6 Å²	125.6	59%	0.588	66%	0.661	S	S	*	*			trans	80.7	112.7	171.2	0	0	0	0	0	114.7
445	N	30.8	Very low	31.3	Very low	102 Å²	102	122.6 Å²	122.6	55%	0.545	66%	0.659	S	S	.	*			cis	71.8	129.4	31.4	-146.1	0.9	0	0	0	112.6	S951 N952	N445-S951 PolarHBondContact ND2-O 3.35Å; N445-S951 PolarHBondContact OD1-O 3.36Å; N445-N952 WeakPolarHBondContact ND2-CA 3.43Å; N445-N952 PolarHBondContact ND2-N 3.33Å
446	N	33.2	Very low	31.4	Very low	78 Å²	78	122 Å²	122	42%	0.417	67%	0.667	S	S	.	*			trans	107.6	153.7	-163	-69.7	-90.5	0	0	0	115.5	N950 S951 N952	N446-N950 WeakPolarHBondContact CA-OD1 3.48Å; N446-N950 WeakPolarHBondContact CB-OD1 3.39Å; N446-N950 PolarHBondContact OD1-OD1 2.87Å; N446-S951 WeakPolarHBondContact OD1-CB 3.24Å; N446-S951 PolarHBondContact OD1-OG 3.15Å; N446-N952 PolarHBondContact ND2-ND2 3.22Å; N446-N952 PolarHBondContact ND2-OD1 2.77Å
447	T	32.9	Very low	31.6	Very low	99 Å²	99	120.1 Å²	120.1	61%	0.607	67%	0.67	S	S	*	*			trans	-162.3	-64.9	-169.8	-4.6	0	0	0	0	122	Q949 N950	T447-Q949 HydrophobicContact CG2-CB 4.27Å; T447-N950 PolarHBondContact N-OD1 3.45Å; T447-N950 PolarHBondContact OG1-N 2.96Å
448	P	37.2	Very low	31.5	Very low	33 Å²	33	124.1 Å²	124.1	21%	0.214	68%	0.679	C	S	.	*			trans	-116.9	163.9	-144.5	39.3	-32.3	0	0	0	119.7	Q949 N950	P448-Q949 HydrophobicContact CB-CB 3.83Å; P448-Q949 HydrophobicContact CB-CG 4.05Å; P448-Q949 HydrophobicContact CG-CB 3.75Å; P448-N950 WeakPolarHBondContact CD-OD1 3.49Å; P448-N950 HydrophobicContact CG-CB 3.67Å
449	R	31.6	Very low	31.9	Very low	239 Å²	239	121.8 Å²	121.8	90%	0.902	67%	0.673	S	S	*	*				-158.6	167.9	120.9	-124.2	-179.1	-178.7	-163.8	2.1	111.3
450	K	31.9	Very low	32.3	Very low	151 Å²	151	127.7 Å²	127.7	66%	0.657	69%	0.692	S	S	*	*			trans	-84.1	139.7	166.6	-59.6	177.1	179.6	-178.9	0	110
451	S	30.6	Very low	32.4	Very low	106 Å²	106	130.3 Å²	130.3	74%	0.741	70%	0.695	S	S	*	*			trans	172.4	122.2	130.2	54	0	0	0	0	115.5
452	F	31.1	Very low	32.8	Very low	199 Å²	199	129.6 Å²	129.6	87%	0.873	70%	0.702	S	S	*	*			trans	45.8	115.8	137.3	-70.5	-77.6	0	0	0	124.2
453	S	29.4	Very low	33.1	Very low	95 Å²	95	126.6 Å²	126.6	66%	0.664	70%	0.702	S	S	*	*				73.4	127.1	120.5	73.9	0	0	0	0	123.8
454	N	31.4	Very low	33.3	Very low	163 Å²	163	126.6 Å²	126.6	87%	0.872	71%	0.711	S	S	*	*			trans	55.8	147.7	131.7	-76.4	-0.7	0	0	0	121.6
455	A	32.5	Very low	33.7	Very low	93 Å²	93	130.8 Å²	130.8	77%	0.769	73%	0.725	S	S	*	*			cis	-155	162.3	-7.1	0	0	0	0	0	110.5
456	G	32.9	Very low	33.8	Very low	83 Å²	83	131.6 Å²	131.6	86%	0.856	74%	0.736	S	S	*	*			trans	-97.8	-165.6	-177.2	0	0	0	0	0	116.2
457	A	33.4	Very low	33.8	Very low	90 Å²	90	139.4 Å²	139.4	74%	0.744	76%	0.759	S	S	*	*			trans	-145.8	125.8	174.1	0	0	0	0	0	107.2
458	R	33.2	Very low	33.8	Very low	247 Å²	247	143 Å²	143	93%	0.932	77%	0.774	S	S	*	*				69.7	144.4	77.7	-78.1	-174.4	176.2	-176.3	1.2	112.8
459	S	35	Very low	33.6	Very low	87 Å²	87	146 Å²	146	61%	0.608	79%	0.791	S	S	*	*			cis	-173.8	150.8	-1.3	149	0	0	0	0	109.7
460	H	36.9	Very low	33.8	Very low	197 Å²	197	144.5 Å²	144.5	91%	0.912	79%	0.791	S	S	*	*			trans	-144.2	158.1	137.6	-96.9	-75.2	0	0	0	111.6
461	R	31.5	Very low	33.8	Very low	216 Å²	216	145.7 Å²	145.7	82%	0.815	80%	0.799	S	S	*	*			trans	-149.3	160.6	-171.7	-132.9	-172.7	-174.2	-164	3.7	107
462	P	37.8	Very low	34	Very low	117 Å²	117	145.5 Å²	145.5	76%	0.76	80%	0.804	S	S	*	*				-154.5	-164.9	76	41.1	-19.9	0	0	0	115.5
463	A	38.5	Very low	34	Very low	84 Å²	84	140.1 Å²	140.1	69%	0.694	81%	0.805	S	S	*	*			trans	61	120.8	169.6	0	0	0	0	0	118.1
464	T	34.7	Very low	34.1	Very low	123 Å²	123	140.7 Å²	140.7	76%	0.755	82%	0.815	S	S	*	*			cis	84.4	91.3	27	77.7	0	0	0	0	117.2
465	T	41.3	Very low	34	Very low	144 Å²	144	137.5 Å²	137.5	88%	0.883	81%	0.811	S	S	*	*			trans	-163.3	163	146.6	10.9	0	0	0	0	109
466	P	33.9	Very low	34.1	Very low	119 Å²	119	144.7 Å²	144.7	77%	0.773	82%	0.819	S	S	*	*			trans	-92.1	161.9	-150	34.6	-38	0	0	0	117.2
467	R	31.2	Very low	34.2	Very low	243 Å²	243	145.6 Å²	145.6	92%	0.917	82%	0.818	S	S	*	*			trans	-53.5	139.6	161.4	-80.4	174.5	161.9	165.9	-7.7	110.9
468	L	34.1	Very low	34	Very low	173 Å²	173	152.9 Å²	152.9	91%	0.906	83%	0.826	S	S	*	*			trans	-127.3	125.5	159.5	-134.3	168	0	0	0	109
469	V	32.5	Very low	34	Very low	96 Å²	96	150.4 Å²	150.4	58%	0.582	83%	0.825	S	S	*	*			trans	-85.3	142.3	-169.2	171.4	0	0	0	0	111.1	E471	V469-E471 HydrophobicContact CG1-CB 3.85Å; V469-E471 HydrophobicContact CG1-CG 3.92Å
470	K	36.9	Very low	33.9	Very low	208 Å²	208	150.6 Å²	150.6	90%	0.904	83%	0.832	S	S	*	*			trans	-132.9	45.9	164.1	-155.5	170.7	-175.5	173.8	0	112.6	A472	K470-A472 PolarHBondContact O-N 3.34Å
471	E	30.2	Very low	33.7	Very low	177 Å²	177	145.5 Å²	145.5	83%	0.827	82%	0.824	S	S	*	*			trans	-73.5	116.6	162.4	-70	-178	119.1	0	0	109.7	V469	V469-E471 HydrophobicContact CG1-CB 3.85Å; V469-E471 HydrophobicContact CG1-CG 3.92Å
472	A	35.3	Very low	33.8	Very low	101 Å²	101	140.9 Å²	140.9	84%	0.835	83%	0.825	S	S	*	*			trans	-155	126.9	166.5	0	0	0	0	0	110.4	K470	K470-A472 PolarHBondContact O-N 3.34Å
473	G	31.3	Very low	33.8	Very low	87 Å²	87	144.2 Å²	144.2	90%	0.897	83%	0.827	S	S	*	*	S	Bend	trans	106.1	22	157.9	0	0	0	0	0	119.7
474	A	31.4	Very low	33.8	Very low	107 Å²	107	146.6 Å²	146.6	88%	0.884	83%	0.828	S	S	*	*			trans	-141.7	19.7	-178.7	0	0	0	0	0	118.2
475	A	30.2	Very low	33.9	Very low	95 Å²	95	146 Å²	146	79%	0.785	82%	0.824	S	S	*	*			trans	-148.6	108.2	178.9	0	0	0	0	0	115.2
476	R	33.8	Very low	33.6	Very low	245 Å²	245	145 Å²	145	93%	0.925	82%	0.818	S	S	*	*			trans	159.4	119.3	144.8	-94.6	171.8	175.9	169.4	0.5	111.4
477	A	34.6	Very low	33.7	Very low	101 Å²	101	147.7 Å²	147.7	84%	0.835	82%	0.818	S	S	*	*	S	Bend	trans	179.6	33.5	151.6	0	0	0	0	0	114.1
478	R	30.4	Very low	33.9	Very low	243 Å²	243	142.4 Å²	142.4	92%	0.917	81%	0.806	S	S	*	*			trans	-148.6	82.6	170.4	-88	-166.8	172.9	171.3	-4.1	111.4
479	E	31.6	Very low	33.9	Very low	196 Å²	196	140.3 Å²	140.3	92%	0.916	80%	0.796	S	S	*	*			trans	-168.7	117.8	153.2	-117.8	175.1	172.8	0	0	109.7
480	A	33.4	Very low	34.1	Very low	90 Å²	90	142.6 Å²	142.6	74%	0.744	80%	0.8	S	S	*	*			trans	-164.5	47.3	178	0	0	0	0	0	111.4
481	A	33.6	Very low	33.8	Very low	90 Å²	90	140 Å²	140	74%	0.744	79%	0.789	S	S	*	*			trans	-145.2	137.2	176.3	0	0	0	0	0	111.6
482	S	33.1	Very low	34	Very low	120 Å²	120	141.4 Å²	141.4	84%	0.839	79%	0.788	S	S	*	*			trans	69.7	156.9	170.8	-57.4	0	0	0	0	118.4
483	K	38.6	Very low	33.9	Very low	186 Å²	186	141.7 Å²	141.7	81%	0.809	78%	0.784	S	S	*	*			trans	81.4	125.5	-168.9	-61.6	-166.1	177.8	-175.1	0	114.5
484	D	37.6	Very low	34.6	Very low	134 Å²	134	142 Å²	142	72%	0.717	77%	0.77	S	S	*	*			cis	-151.8	167.6	-0.2	-78.8	-41.3	0	0	0	107.5
485	V	37	Very low	34.9	Very low	110 Å²	110	145 Å²	145	67%	0.667	77%	0.766	S	S	*	*			cis	178	154.2	-14.7	146.1	0	0	0	0	105.6
486	T	34.9	Very low	35.1	Very low	124 Å²	124	145.3 Å²	145.3	76%	0.761	76%	0.762	S	S	*	*			trans	67.3	150.5	173.1	46.7	0	0	0	0	118.5
487	K	35.3	Very low	35.2	Very low	175 Å²	175	141.9 Å²	141.9	76%	0.761	76%	0.756	S	S	*	*			cis	-157.5	151.9	14.2	-135	171.3	-178.8	-178.5	0	112
488	I	35.5	Very low	35.2	Very low	132 Å²	132	141 Å²	141	68%	0.677	75%	0.749	S	S	*	*			trans	66	113.2	156.1	-69.6	155.4	0	0	0	116.2
489	D	33.9	Very low	35.3	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	74%	0.741	S	S	*	*				79.9	140	68.3	-79.7	-59.9	0	0	0	113.7
490	H	36.6	Very low	35.2	Very low	144 Å²	144	137.6 Å²	137.6	67%	0.667	74%	0.738	S	S	*	*			cis	-162.4	152.9	26.7	-115.1	1.4	0	0	0	112.7
491	F	32.3	Very low	35.3	Very low	153 Å²	153	139.5 Å²	139.5	67%	0.671	74%	0.74	S	S	*	*			trans	48.3	161.3	152.9	-68.2	-73.2	0	0	0	122.4
492	Y	34.1	Very low	35.3	Very low	208 Å²	208	140.3 Å²	140.3	82%	0.816	74%	0.74	S	S	*	*			cis	-140.8	-166.3	1.1	-125.8	-64.4	0	0	0	110.7
493	S	32.6	Very low	35.8	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	74%	0.739	S	S	*	*			trans	-153.7	-171.4	-166.9	-117.1	0	0	0	0	111.4
494	P	46.4	Very low	35.5	Very low	94 Å²	94	137.7 Å²	137.7	61%	0.61	74%	0.743	S	S	*	*			cis	-140.9	-160.4	-30.8	35.8	-13.4	0	0	0	114.5
495	H	36.7	Very low	35.4	Very low	171 Å²	171	134.2 Å²	134.2	79%	0.792	73%	0.732	S	S	*	*			trans	78.6	128.4	159.4	-62.1	-27.6	0	0	0	119.1
496	S	34.4	Very low	35.3	Very low	100 Å²	100	137.8 Å²	137.8	70%	0.699	74%	0.739	S	S	*	*				96.3	144.9	58.5	93.9	0	0	0	0	112.2
497	Q	36.5	Very low	35.4	Very low	173 Å²	173	136.1 Å²	136.1	81%	0.808	73%	0.728	S	S	*	*			cis	-143.4	163.6	15	-57.8	-177.7	-16	0	0	114.6
498	A	34.1	Very low	35.5	Very low	82 Å²	82	130.3 Å²	130.3	68%	0.678	72%	0.718	S	S	*	*			trans	54.6	148.1	135	0	0	0	0	0	126.2
499	N	33.9	Very low	35.4	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	71%	0.713	S	S	*	*			trans	89.1	97.1	142.1	-86.8	-35.8	0	0	0	123.7
500	R	29.3	Very low	35.5	Very low	226 Å²	226	128.5 Å²	128.5	85%	0.853	72%	0.715	S	S	*	*				93.5	147.5	112.7	-134.1	-179.6	-155.7	-166	7.7	120.1
501	V	35.9	Very low	35.4	Very low	130 Å²	130	128.2 Å²	128.2	79%	0.788	72%	0.718	S	S	*	*			trans	80.6	148.2	166.6	-167.8	0	0	0	0	117.3
502	S	32.4	Very low	35.5	Very low	107 Å²	107	125.9 Å²	125.9	75%	0.748	72%	0.72	S	S	*	*			trans	-152.1	179.1	-177.9	-37.8	0	0	0	0	107.6
503	P	43.1	Very low	35.4	Very low	126 Å²	126	122.5 Å²	122.5	82%	0.818	72%	0.721	S	S	*	*			cis	-128.5	-167.8	-35.4	37.4	-20.5	0	0	0	111.4
504	S	32.4	Very low	35.3	Very low	126 Å²	126	123.5 Å²	123.5	88%	0.881	73%	0.727	S	S	*	*			trans	133.9	148.6	136.4	-156.9	0	0	0	0	116.9
505	A	35.8	Very low	34.6	Very low	60 Å²	60	127.7 Å²	127.7	50%	0.496	74%	0.738	S	S	.	*			trans	-90.1	162.6	-156.8	0	0	0	0	0	117.8
506	K	36	Very low	34.9	Very low	185 Å²	185	124.4 Å²	124.4	80%	0.804	73%	0.732	S	S	*	*				176.4	123.4	127.1	-95.2	160.4	-174.5	-179.6	0	110.9
507	V	37.1	Very low	34.9	Very low	89 Å²	89	125.1 Å²	125.1	54%	0.539	73%	0.732	S	S	.	*				82.6	117.3	81.9	170.7	0	0	0	0	114.2
508	G	35.7	Very low	34.8	Very low	53 Å²	53	123.1 Å²	123.1	55%	0.546	73%	0.727	S	S	.	*			trans	-144.1	178.2	172.7	0	0	0	0	0	111.7
509	N	34	Very low	34.9	Very low	107 Å²	107	125.8 Å²	125.8	57%	0.572	73%	0.73	S	S	*	*			trans	-165.9	177.2	-177.5	-152.8	95.3	0	0	0	110.3	Y1057	N509-Y1057 PolarHBondContact OD1-OH 2.95Å
510	T	37.4	Very low	35	Very low	117 Å²	117	123.7 Å²	123.7	72%	0.718	73%	0.726	S	S	*	*			trans	74.3	148.7	164	73	0	0	0	0	118.2
511	D	32.8	Very low	35.4	Very low	137 Å²	137	120.6 Å²	120.6	73%	0.733	73%	0.725	S	S	*	*			cis	-165.8	175.3	-31.9	-111.1	-56.4	0	0	0	111.9
512	S	35.9	Very low	35.7	Very low	104 Å²	104	119.3 Å²	119.3	73%	0.727	72%	0.72	S	S	*	*			trans	73.9	107	157.7	65	0	0	0	0	122.9
513	V	31.7	Very low	35.8	Very low	138 Å²	138	121.5 Å²	121.5	84%	0.836	72%	0.721	S	S	*	*				28.2	118.7	126.1	-173.5	0	0	0	0	120.9
514	C	30.2	Very low	35.2	Very low	126 Å²	126	119.7 Å²	119.7	85%	0.851	71%	0.712	S	S	*	*				-172	164.4	121.5	-112	0	0	0	0	113.9
515	Q	31.9	Very low	35.2	Very low	183 Å²	183	119.8 Å²	119.8	86%	0.855	71%	0.711	S	S	*	*			trans	-115	179.5	169.4	-82.5	-157	-10.2	0	0	108.9
516	P	41.4	Very low	35	Very low	102 Å²	102	120.2 Å²	120.2	66%	0.662	72%	0.721	S	S	*	*			cis	-143.5	-155.2	15.1	42	-19.1	0	0	0	116.2
517	T	34.4	Very low	34.7	Very low	115 Å²	115	119 Å²	119	71%	0.706	72%	0.718	S	S	*	*			trans	78.1	101	153.3	41.8	0	0	0	0	122.1
518	D	35.2	Very low	34.3	Very low	131 Å²	131	123.5 Å²	123.5	70%	0.701	73%	0.725	S	S	*	*				66	128.9	107.9	-79.2	39.4	0	0	0	124.8
519	N	35.6	Very low	34	Very low	137 Å²	137	127.1 Å²	127.1	73%	0.733	73%	0.732	S	S	*	*			trans	61.4	130.6	144.5	-55.8	-42.1	0	0	0	118.1
520	S	37.7	Very low	33.8	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	74%	0.742	S	S	*	*				179.4	142.3	64.8	56.4	0	0	0	0	110.7
521	I	37.8	Very low	33.6	Very low	161 Å²	161	130.6 Å²	130.6	83%	0.826	75%	0.746	S	S	*	*				105.7	142	102.7	-85.9	176.9	0	0	0	113.1
522	P	40.3	Very low	33.7	Very low	104 Å²	104	128.6 Å²	128.6	68%	0.675	74%	0.741	S	S	*	*				-142.5	-120.9	-109.9	39.5	-16.1	0	0	0	114
523	I	35.8	Very low	33.5	Very low	152 Å²	152	131 Å²	131	78%	0.779	75%	0.746	S	S	*	*			trans	84.7	138.7	159.8	-76.6	159	0	0	0	118.9
524	S	30.2	Very low	33.4	Very low	89 Å²	89	134.8 Å²	134.8	62%	0.622	75%	0.745	S	S	*	*			cis	-168.3	173.5	-34.1	67.7	0	0	0	0	110.8
525	C	32.2	Very low	33.4	Very low	128 Å²	128	134.7 Å²	134.7	87%	0.865	74%	0.735	S	S	*	*			trans	70.2	143.2	160.9	-64.4	0	0	0	0	119
526	G	30.7	Very low	33.6	Very low	69 Å²	69	134.1 Å²	134.1	71%	0.711	73%	0.732	S	S	*	*			cis	173.5	118	-8.8	0	0	0	0	0	116.3
527	H	30.9	Very low	33.6	Very low	159 Å²	159	134.7 Å²	134.7	74%	0.736	74%	0.736	S	S	*	*			trans	57.6	125.8	141.7	-96.9	-6.9	0	0	0	123.3
528	R	27.6	Very low	33.8	Very low	183 Å²	183	132.6 Å²	132.6	69%	0.691	74%	0.737	S	S	*	*				92.2	121	127.2	-73.8	176.2	-167.4	-146.9	3.9	122.1
529	N	29.8	Very low	33.8	Very low	129 Å²	129	135.4 Å²	135.4	69%	0.69	75%	0.749	S	S	*	*				77.9	134.2	129.3	-60	6.5	0	0	0	121.2
530	N	30.5	Very low	33.8	Very low	144 Å²	144	132.3 Å²	132.3	77%	0.77	75%	0.749	S	S	*	*			trans	4.9	127	138.8	-41.7	-5.7	0	0	0	115.3
531	D	32.5	Very low	33.8	Very low	153 Å²	153	133.6 Å²	133.6	82%	0.818	75%	0.753	S	S	*	*				-162.3	177	64.2	-110.3	-28.5	0	0	0	112.9
532	P	35.9	Very low	33.6	Very low	95 Å²	95	132.2 Å²	132.2	62%	0.617	75%	0.752	S	S	*	*			trans	-92.3	154.1	-175.7	35.5	-34.6	0	0	0	115.3
533	N	30.4	Very low	33.2	Very low	155 Å²	155	134 Å²	134	83%	0.829	76%	0.756	S	S	*	*			trans	73.5	155	-179.2	-40	-84.5	0	0	0	112.8
534	R	29.5	Very low	33.2	Very low	218 Å²	218	131.6 Å²	131.6	82%	0.823	75%	0.753	S	S	*	*			cis	-173.7	137.2	35.2	-179.4	173.9	-175.9	-156.2	0.3	112.9
535	L	31.5	Very low	33.3	Very low	123 Å²	123	133.5 Å²	133.5	64%	0.644	76%	0.756	S	S	*	*			trans	64.5	130.9	161.3	-66.2	169.7	0	0	0	117.8
536	Q	35.9	Very low	33.2	Very low	171 Å²	171	130.8 Å²	130.8	80%	0.799	74%	0.738	S	S	*	*				77.6	158.8	62.9	-82.4	-160.5	35.1	0	0	114.9
537	P	41.6	Very low	33.4	Very low	114 Å²	114	131.3 Å²	131.3	74%	0.74	73%	0.731	S	S	*	*			cis	-136.8	176.7	9.8	42.1	-24.9	0	0	0	118.2
538	G	37.7	Very low	33.5	Very low	71 Å²	71	130.9 Å²	130.9	73%	0.732	73%	0.734	S	S	*	*			trans	93.1	143.5	152	0	0	0	0	0	118.1
539	M	36.4	Very low	33.9	Very low	191 Å²	191	133 Å²	133	94%	0.941	74%	0.742	S	S	*	*			cis	-150.5	140.3	-8.1	-74.3	-179.6	64.7	0	0	111.4
540	G	35.7	Very low	34.3	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	75%	0.753	S	S	*	*			trans	75.9	146.6	157.8	0	0	0	0	0	118.5
541	T	36.2	Very low	34.6	Very low	126 Å²	126	136.8 Å²	136.8	77%	0.773	75%	0.75	S	S	*	*			cis	-157.1	137.2	-11.7	37.5	0	0	0	0	110.4
542	T	34.6	Very low	34.7	Very low	132 Å²	132	137.9 Å²	137.9	81%	0.81	75%	0.754	S	S	*	*			trans	59.7	146.5	152.2	55.5	0	0	0	0	121.8
543	N	31.5	Very low	34.5	Very low	141 Å²	141	138.4 Å²	138.4	75%	0.754	76%	0.76	S	S	*	*			cis	-168.5	137.8	-28.8	-157.2	1.1	0	0	0	110.2
544	S	35.9	Very low	34.7	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	76%	0.763	S	S	*	*			trans	163.8	146.2	148.1	46.2	0	0	0	0	111.8
545	N	32.3	Very low	34.7	Very low	129 Å²	129	129.6 Å²	129.6	69%	0.69	76%	0.763	S	S	*	*			trans	-99.9	173.3	-162.1	-72.9	-30	0	0	0	114.9	N822	N545-N822 WeakPolarHBondContact O-CB 3.43Å; N545-N822 PolarHBondContact O-ND2 2.77Å
546	S	30.6	Very low	34.7	Very low	71 Å²	71	128.3 Å²	128.3	50%	0.497	77%	0.77	S	S	.	*			trans	-148.6	133.3	152.4	64.5	0	0	0	0	112.8
547	S	34.6	Very low	34.4	Very low	81 Å²	81	123.7 Å²	123.7	57%	0.566	76%	0.761	S	S	*	*			trans	59.7	131.9	155.6	69.4	0	0	0	0	121.8
548	N	33.8	Very low	34	Very low	149 Å²	149	126.2 Å²	126.2	80%	0.797	76%	0.763	S	S	*	*				169.9	163.6	109.8	-98.8	-69.9	0	0	0	117.2
549	R	35.8	Very low	33.7	Very low	229 Å²	229	128.6 Å²	128.6	86%	0.864	76%	0.758	S	S	*	*			trans	80.8	96.6	157.2	-75.5	177.6	-172.9	-141.6	1.9	123.1
550	R	37	Very low	33.3	Very low	244 Å²	244	130.3 Å²	130.3	92%	0.921	75%	0.754	S	S	*	*				75.4	161	115.9	-79.5	-159.6	171.7	-137.7	-2.3	121.7
551	P	37.3	Very low	33.1	Very low	108 Å²	108	132 Å²	132	70%	0.701	76%	0.755	S	S	*	*			trans	-130	-177.7	-144.7	46.1	-32.7	0	0	0	116.7
552	I	35.2	Very low	33.1	Very low	175 Å²	175	131.3 Å²	131.3	90%	0.897	76%	0.755	S	S	*	*			trans	-150.7	171.1	156.7	-101.4	151.5	0	0	0	109.2
553	S	31	Very low	33	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	76%	0.756	S	S	*	*			trans	-126	170.1	-163.1	57.5	0	0	0	0	116.3
554	A	33.3	Very low	33	Very low	108 Å²	108	125.6 Å²	125.6	89%	0.893	76%	0.756	S	S	*	*			trans	75.1	158.9	159.7	0	0	0	0	0	119.7
555	G	31	Very low	32.8	Very low	79 Å²	79	127.3 Å²	127.3	81%	0.814	76%	0.762	S	S	*	*			trans	132.7	142.6	175.7	0	0	0	0	0	114.2
556	A	31.3	Very low	32.8	Very low	97 Å²	97	128.8 Å²	128.8	80%	0.802	77%	0.768	S	S	*	*			trans	-154.7	172.5	-178.6	0	0	0	0	0	113.6
557	A	30.3	Very low	32.7	Very low	73 Å²	73	128.2 Å²	128.2	60%	0.603	77%	0.774	S	S	*	*			trans	85.6	121.9	161.5	0	0	0	0	0	121.4
558	H	31.8	Very low	32.6	Very low	167 Å²	167	130.6 Å²	130.6	77%	0.773	79%	0.79	S	S	*	*			trans	34	136.3	139.7	-76.1	-68.8	0	0	0	124.1
559	L	31.5	Very low	32.4	Very low	121 Å²	121	130.4 Å²	130.4	63%	0.634	80%	0.795	S	S	*	*				-164.8	129.3	114.2	-92	158.3	0	0	0	107.7
560	R	29.1	Very low	32.2	Very low	227 Å²	227	124.5 Å²	124.5	86%	0.857	80%	0.795	S	S	*	*				51	137.7	96.7	-63.9	-169.5	-176.4	-154.3	0.4	114.7
561	S	30.6	Very low	31.7	Very low	108 Å²	108	118 Å²	118	76%	0.755	79%	0.787	S	S	*	*			cis	-151.4	162.6	6	-158	0	0	0	0	108.2
562	S	36.8	Very low	31.5	Very low	110 Å²	110	119.8 Å²	119.8	77%	0.769	80%	0.796	S	S	*	*			cis	-145.4	-177.3	15.6	-67	0	0	0	0	109
563	G	31.7	Very low	31.2	Very low	80 Å²	80	117.8 Å²	117.8	83%	0.825	79%	0.792	S	S	*	*			cis	132.7	117.9	-6.5	0	0	0	0	0	113.3
564	G	31.3	Very low	31.1	Very low	74 Å²	74	116.4 Å²	116.4	76%	0.763	79%	0.794	S	S	*	*			trans	112.1	140.3	-179.1	0	0	0	0	0	113.7
565	T	32.4	Very low	30.9	Very low	137 Å²	137	116.5 Å²	116.5	84%	0.84	79%	0.794	S	S	*	*			cis	-150.7	154.8	-8.1	-63.8	0	0	0	0	111.2
566	I	31.6	Very low	30.9	Very low	159 Å²	159	116.4 Å²	116.4	82%	0.815	79%	0.793	S	S	*	*			trans	-33.8	147.5	165.9	-57.2	150.5	0	0	0	113.8
567	G	30.4	Very low	30.8	Very low	60 Å²	60	117.7 Å²	117.7	62%	0.619	80%	0.797	S	S	*	*			cis	119.4	126.2	1.6	0	0	0	0	0	114
568	S	32.4	Very low	30.8	Very low	130 Å²	130	117.9 Å²	117.9	91%	0.909	81%	0.806	S	S	*	*			trans	-169	152.5	162.3	-88.2	0	0	0	0	112.4
569	T	29.7	Very low	30.9	Very low	146 Å²	146	116.4 Å²	116.4	90%	0.896	81%	0.809	S	S	*	*			trans	-120.7	150	179.9	49.4	0	0	0	0	111.5
570	A	30.2	Very low	31	Very low	105 Å²	105	121.7 Å²	121.7	87%	0.868	82%	0.82	S	S	*	*			trans	-131.9	145.9	162.4	0	0	0	0	0	108.6
571	S	27.2	Very low	31.3	Very low	107 Å²	107	116 Å²	116	75%	0.748	81%	0.814	S	S	*	*			trans	-127.4	136.3	-170.9	-175.2	0	0	0	0	111.1
572	V	32.2	Very low	31.3	Very low	145 Å²	145	114.2 Å²	114.2	88%	0.879	80%	0.796	S	S	*	*			trans	-131.2	134.2	163.3	-179.7	0	0	0	0	107.9
573	V	28.7	Very low	31	Very low	134 Å²	134	113.7 Å²	113.7	81%	0.812	79%	0.789	S	S	*	*			trans	-99.7	132.6	-176.5	177.3	0	0	0	0	109.7
574	G	29.5	Very low	30.8	Very low	77 Å²	77	112.6 Å²	112.6	79%	0.794	77%	0.768	S	S	*	*			trans	-147.9	127.2	170.8	0	0	0	0	0	110.4
575	A	30.1	Very low	30.6	Very low	110 Å²	110	112.4 Å²	112.4	91%	0.909	75%	0.754	S	S	*	*			trans	-103.5	130.4	-179.2	0	0	0	0	0	110.7
576	G	29.7	Very low	30.4	Very low	77 Å²	77	110.7 Å²	110.7	79%	0.794	74%	0.744	S	S	*	*			trans	-165.7	134.4	178.9	0	0	0	0	0	111.8	G578	G576-G578 PolarHBondContact O-N 3.24Å
577	S	29.8	Very low	30.7	Very low	124 Å²	124	105 Å²	105	87%	0.867	71%	0.714	S	S	*	*			trans	-61.7	119.8	-173.6	47.7	0	0	0	0	114.2
578	G	29.8	Very low	30.9	Very low	77 Å²	77	102.8 Å²	102.8	79%	0.794	69%	0.69	S	S	*	*			trans	-98.3	103.7	176.1	0	0	0	0	0	114	G576	G576-G578 PolarHBondContact O-N 3.24Å
579	T	33.9	Very low	31.2	Very low	137 Å²	137	100.1 Å²	100.1	84%	0.84	67%	0.668	S	S	*	*			trans	-76.3	121.5	168	43.4	0	0	0	0	110.3
580	R	33.2	Very low	32	Very low	231 Å²	231	93.4 Å²	93.4	87%	0.872	63%	0.626	S	S	*	*			trans	-106.9	116.8	-171.4	-144.1	172.6	-172.4	177	2.2	111.8
581	C	35.4	Very low	32.6	Very low	108 Å²	108	91.3 Å²	91.3	73%	0.73	60%	0.603	S	S	*	*			trans	-72.6	143.2	-170.1	-52.1	0	0	0	0	114.2	T583	C581-T583 PolarHBondContact O-N 3Å
582	D	32.3	Very low	33.8	Very low	70 Å²	70	86.7 Å²	86.7	37%	0.374	57%	0.569	S	S	.	*			trans	-88.7	95	179.5	-72.8	-48.9	0	0	0	111.9	R192 R228	R192-D582 IonicContact CZ-OD1 3.56Å; R192-D582 IonicContact CZ-OD2 2.91Å; R192-D582 IonicContact NH1-OD1 2.76Å; R192-D582 IonicContact NH1-OD2 3.78Å; R192-D582 PolarHBondContact NH1-OD2 3.1Å; R192-D582 IonicContact NH2-OD1 2.95Å; R192-D582 PolarHBondContact NH2-OD1 3.37Å; R192-D582 IonicContact NH2-OD2 2.75Å; R192-D582 PolarHBondContact NH2-OD2 2.98Å; R228-D582 IonicContact CZ-OD1 3.68Å; R228-D582 IonicContact CZ-OD2 3.61Å; R228-D582 IonicContact NH1-OD1 2.83Å; R228-D582 IonicContact NH1-OD2 3.25Å; R228-D582 PolarHBondContact NH1-OD2 3.28Å; R228-D582 IonicContact NH2-OD1 2.63Å; R228-D582 PolarHBondContact NH2-OD1 3.12Å; R228-D582 IonicContact NH2-OD2 2.92Å; R228-D582 PolarHBondContact NH2-OD2 3.39Å
583	T	29.7	Very low	34.5	Very low	100 Å²	100	84.1 Å²	84.1	61%	0.613	55%	0.554	S	S	*	*			trans	-120.3	102.6	176.5	48	0	0	0	0	113.3	K231 C581	K231-T583 VanDerWaalsContact CE-O 3.31Å; K231-T583 WeakPolarHBondContact CE-O 3.4Å; K231-T583 PolarHBondContact NZ-O 3.41Å; C581-T583 PolarHBondContact O-N 3Å
584	S	27.4	Very low	35.2	Very low	57 Å²	57	82.2 Å²	82.2	40%	0.399	54%	0.539	S	S	.	.			trans	-160.1	136.4	165.8	50.2	0	0	0	0	111.3
585	C	27.3	Very low	35.6	Very low	69 Å²	69	83 Å²	83	47%	0.466	52%	0.522	S	S	.	.	S	Bend	trans	70	134.2	-179.9	-53.3	0	0	0	0	115.7	V191 H587	V191-C585 HydrophobicContact CG2-CB 4.34Å; C585-H587 PolarHBondContact O-N 2.99Å; C585-H587 VanDerWaalsContact O-N 3.1Å; C585-H587 PolarHBondContact O-ND1 3.24Å
586	T	28.5	Very low	35.9	Very low	102 Å²	102	79.8 Å²	79.8	63%	0.626	50%	0.5	S	S	*	.			trans	-65.6	100.7	-168.5	51.2	0	0	0	0	113.7
587	H	37	Very low	36	Very low	38 Å²	38	85.2 Å²	85.2	18%	0.176	51%	0.505	C	S	.	.			trans	-131.3	143.7	170.4	-62.8	85.9	0	0	0	109.1	D138 G189 T190 C585 V589	D138-H587 IonicContact OD1-CD2 3.48Å; D138-H587 IonicContact OD1-NE2 3.98Å; D138-H587 IonicContact OD2-CD2 2.75Å; D138-H587 PolarHBondContact OD2-CD2 3.39Å; G189-H587 PolarHBondContact O-CE1 3.19Å; G189-H587 PolarHBondContact O-NE2 3.26Å; T190-H587 PolarHBondContact N-NE2 2.95Å; T190-H587 PolarHBondContact OG1-CD2 3.24Å; T190-H587 PolarHBondContact OG1-NE2 3.17Å; C585-H587 PolarHBondContact O-N 2.99Å; C585-H587 VanDerWaalsContact O-N 3.1Å; C585-H587 PolarHBondContact O-ND1 3.24Å; H587-V589 PolarHBondContact O-N 3.41Å
588	A	35	Very low	36.3	Very low	14 Å²	14	87.4 Å²	87.4	12%	0.116	51%	0.507	C	S	.	.			trans	-64.1	124.1	161	0	0	0	0	0	107.6	G26	G26-A588 WeakPolarHBondContact O-CA 3.38Å
589	V	39	Very low	36.5	Very low	74 Å²	74	87.9 Å²	87.9	45%	0.448	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	107.2	164	-176.3	0	0	0	0	105.5	G25 H587 V591	G25-V589 WeakPolarHBondContact CA-O 3.46Å; H587-V589 PolarHBondContact O-N 3.41Å; V589-V591 VanDerWaalsContact C-N 3.28Å; V589-V591 HydrophobicContact CG1-CG2 3.85Å; V589-V591 PolarHBondContact O-N 3.41Å; V589-V591 VanDerWaalsContact O-N 3.09Å
590	I	47.1	Very low	36.4	Very low	5 Å²	5	89.6 Å²	89.6	3%	0.026	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	86	170.3	-56.1	-177.3	0	0	0	106.8	I32 N97 L163 D164 M592	I32-I590 HydrophobicContact CD1-CD1 4.39Å; I32-I590 HydrophobicContact CD1-CG2 4.35Å; I32-I590 HydrophobicContact CG2-CG1 4.35Å; N97-I590 PolarHBondContact ND2-O 3.31Å; L163-I590 HydrophobicContact CB-CD1 4.23Å; L163-I590 HydrophobicContact CD1-CG2 4.21Å; D164-I590 HydrophobicContact CB-CD1 3.97Å; I590-M592 HydrophobicContact CG2-CE 4.09Å; I590-M592 HydrophobicContact CG2-CG 3.8Å; I590-M592 HydrophobicContact CG2-SD 4.14Å
591	V	43	Very low	36.4	Very low	61 Å²	61	88.8 Å²	88.8	37%	0.37	50%	0.5	S	S	.	.			trans	-72.6	140.2	158	-170.3	0	0	0	0	106	I24 V589	I24-V591 CarbonylContact C-O 3.47Å; I24-V591 WeakPolarHBondContact CB-O 3.48Å; I24-V591 WeakPolarHBondContact O-CB 3.38Å; V589-V591 VanDerWaalsContact C-N 3.28Å; V589-V591 HydrophobicContact CG1-CG2 3.85Å; V589-V591 PolarHBondContact O-N 3.41Å; V589-V591 VanDerWaalsContact O-N 3.09Å
592	M	51.7	Low	36.3	Very low	11 Å²	11	92.5 Å²	92.5	5%	0.054	51%	0.507	C	S	.	.			trans	-129.8	131.5	164.6	-66.8	-162.7	-80.1	0	0	107.6	I24 L93 Q94 A145 L163 I590	I24-M592 HydrophobicContact CD1-CG 3.84Å; I24-M592 HydrophobicContact CD1-SD 4.05Å; I24-M592 HydrophobicContact CG1-CG 4.45Å; L93-M592 HydrophobicContact CD1-SD 3.82Å; Q94-M592 HydrophobicContact CB-CE 3.6Å; Q94-M592 HydrophobicContact CG-CE 4.29Å; Q94-M592 WeakPolarHBondContact O-CB 3.46Å; A145-M592 HydrophobicContact CB-CE 3.89Å; L163-M592 HydrophobicContact CD1-CE 3.63Å; I590-M592 HydrophobicContact CG2-CE 4.09Å; I590-M592 HydrophobicContact CG2-CG 3.8Å; I590-M592 HydrophobicContact CG2-SD 4.14Å
593	V	47.6	Very low	36.2	Very low	91 Å²	91	94.4 Å²	94.4	55%	0.552	52%	0.517	S	S	*	.			trans	-82	151.4	-163.3	-176.7	0	0	0	0	109.8	I24	I24-V593 HydrophobicContact CG2-CG2 4.33Å
594	D	41.9	Very low	36.2	Very low	94 Å²	94	98.3 Å²	98.3	50%	0.503	53%	0.53	S	S	.	.			trans	-66.1	149.3	178.9	-144.5	10.7	0	0	0	111.9	K96	K96-D594 WeakPolarHBondContact CE-OD1 3.32Å; K96-D594 VanDerWaalsContact CE-OD2 3.3Å; K96-D594 WeakPolarHBondContact CE-OD2 3.41Å; K96-D594 IonicContact NZ-OD1 3.95Å; K96-D594 PolarHBondContact NZ-OD1 3.42Å; K96-D594 IonicContact NZ-OD2 3.24Å; K96-D594 PolarHBondContact NZ-OD2 3.24Å
595	Q	39.3	Very low	36.6	Very low	92 Å²	92	100.9 Å²	100.9	43%	0.43	54%	0.544	S	S	.	.			trans	-119.2	85.5	167.3	-67	-171.6	25.3	0	0	107.5	K43	K43-Q595 VanDerWaalsContact CD-NE2 3.28Å
596	G	35.4	Very low	36.7	Very low	44 Å²	44	106.3 Å²	106.3	45%	0.454	56%	0.559	S	S	.	*			trans	-145.5	61.6	-168.3	0	0	0	0	0	112.3	N598	G596-N598 PolarHBondContact O-N 3.25Å
597	E	32.7	Very low	36.8	Very low	190 Å²	190	106 Å²	106	89%	0.888	57%	0.567	S	S	*	*	S	Bend	trans	-67.8	79.9	165.9	-68.7	178.3	-177.6	0	0	109.5
598	N	34.2	Very low	36.4	Very low	171 Å²	171	109 Å²	109	91%	0.914	59%	0.587	S	S	*	*			trans	166.2	53.9	157.2	-86.5	-31.1	0	0	0	111.8	G596	G596-N598 PolarHBondContact O-N 3.25Å
599	S	34.9	Very low	36.3	Very low	87 Å²	87	113.4 Å²	113.4	61%	0.608	62%	0.615	S	S	*	*			trans	-139.2	122	164.2	70.5	0	0	0	0	111.6	Y601	S599-Y601 PolarHBondContact O-N 2.98Å
600	N	31.8	Very low	35.8	Very low	173 Å²	173	117.9 Å²	117.9	93%	0.925	64%	0.636	S	S	*	*			trans	-87.1	46.8	-172.7	-158.7	3.1	0	0	0	112
601	Y	33.5	Very low	35.1	Very low	213 Å²	213	121.8 Å²	121.8	84%	0.835	66%	0.66	S	S	*	*			trans	-109.7	123.3	177.8	-94.3	-83.4	0	0	0	110.1	S599 D603	S599-Y601 PolarHBondContact O-N 2.98Å; Y601-D603 PolarHBondContact O-N 2.55Å
602	H	32	Very low	34.4	Very low	187 Å²	187	126.7 Å²	126.7	87%	0.866	68%	0.683	S	S	*	*			trans	-59.8	128.4	-177.6	-90.7	-44.5	0	0	0	113	M604	H602-M604 PolarHBondContact O-N 3.28Å
603	D	31.8	Very low	33.3	Very low	109 Å²	109	129.3 Å²	129.3	58%	0.583	71%	0.706	S	S	*	*			trans	-60.2	116.5	174.1	175.6	33.4	0	0	0	112.2	Y601 T605	Y601-D603 PolarHBondContact O-N 2.55Å; D603-T605 WeakPolarHBondContact OD1-CA 3.28Å; D603-T605 WeakPolarHBondContact OD1-CB 3.25Å; D603-T605 PolarHBondContact OD1-N 3.41Å; D603-T605 PolarHBondContact OD1-OG1 3.26Å
604	M	29.2	Very low	32.4	Very low	183 Å²	183	129.8 Å²	129.8	90%	0.901	71%	0.714	S	S	*	*			trans	-98.2	22.1	171.2	-70.6	-156.3	73.5	0	0	113.3	H602 K606	H602-M604 PolarHBondContact O-N 3.28Å; M604-K606 VanDerWaalsContact C-N 3.29Å; M604-K606 PolarHBondContact O-N 2.8Å
605	T	36.5	Very low	31.8	Very low	110 Å²	110	133.5 Å²	133.5	68%	0.675	73%	0.728	S	S	*	*			trans	-89.1	15.7	178.8	-36.1	0	0	0	0	113.1	D603 A607	D603-T605 WeakPolarHBondContact OD1-CA 3.28Å; D603-T605 WeakPolarHBondContact OD1-CB 3.25Å; D603-T605 PolarHBondContact OD1-N 3.41Å; D603-T605 PolarHBondContact OD1-OG1 3.26Å; T605-A607 PolarHBondContact O-N 2.97Å
606	K	29.4	Very low	31.3	Very low	184 Å²	184	140.5 Å²	140.5	80%	0.8	75%	0.751	S	S	*	*			trans	-73.3	55	164.6	-74.4	-171	177.4	177.8	0	112.6	M604 V608	M604-K606 VanDerWaalsContact C-N 3.29Å; M604-K606 PolarHBondContact O-N 2.8Å; K606-V608 PolarHBondContact O-N 2.76Å
607	A	30.7	Very low	31	Very low	94 Å²	94	145.4 Å²	145.4	78%	0.777	77%	0.765	S	S	*	*			trans	-74.4	55	165.3	0	0	0	0	0	111	T605	T605-A607 PolarHBondContact O-N 2.97Å
608	V	28.1	Very low	30.8	Very low	101 Å²	101	141.2 Å²	141.2	61%	0.612	76%	0.763	S	S	*	*			trans	-55.6	133.5	166	179	0	0	0	0	107.3	K606 L610	K606-V608 PolarHBondContact O-N 2.76Å; V608-L610 PolarHBondContact O-N 2.92Å
609	P	33.1	Very low	30.7	Very low	107 Å²	107	136.5 Å²	136.5	70%	0.695	75%	0.754	S	S	*	*			trans	-68.9	86.7	172.3	28.9	-34	0	0	0	109.1	T611	P609-T611 PolarHBondContact O-N 2.94Å
610	L	28.3	Very low	30.4	Very low	168 Å²	168	135.9 Å²	135.9	88%	0.88	76%	0.761	S	S	*	*			trans	-62.9	73.2	166.8	-83.8	174.2	0	0	0	109.4	V608 L612	V608-L610 PolarHBondContact O-N 2.92Å; L610-L612 PolarHBondContact O-N 3.28Å
611	T	32.9	Very low	30.4	Very low	88 Å²	88	136.4 Å²	136.4	54%	0.54	76%	0.758	S	S	.	*			trans	-73.6	110.7	163.3	-49.6	0	0	0	0	105.5	M1 P609 A613	M1-T611 HydrophobicContact CE-CG2 3.4Å; M1-T611 VanDerWaalsContact CE-CG2 3.4Å; P609-T611 PolarHBondContact O-N 2.94Å; T611-A613 PolarHBondContact O-N 3.23Å
612	L	27.1	Very low	30.4	Very low	164 Å²	164	133.6 Å²	133.6	86%	0.859	76%	0.758	S	S	*	*			trans	-68.5	74.7	171.6	-168.2	76.9	0	0	0	108.9	L610 S614	L610-L612 PolarHBondContact O-N 3.28Å; L612-S614 PolarHBondContact O-N 3.2Å
613	A	28.4	Very low	30.5	Very low	65 Å²	65	133 Å²	133	54%	0.537	76%	0.756	S	S	.	*			trans	-68.9	111.8	164.6	0	0	0	0	0	106.6	M1 T611 H615	M1-A613 HydrophobicContact CE-CB 4.37Å; T611-A613 PolarHBondContact O-N 3.23Å; A613-H615 PolarHBondContact O-N 3.31Å; A613-H615 VanDerWaalsContact O-N 3.09Å
614	S	29.3	Very low	30.5	Very low	101 Å²	101	137 Å²	137	71%	0.706	77%	0.77	S	S	*	*			trans	-54	116.9	-176.9	-52.2	0	0	0	0	110.6	L612 W616	L612-S614 PolarHBondContact O-N 3.2Å; S614-W616 VanDerWaalsContact C-N 3.27Å; S614-W616 PolarHBondContact O-N 3Å
615	H	30	Very low	30.5	Very low	173 Å²	173	131.3 Å²	131.3	80%	0.801	76%	0.759	S	S	*	*			trans	-67	94.1	159.1	-89.3	54.6	0	0	0	107.9	A613	A613-H615 PolarHBondContact O-N 3.31Å; A613-H615 VanDerWaalsContact O-N 3.09Å
616	W	28.3	Very low	30.1	Very low	239 Å²	239	131.5 Å²	131.5	91%	0.905	77%	0.765	S	S	*	*			trans	-88.8	126.2	140.6	-93	85.5	0	0	0	106.8	S614	S614-W616 VanDerWaalsContact C-N 3.27Å; S614-W616 PolarHBondContact O-N 3Å
617	I	29.4	Very low	30.2	Very low	147 Å²	147	128.5 Å²	128.5	75%	0.754	76%	0.762	S	S	*	*			trans	-78.7	125.4	-168.5	-62.7	168.3	0	0	0	108.9
618	A	29	Very low	30.1	Very low	102 Å²	102	131.5 Å²	131.5	84%	0.843	76%	0.764	S	S	*	*			trans	-146.4	39.6	168.6	0	0	0	0	0	110.1
619	G	30.5	Very low	30.3	Very low	71 Å²	71	130.1 Å²	130.1	73%	0.732	76%	0.758	S	S	*	*			trans	-83.2	118.5	159.2	0	0	0	0	0	107.3
620	G	28.6	Very low	30.4	Very low	74 Å²	74	132.3 Å²	132.3	76%	0.763	76%	0.76	S	S	*	*			trans	-109.5	122.9	171.3	0	0	0	0	0	108.8
621	E	32.6	Very low	30.8	Very low	185 Å²	185	129.7 Å²	129.7	86%	0.864	75%	0.746	S	S	*	*			trans	-133.7	111.9	164.8	-67.5	-178.1	169.1	0	0	105.2
622	D	33.7	Very low	31	Very low	153 Å²	153	133.3 Å²	133.3	82%	0.818	76%	0.757	S	S	*	*			trans	18.6	132.1	151.4	-42.5	-39.8	0	0	0	118.4
623	E	34	Very low	31.4	Very low	176 Å²	176	132.4 Å²	132.4	82%	0.822	75%	0.753	S	S	*	*				-164.1	162.1	61.9	-88.2	-169.2	151.2	0	0	115.2
624	E	31.6	Very low	31.7	Very low	191 Å²	191	133.1 Å²	133.1	89%	0.893	76%	0.759	S	S	*	*			trans	45.1	153.9	151.3	-61.8	-144.3	135.6	0	0	125.1
625	G	29.8	Very low	31.8	Very low	64 Å²	64	134.5 Å²	134.5	66%	0.66	76%	0.763	S	S	*	*			trans	100.8	54.2	148.3	0	0	0	0	0	118.7
626	S	28.3	Very low	31.9	Very low	115 Å²	115	132 Å²	132	80%	0.804	76%	0.76	S	S	*	*				84.6	171.4	85.2	79.8	0	0	0	0	115.4
627	V	30.6	Very low	31.9	Very low	121 Å²	121	129.7 Å²	129.7	73%	0.733	76%	0.756	S	S	*	*			trans	73.7	89.8	175.2	-177.4	0	0	0	0	116.4
628	L	29	Very low	31.9	Very low	157 Å²	157	127.5 Å²	127.5	82%	0.822	75%	0.749	S	S	*	*				80.8	144.3	106.9	-64.9	-171.8	0	0	0	115.6
629	S	30.9	Very low	32	Very low	71 Å²	71	132.6 Å²	132.6	50%	0.497	75%	0.753	S	S	.	*			cis	-168	169.5	-19	54.6	0	0	0	0	110.2
630	E	36.2	Very low	31.9	Very low	154 Å²	154	132.3 Å²	132.3	72%	0.72	75%	0.75	S	S	*	*			trans	63.2	144.7	152.8	-67.9	152.7	-107.5	0	0	118.1
631	N	36.5	Very low	32.3	Very low	112 Å²	112	134.9 Å²	134.9	60%	0.599	75%	0.753	S	S	*	*			cis	-142.6	146.9	-7.9	-101.5	-23.2	0	0	0	108
632	E	36.5	Very low	32	Very low	165 Å²	165	132.9 Å²	132.9	77%	0.771	75%	0.753	S	S	*	*				53.1	137.4	100.3	-52.4	-169	144.4	0	0	113.9
633	D	36.7	Very low	31.7	Very low	144 Å²	144	130 Å²	130	77%	0.77	75%	0.745	S	S	*	*			cis	-157.8	169.7	36.1	-157.4	-7.5	0	0	0	113.6
634	A	33.3	Very low	31.3	Very low	80 Å²	80	126.3 Å²	126.3	66%	0.661	74%	0.738	S	S	*	*			trans	65.7	136	153.1	0	0	0	0	0	120.1
635	V	32.8	Very low	31.1	Very low	130 Å²	130	123.7 Å²	123.7	79%	0.788	74%	0.735	S	S	*	*			cis	-158.4	145.5	-4.6	113.3	0	0	0	0	110.4
636	V	31.3	Very low	31	Very low	121 Å²	121	124.3 Å²	124.3	73%	0.733	73%	0.734	S	S	*	*			trans	40.4	104.4	154.7	-175	0	0	0	0	117.8
637	K	28	Very low	31.1	Very low	190 Å²	190	124.7 Å²	124.7	83%	0.826	74%	0.736	S	S	*	*			cis	75	138.8	33.7	-151.6	-175.3	-173.2	171.5	0	114.2
638	V	29.4	Very low	31.1	Very low	102 Å²	102	123.2 Å²	123.2	62%	0.618	74%	0.737	S	S	*	*			trans	116.5	115.2	145.7	-179	0	0	0	0	117.7
639	K	31.9	Very low	31.2	Very low	209 Å²	209	121.2 Å²	121.2	91%	0.909	74%	0.736	S	S	*	*			trans	53.5	155.9	152.8	-62.7	164.6	-166	173.9	0	117.5
640	G	27.3	Very low	31.3	Very low	65 Å²	65	121.8 Å²	121.8	67%	0.67	75%	0.754	S	S	*	*			cis	144.6	144.7	12.3	0	0	0	0	0	107.3
641	P	37.7	Very low	31.2	Very low	128 Å²	128	117.6 Å²	117.6	83%	0.831	75%	0.752	S	S	*	*			trans	-101.3	131.1	-155.2	35.8	-32.6	0	0	0	115.2
642	V	27.5	Very low	31.2	Very low	143 Å²	143	119 Å²	119	87%	0.867	76%	0.764	S	S	*	*			trans	-152.9	156	159.7	-117.6	0	0	0	0	113.9
643	S	26.4	Very low	31.1	Very low	93 Å²	93	114.1 Å²	114.1	65%	0.65	76%	0.758	S	S	*	*			trans	-29.9	152.4	172.6	52.9	0	0	0	0	122.2
644	S	26.2	Very low	31.1	Very low	97 Å²	97	113 Å²	113	68%	0.678	75%	0.752	S	S	*	*			trans	77.3	154.7	134	68.2	0	0	0	0	121.8
645	V	26.3	Very low	31.1	Very low	137 Å²	137	115.8 Å²	115.8	83%	0.83	75%	0.751	S	S	*	*			trans	57.6	150.2	162.6	-70.2	0	0	0	0	118.4
646	A	28.5	Very low	31	Very low	76 Å²	76	117.5 Å²	117.5	63%	0.628	75%	0.745	S	S	*	*			cis	-166.7	168.3	-20.4	0	0	0	0	0	109.8
647	S	29.3	Very low	30.9	Very low	123 Å²	123	118.5 Å²	118.5	86%	0.86	75%	0.746	S	S	*	*			trans	66.6	160.5	156.5	-57.1	0	0	0	0	116.6
648	A	31.3	Very low	30.9	Very low	90 Å²	90	112.5 Å²	112.5	74%	0.744	73%	0.732	S	S	*	*			cis	-152.3	168.5	-2.4	0	0	0	0	0	107.8
649	S	31.9	Very low	30.8	Very low	115 Å²	115	112.9 Å²	112.9	80%	0.804	74%	0.739	S	S	*	*			cis	-170.7	151.3	-4.4	43	0	0	0	0	109.4
650	G	32.6	Very low	30.6	Very low	84 Å²	84	109.2 Å²	109.2	87%	0.866	73%	0.729	S	S	*	*			trans	89.5	115.7	160.4	0	0	0	0	0	115.6
651	G	34.6	Very low	30.6	Very low	66 Å²	66	113.1 Å²	113.1	68%	0.68	73%	0.73	S	S	*	*			cis	150.3	161.9	-10	0	0	0	0	0	112.5
652	V	35.2	Very low	30	Very low	142 Å²	142	114.9 Å²	114.9	86%	0.861	73%	0.725	S	S	*	*			trans	61.9	126.7	173.9	-164.2	0	0	0	0	113.4
653	G	35.5	Very low	30	Very low	62 Å²	62	114 Å²	114	64%	0.639	72%	0.715	S	S	*	*			cis	134.3	162.4	15.9	0	0	0	0	0	108.7
654	D	37	Very low	29.9	Very low	121 Å²	121	117.4 Å²	117.4	65%	0.647	72%	0.718	S	S	*	*			cis	-155.6	152.8	-8	-80.8	-48.8	0	0	0	107.9
655	E	31.8	Very low	29.9	Very low	137 Å²	137	118.8 Å²	118.8	64%	0.64	72%	0.717	S	S	*	*			trans	60.2	160.4	137.3	-68.4	173.2	164.9	0	0	120.4
656	Y	31.9	Very low	30	Very low	167 Å²	167	119.2 Å²	119.2	66%	0.655	72%	0.715	S	S	*	*			cis	-150.8	153.4	-5.8	-122.5	-39.2	0	0	0	109.9
657	D	29	Very low	30	Very low	141 Å²	141	118.9 Å²	118.9	75%	0.754	72%	0.719	S	S	*	*			trans	49.1	169.8	138.8	-80.6	7.6	0	0	0	122.8
658	A	28.4	Very low	30.1	Very low	65 Å²	65	118.2 Å²	118.2	54%	0.537	71%	0.71	S	S	.	*			cis	-174.7	160.2	-40.5	0	0	0	0	0	107.7
659	S	26.7	Very low	30	Very low	110 Å²	110	120 Å²	120	77%	0.769	71%	0.707	S	S	*	*			trans	62.7	-177.4	165.2	91.2	0	0	0	0	112.6
660	N	26.7	Very low	30	Very low	132 Å²	132	120.3 Å²	120.3	71%	0.706	70%	0.699	S	S	*	*			cis	-159.3	174.5	-29.5	-123.4	-21.2	0	0	0	106.7
661	H	28.6	Very low	30.1	Very low	147 Å²	147	124.4 Å²	124.4	68%	0.681	70%	0.696	S	S	*	*			trans	49.2	124	146.4	-87.5	-110.5	0	0	0	122.1
662	F	24.8	Very low	29.8	Very low	164 Å²	164	128.5 Å²	128.5	72%	0.719	70%	0.701	S	S	*	*			trans	64.4	152.5	132.7	-89.4	-117.1	0	0	0	120.9
663	N	26.5	Very low	29.8	Very low	125 Å²	125	126.7 Å²	126.7	67%	0.668	69%	0.693	S	S	*	*			trans	65.6	155.9	149.9	-75.4	-20.8	0	0	0	117.1
664	K	26.1	Very low	29.5	Very low	164 Å²	164	131.5 Å²	131.5	71%	0.713	70%	0.698	S	S	*	*			cis	-173	154.6	-31.7	-124.1	-176.9	177.3	-179.8	0	105.8
665	L	25.8	Very low	28.9	Very low	126 Å²	126	131.8 Å²	131.8	66%	0.66	71%	0.709	S	S	*	*			trans	61.1	122.3	147.5	-63.2	171	0	0	0	120.7
666	N	27.7	Very low	28.9	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	71%	0.711	S	S	*	*			trans	76.7	149.1	131.8	-56.8	-2	0	0	0	118.6
667	G	29.8	Very low	28.8	Very low	68 Å²	68	126.5 Å²	126.5	70%	0.701	72%	0.722	S	S	*	*			trans	155.8	6.1	-168.8	0	0	0	0	0	116.1
668	T	29.9	Very low	28.9	Very low	109 Å²	109	123.7 Å²	123.7	67%	0.669	73%	0.726	S	S	*	*			trans	20.8	119.6	142.7	57.4	0	0	0	0	118.6
669	N	30.7	Very low	29.1	Very low	129 Å²	129	130.2 Å²	130.2	69%	0.69	75%	0.745	S	S	*	*				172.7	137.8	99.5	-90.2	-42.9	0	0	0	113.7
670	N	31.9	Very low	29.2	Very low	120 Å²	120	128 Å²	128	64%	0.642	74%	0.74	S	S	*	*			trans	55.2	137.7	141.5	-55.8	-25.8	0	0	0	120.8
671	Q	33.1	Very low	29.5	Very low	171 Å²	171	129.6 Å²	129.6	80%	0.799	75%	0.748	S	S	*	*			cis	-160.2	160.8	-4.7	-121.4	157.5	33.2	0	0	111
672	L	28	Very low	29.4	Very low	151 Å²	151	130.9 Å²	130.9	79%	0.791	76%	0.755	S	S	*	*			trans	-67.9	174.1	162.9	-84.5	118.4	0	0	0	110.9
673	P	35.1	Very low	29.8	Very low	105 Å²	105	129.4 Å²	129.4	68%	0.682	76%	0.759	S	S	*	*			cis	-142.7	162.1	21.1	34.2	-10.6	0	0	0	119.9
674	E	29.2	Very low	29.8	Very low	162 Å²	162	132.7 Å²	132.7	76%	0.757	77%	0.767	S	S	*	*			trans	64.9	123	131.8	-68.3	175.8	165.2	0	0	126.1
675	C	25.6	Very low	30	Very low	128 Å²	128	130.1 Å²	130.1	87%	0.865	77%	0.768	S	S	*	*				80.9	144.1	124.9	-67.7	0	0	0	0	123
676	G	30.8	Very low	30.1	Very low	66 Å²	66	135.8 Å²	135.8	68%	0.68	78%	0.78	S	S	*	*			trans	108.9	61.4	171.3	0	0	0	0	0	114.9
677	S	29.7	Very low	30.1	Very low	127 Å²	127	137.2 Å²	137.2	89%	0.888	79%	0.785	S	S	*	*				62.3	118.9	91.4	74.6	0	0	0	0	116.3
678	G	32	Very low	30.1	Very low	82 Å²	82	139.3 Å²	139.3	85%	0.845	79%	0.786	S	S	*	*			trans	159.3	112.3	171	0	0	0	0	0	112.7
679	E	31.4	Very low	29.9	Very low	201 Å²	201	139.8 Å²	139.8	94%	0.939	79%	0.793	S	S	*	*			trans	-89.9	158.8	-174	-61.6	178.2	115.4	0	0	114.2
680	G	30.4	Very low	29.9	Very low	64 Å²	64	142.7 Å²	142.7	66%	0.66	80%	0.803	S	S	*	*			trans	96.1	104.1	142.6	0	0	0	0	0	117.8
681	N	32.3	Very low	29.7	Very low	165 Å²	165	145.2 Å²	145.2	88%	0.882	82%	0.816	S	S	*	*				-165.2	160.1	105.1	-101.4	-68.9	0	0	0	112.1
682	E	27.2	Very low	29.6	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	81%	0.811	S	S	*	*			trans	-78.5	144	-168.2	-55.9	175.9	134.3	0	0	113.5
683	V	32.6	Very low	29.6	Very low	132 Å²	132	140.4 Å²	140.4	80%	0.8	81%	0.813	S	S	*	*			trans	-132.7	118.8	167.1	177.5	0	0	0	0	109.1	P685	V683-P685 WeakPolarHBondContact O-CD 3.35Å
684	F	26.8	Very low	29.5	Very low	194 Å²	194	142.1 Å²	142.1	85%	0.851	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-67.4	117.8	175.2	-86.5	-102.2	0	0	0	111.8
685	P	31.2	Very low	29.6	Very low	111 Å²	111	141.7 Å²	141.7	72%	0.721	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-88.1	152.1	170.3	-4.3	25.6	0	0	0	111.2	V683	V683-P685 WeakPolarHBondContact O-CD 3.35Å
686	R	26.2	Very low	30.1	Very low	245 Å²	245	140.9 Å²	140.9	93%	0.925	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.4	131.6	164.6	-65.7	177.2	176.9	-178.4	-0.4	109.3
687	M	29.1	Very low	30.1	Very low	177 Å²	177	143.7 Å²	143.7	87%	0.872	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-88.8	138	163.8	-79.7	-67	-176.4	0	0	110.9
688	P	29.5	Very low	30.2	Very low	111 Å²	111	147.2 Å²	147.2	72%	0.721	80%	0.8	S	S	*	*			trans	-82.4	178.5	176.4	35.5	-35.9	0	0	0	112.4
689	S	25.9	Very low	30.3	Very low	119 Å²	119	148.8 Å²	148.8	83%	0.832	78%	0.784	S	S	*	*			trans	-86.8	127.1	175.9	54.4	0	0	0	0	112.4
690	E	30.6	Very low	30.4	Very low	191 Å²	191	143.8 Å²	143.8	89%	0.893	77%	0.771	S	S	*	*			trans	-131.9	150.5	163.7	-69.4	-161.2	132.4	0	0	111.6
691	N	27.7	Very low	30.6	Very low	173 Å²	173	146.9 Å²	146.9	93%	0.925	77%	0.772	S	S	*	*			trans	-84.4	138.5	175.4	-65.5	-50.6	0	0	0	109.9
692	G	30	Very low	30.7	Very low	66 Å²	66	144.3 Å²	144.3	68%	0.68	77%	0.765	S	S	*	*			trans	-149.5	115.3	172.7	0	0	0	0	0	111.6
693	N	29.1	Very low	30.9	Very low	155 Å²	155	141.6 Å²	141.6	83%	0.829	76%	0.757	S	S	*	*			trans	-65.5	142.2	167.8	-69.6	-3.1	0	0	0	109.3
694	N	33.2	Very low	31.1	Very low	140 Å²	140	139.5 Å²	139.5	75%	0.749	75%	0.746	S	S	*	*			trans	-149.6	87.6	174.3	-102	-38.6	0	0	0	110.2	N696	N694-N696 PolarHBondContact O-N 2.87Å
695	D	31	Very low	31.6	Very low	154 Å²	154	137.2 Å²	137.2	82%	0.824	74%	0.742	S	S	*	*			trans	-71.6	92.4	175.9	-71.1	-66.8	0	0	0	111.5
696	N	35	Very low	31.7	Very low	111 Å²	111	140.3 Å²	140.3	59%	0.594	75%	0.749	S	S	*	*			trans	-103.9	87.3	176.2	-87.7	-68.7	0	0	0	111.4	N694 Y698	N694-N696 PolarHBondContact O-N 2.87Å; N696-Y698 VanDerWaalsContact C-N 3.29Å; N696-Y698 HydrophobicContact CB-CD2 4.13Å; N696-Y698 HydrophobicContact CB-CE2 4.15Å; N696-Y698 PolarHBondContact O-N 3.21Å
697	N	30.6	Very low	31.9	Very low	124 Å²	124	136.5 Å²	136.5	66%	0.663	75%	0.746	S	S	*	*			trans	-82.3	63	-172.4	-153.8	-4.8	0	0	0	112.3	K15 F699	K15-N697 PolarHBondContact NZ-OD1 3.47Å; N697-F699 PolarHBondContact O-N 3.14Å
698	Y	32.2	Very low	31.9	Very low	201 Å²	201	135.5 Å²	135.5	79%	0.788	75%	0.745	S	S	*	*			trans	-67.3	99.8	179	-84.1	-85.5	0	0	0	112.4	N696	N696-Y698 VanDerWaalsContact C-N 3.29Å; N696-Y698 HydrophobicContact CB-CD2 4.13Å; N696-Y698 HydrophobicContact CB-CE2 4.15Å; N696-Y698 PolarHBondContact O-N 3.21Å
699	F	35.3	Very low	32.1	Very low	116 Å²	116	135.9 Å²	135.9	51%	0.509	75%	0.75	S	S	.	*			trans	-85.7	130.8	164.8	-107.9	-84.7	0	0	0	110.4	K15 N697 N701	K15-F699 HydrophobicContact CD-CE2 3.83Å; K15-F699 HydrophobicContact CD-CZ 3.65Å; N697-F699 PolarHBondContact O-N 3.14Å; F699-N701 WeakPolarHBondContact CD1-OD1 3.3Å
700	C	33.7	Very low	32.4	Very low	96 Å²	96	139.7 Å²	139.7	65%	0.649	76%	0.755	S	S	*	*			trans	-107	102.8	158.1	-58.5	0	0	0	0	107.5	C702	C700-C702 PolarHBondContact O-N 2.94Å
701	N	32.8	Very low	32.4	Very low	129 Å²	129	142.2 Å²	142.2	69%	0.69	76%	0.756	S	S	*	*			trans	-76.1	105	168.8	-81.6	-8.7	0	0	0	109	F699	F699-N701 WeakPolarHBondContact CD1-OD1 3.3Å
702	C	34.9	Very low	32.5	Very low	110 Å²	110	139.4 Å²	139.4	74%	0.743	75%	0.745	S	S	*	*			trans	-92.9	89.1	163.5	-63.1	0	0	0	0	107.9	C700 P704	C700-C702 PolarHBondContact O-N 2.94Å; C702-P704 WeakPolarHBondContact O-CD 3.04Å
703	D	32.1	Very low	32.6	Very low	119 Å²	119	146 Å²	146	64%	0.636	76%	0.755	S	S	*	*			trans	-72.8	117.8	-178	-167.2	-2.6	0	0	0	110.8	N705	D703-N705 PolarHBondContact O-N 3.08Å
704	P	36.7	Very low	32.8	Very low	88 Å²	88	145.3 Å²	145.3	57%	0.571	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	37.9	-166	35	-39.1	0	0	0	114.8	C702	C702-P704 WeakPolarHBondContact O-CD 3.04Å
705	N	36.2	Very low	32.8	Very low	145 Å²	145	144.3 Å²	144.3	78%	0.775	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	-5.7	179.8	-88.7	-36.7	0	0	0	115.8	D703 L707	D703-N705 PolarHBondContact O-N 3.08Å; N705-L707 PolarHBondContact O-N 2.88Å
706	M	33.4	Very low	32.8	Very low	177 Å²	177	142.6 Å²	142.6	87%	0.872	75%	0.748	S	S	*	*			trans	-89.6	78.8	-179.3	-91.1	-70.2	164.7	0	0	113
707	L	31.4	Very low	32.7	Very low	164 Å²	164	140.7 Å²	140.7	86%	0.859	76%	0.755	S	S	*	*			trans	-147.6	38.6	172.6	-131	170.1	0	0	0	113.9	N705	N705-L707 PolarHBondContact O-N 2.88Å
708	N	29.7	Very low	32.9	Very low	157 Å²	157	142.3 Å²	142.3	84%	0.84	76%	0.764	S	S	*	*			trans	-154.5	74.8	170.9	-139.1	2.7	0	0	0	114.2
709	S	31.7	Very low	33	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	76%	0.762	S	S	*	*			trans	-169.7	94.9	158.3	-88	0	0	0	0	111.7
710	Q	32.5	Very low	32.9	Very low	200 Å²	200	139.7 Å²	139.7	94%	0.935	77%	0.773	S	S	*	*			trans	-91.9	109.8	156.8	-72.9	-174.6	-5.4	0	0	108.3
711	R	30.9	Very low	32.9	Very low	243 Å²	243	142.8 Å²	142.8	92%	0.917	78%	0.775	S	S	*	*			trans	-118.6	140.9	156.6	-80.6	-164.1	177.5	-162.7	1.7	109.4
712	V	29.8	Very low	33	Very low	114 Å²	114	142.3 Å²	142.3	69%	0.691	77%	0.772	S	S	*	*			trans	-80.2	137.3	-170.4	177.7	0	0	0	0	110.3	Q714	V712-Q714 HydrophobicContact CG1-CG 4.23Å
713	F	31.5	Very low	33	Very low	206 Å²	206	144.3 Å²	144.3	90%	0.904	78%	0.781	S	S	*	*			trans	-133.2	134.5	153.3	-99.2	-84.8	0	0	0	109.5
714	Q	33.4	Very low	33	Very low	140 Å²	140	142.3 Å²	142.3	65%	0.654	79%	0.789	S	S	*	*			trans	-105.2	146.5	173.6	-65.7	-178	-6.2	0	0	109.2	V712	V712-Q714 HydrophobicContact CG1-CG 4.23Å
715	P	34.2	Very low	32.9	Very low	118 Å²	118	144.4 Å²	144.4	77%	0.766	81%	0.806	S	S	*	*			trans	-83.6	125.1	-177.6	31.7	-33.2	0	0	0	113
716	S	30.5	Very low	32.8	Very low	118 Å²	118	141.6 Å²	141.6	83%	0.825	81%	0.811	S	S	*	*			trans	31.7	121.7	142.6	59	0	0	0	0	120.3
717	G	34.2	Very low	32.7	Very low	72 Å²	72	137.8 Å²	137.8	74%	0.742	80%	0.801	S	S	*	*			trans	-164	64.3	169.6	0	0	0	0	0	114.8
718	D	33.6	Very low	32.7	Very low	158 Å²	158	140.6 Å²	140.6	85%	0.845	80%	0.802	S	S	*	*			trans	51.3	160	155.1	-57.4	-35.3	0	0	0	123.7
719	V	34.8	Very low	32.8	Very low	126 Å²	126	139.3 Å²	139.3	76%	0.764	79%	0.791	S	S	*	*			trans	84.6	88.4	158.7	-162.2	0	0	0	0	119.6
720	N	33.1	Very low	32.9	Very low	136 Å²	136	141 Å²	141	73%	0.727	79%	0.786	S	S	*	*			trans	72.4	121.4	135	-74.4	-28.2	0	0	0	123.9
721	K	34.4	Very low	33.2	Very low	161 Å²	161	136 Å²	136	70%	0.7	77%	0.771	S	S	*	*				92.1	114.5	123	-74.6	-173.3	166.1	-133	0	123.1
722	D	34.1	Very low	33.2	Very low	118 Å²	118	132.9 Å²	132.9	63%	0.631	77%	0.767	S	S	*	*				79.6	107	120.8	-55.1	-15.9	0	0	0	121.8
723	V	33.9	Very low	33.4	Very low	152 Å²	152	131.4 Å²	131.4	92%	0.921	76%	0.761	S	S	*	*			trans	70.9	129.1	132.7	-178.5	0	0	0	0	120.1
724	G	34	Very low	33.6	Very low	78 Å²	78	128 Å²	128	80%	0.804	75%	0.752	S	S	*	*			trans	160.1	98.1	160.2	0	0	0	0	0	114.1
725	S	33.8	Very low	33.8	Very low	132 Å²	132	129.3 Å²	129.3	92%	0.923	76%	0.759	S	S	*	*			trans	-103.6	153.6	175.7	50.7	0	0	0	0	112.4
726	G	34.7	Very low	33.7	Very low	85 Å²	85	129.6 Å²	129.6	88%	0.876	75%	0.754	S	S	*	*			trans	174.4	111	173.2	0	0	0	0	0	114.1
727	S	31.1	Very low	34	Very low	97 Å²	97	129.4 Å²	129.4	68%	0.678	75%	0.753	S	S	*	*			trans	-124.5	144.6	173.6	54.1	0	0	0	0	109.7
728	Y	31.2	Very low	34	Very low	223 Å²	223	129.3 Å²	129.3	88%	0.875	75%	0.751	S	S	*	*			trans	-162.3	171.1	154.4	-92.2	-58.4	0	0	0	110.6
729	Q	31.3	Very low	34.1	Very low	130 Å²	130	129.2 Å²	129.2	61%	0.607	75%	0.746	S	S	*	*			trans	-115.8	-143.1	-173.5	-43.2	82.7	-113.1	0	0	111.3
730	E	33.8	Very low	34	Very low	154 Å²	154	132.9 Å²	132.9	72%	0.72	75%	0.746	S	S	*	*			cis	-138.4	-146	15.4	-143.1	87.9	-112.1	0	0	109.3
731	P	38.5	Very low	33.9	Very low	95 Å²	95	130.5 Å²	130.5	62%	0.617	74%	0.74	S	S	*	*			trans	-130.1	-163.8	-150.5	43.4	-21.2	0	0	0	116.3
732	E	32.5	Very low	33.7	Very low	177 Å²	177	128 Å²	128	83%	0.827	74%	0.743	S	S	*	*			trans	68.4	154.7	153.1	-79	166.5	-153.9	0	0	118.5
733	S	33.3	Very low	33.6	Very low	83 Å²	83	128 Å²	128	58%	0.58	75%	0.747	S	S	*	*			cis	-162.9	179.4	-10.1	48.9	0	0	0	0	111.9
734	D	36.1	Very low	33.3	Very low	134 Å²	134	127.3 Å²	127.3	72%	0.717	74%	0.738	S	S	*	*			trans	82.8	133	145.9	-59.8	-37.3	0	0	0	125.5
735	E	36.1	Very low	33.1	Very low	168 Å²	168	129.8 Å²	129.8	79%	0.785	74%	0.737	S	S	*	*			trans	67.9	146.4	136.2	-78.1	-150.8	-141.8	0	0	123.1
736	N	33	Very low	33.3	Very low	125 Å²	125	128 Å²	128	67%	0.668	72%	0.722	S	S	*	*			cis	-166.6	175	-15.6	-152.9	-21.9	0	0	0	111.9
737	S	36.3	Very low	33.2	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	72%	0.717	S	S	*	*			trans	82.1	150.7	152.3	80.2	0	0	0	0	121.7
738	G	35.1	Very low	33.1	Very low	69 Å²	69	135.8 Å²	135.8	71%	0.711	72%	0.721	S	S	*	*			trans	104.2	81.1	176.2	0	0	0	0	0	114.7
739	E	34.7	Very low	33.3	Very low	156 Å²	156	131.2 Å²	131.2	73%	0.729	72%	0.717	S	S	*	*				53.6	132.3	82.6	-70.4	-133.5	114	0	0	116
740	R	33	Very low	33.8	Very low	203 Å²	203	130.8 Å²	130.8	77%	0.766	73%	0.725	S	S	*	*			cis	-165.1	143.1	-11.2	-148.8	-172.5	-177.1	133.1	-12.1	110.6
741	S	31.9	Very low	33.8	Very low	87 Å²	87	127 Å²	127	61%	0.608	73%	0.728	S	S	*	*			trans	40.1	124.9	147.8	60.6	0	0	0	0	123.6
742	S	30.4	Very low	33.5	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	74%	0.74	S	S	*	*				75.2	159.9	129.4	84.9	0	0	0	0	119.1
743	V	30.5	Very low	33.6	Very low	119 Å²	119	131.9 Å²	131.9	72%	0.721	74%	0.736	S	S	*	*			cis	-167.6	156.4	-14	123.5	0	0	0	0	110.1
744	N	29.3	Very low	33.4	Very low	137 Å²	137	132 Å²	132	73%	0.733	74%	0.737	S	S	*	*			trans	63.7	105.6	159.1	-80.2	-6.3	0	0	0	124
745	V	28.9	Very low	33.2	Very low	129 Å²	129	132.7 Å²	132.7	78%	0.782	74%	0.739	S	S	*	*			trans	52.3	-159.1	136.7	-122.9	0	0	0	0	118
746	P	37.8	Very low	32.9	Very low	94 Å²	94	129.7 Å²	129.7	61%	0.61	74%	0.737	S	S	*	*				-110.4	-159.6	-66.9	22.8	-2.6	0	0	0	114.5
747	Y	31.8	Very low	32.7	Very low	198 Å²	198	127.9 Å²	127.9	78%	0.776	73%	0.734	S	S	*	*			trans	81.5	136.8	173.6	-61.6	-90.5	0	0	0	116.1
748	I	30.5	Very low	32.5	Very low	149 Å²	149	129.9 Å²	129.9	76%	0.764	73%	0.731	S	S	*	*			cis	95.2	141.8	32.1	-64.9	167.4	0	0	0	113.3
749	T	35.1	Very low	32.4	Very low	127 Å²	127	133.9 Å²	133.9	78%	0.779	73%	0.731	S	S	*	*			trans	-90.3	158.9	-163.5	38.4	0	0	0	0	116.8
750	P	41.7	Very low	32.3	Very low	121 Å²	121	131.4 Å²	131.4	79%	0.786	73%	0.727	S	S	*	*			trans	-102.5	166	135.7	-0.7	22.1	0	0	0	110.4
751	G	34	Very low	32.1	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	73%	0.732	S	S	*	*			cis	95.4	139.4	15.3	0	0	0	0	0	111.7
752	R	32.1	Very low	32.2	Very low	228 Å²	228	132.2 Å²	132.2	86%	0.86	74%	0.743	S	S	*	*			cis	-170.7	178.7	-6.5	-166.3	-175.2	-173.7	-162.6	4	107.1
753	L	33.2	Very low	32.2	Very low	145 Å²	145	136.1 Å²	136.1	76%	0.759	75%	0.749	S	S	*	*			trans	79.7	167	163.6	-50.8	172.6	0	0	0	117.3
754	S	30	Very low	32.4	Very low	85 Å²	85	137.5 Å²	137.5	59%	0.594	76%	0.757	S	S	*	*				179.2	170.7	-67.5	52.8	0	0	0	0	111.5
755	I	32.8	Very low	32.6	Very low	150 Å²	150	139.6 Å²	139.6	77%	0.769	76%	0.763	S	S	*	*			trans	81.5	120.4	169.9	-52.1	163.8	0	0	0	112.3
756	S	28.5	Very low	32.9	Very low	104 Å²	104	139.2 Å²	139.2	73%	0.727	77%	0.766	S	S	*	*				72.5	143.6	67.1	132.4	0	0	0	0	113.8
757	S	29.4	Very low	32.8	Very low	88 Å²	88	138 Å²	138	62%	0.615	77%	0.771	S	S	*	*			cis	-169	-179.2	-2	53.4	0	0	0	0	112.6
758	Q	31.7	Very low	32.8	Very low	156 Å²	156	134.2 Å²	134.2	73%	0.729	77%	0.773	S	S	*	*			trans	81.6	134.6	148.6	-79	177.3	7.2	0	0	123
759	H	33.4	Very low	32.9	Very low	152 Å²	152	131.5 Å²	131.5	70%	0.704	77%	0.767	S	S	*	*			trans	65.5	156.5	142.5	-68.8	-46	0	0	0	120.1
760	T	31.8	Very low	32.7	Very low	105 Å²	105	135.7 Å²	135.7	64%	0.644	77%	0.768	S	S	*	*			cis	-159.7	139.6	2.7	9.8	0	0	0	0	111.9
761	Y	30.2	Very low	32.3	Very low	226 Å²	226	138.1 Å²	138.1	89%	0.886	77%	0.768	S	S	*	*			trans	57	151.7	143.1	-76.2	-117.8	0	0	0	123
762	G	34.1	Very low	32.3	Very low	81 Å²	81	141.6 Å²	141.6	84%	0.835	77%	0.77	S	S	*	*			trans	151.4	93.9	162.9	0	0	0	0	0	115.3
763	E	29.1	Very low	32.1	Very low	190 Å²	190	138 Å²	138	89%	0.888	77%	0.767	S	S	*	*			trans	-101.1	147.9	178.3	-61.5	171.4	115.5	0	0	112.8
764	V	35.8	Very low	32.2	Very low	147 Å²	147	138.1 Å²	138.1	89%	0.891	77%	0.767	S	S	*	*			trans	-146	143.4	146.5	-169.3	0	0	0	0	109.4
765	E	32.4	Very low	32.1	Very low	182 Å²	182	141.4 Å²	141.4	85%	0.85	78%	0.778	S	S	*	*			trans	-80.6	-178.3	-177.4	-49.8	173.2	102.1	0	0	112.3
766	S	35.8	Very low	32.1	Very low	120 Å²	120	139 Å²	139	84%	0.839	78%	0.775	S	S	*	*			cis	-170.5	171.7	28.3	52.7	0	0	0	0	112.9
767	G	35.3	Very low	32.2	Very low	70 Å²	70	143.7 Å²	143.7	72%	0.722	78%	0.782	S	S	*	*			trans	98.7	86.9	166.1	0	0	0	0	0	115.5
768	S	33	Very low	32.4	Very low	117 Å²	117	142.9 Å²	142.9	82%	0.818	79%	0.788	S	S	*	*				61.8	124	72	-154.7	0	0	0	0	112.9
769	C	32.2	Very low	32.5	Very low	93 Å²	93	141.6 Å²	141.6	63%	0.628	79%	0.786	S	S	*	*			cis	-160.4	141.6	48.8	-146.1	0	0	0	0	114.9
770	R	31.4	Very low	32.6	Very low	215 Å²	215	145.3 Å²	145.3	81%	0.811	79%	0.793	S	S	*	*			trans	46.7	111.2	141	-70.7	175.7	-171.2	170.7	1.9	120.2
771	H	33	Very low	32.7	Very low	171 Å²	171	143.8 Å²	143.8	79%	0.792	80%	0.799	S	S	*	*				91.6	116.1	72.1	-90	43	0	0	0	114.3
772	N	33.5	Very low	32.8	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	79%	0.792	S	S	*	*				-174.8	136.7	107.7	-96.4	-17.5	0	0	0	112.3
773	N	28.7	Very low	32.7	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	79%	0.79	S	S	*	*			trans	-122.6	127.9	175.1	-138.9	-5.1	0	0	0	106.6
774	I	34.1	Very low	32.8	Very low	149 Å²	149	140.7 Å²	140.7	76%	0.764	79%	0.786	S	S	*	*			trans	-133.3	107.4	171.6	-61.7	-176.5	0	0	0	109.5
775	N	28.3	Very low	32.7	Very low	153 Å²	153	143.4 Å²	143.4	82%	0.818	79%	0.786	S	S	*	*			trans	-80.7	136	159.7	-73.5	-44.8	0	0	0	109
776	S	32	Very low	32.7	Very low	101 Å²	101	142.2 Å²	142.2	71%	0.706	79%	0.785	S	S	*	*			trans	-156.4	104.3	157.1	-165.4	0	0	0	0	114.5
777	F	31.7	Very low	32.5	Very low	202 Å²	202	141 Å²	141	89%	0.886	78%	0.776	S	S	*	*			trans	24.6	130.1	140.6	-70	-87.7	0	0	0	123
778	G	32.6	Very low	32.4	Very low	70 Å²	70	144.8 Å²	144.8	72%	0.722	78%	0.775	S	S	*	*			trans	97.4	151.9	141.6	0	0	0	0	0	116
779	N	34.4	Very low	32.3	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	77%	0.773	S	S	*	*			cis	-155.6	146.7	0.5	-124.3	-37.7	0	0	0	110.5
780	R	34.9	Very low	32.3	Very low	230 Å²	230	145.7 Å²	145.7	87%	0.868	78%	0.775	S	S	*	*			trans	37.9	122.2	148.8	-58.7	159.8	-158.1	-154.7	-0.9	119.9
781	G	34	Very low	32.3	Very low	74 Å²	74	147.1 Å²	147.1	76%	0.763	78%	0.78	S	S	*	*			trans	-174.9	72.1	165.1	0	0	0	0	0	117.8	A783	G781-A783 PolarHBondContact O-N 3.47Å
782	V	33.6	Very low	32.2	Very low	122 Å²	122	149.4 Å²	149.4	74%	0.739	78%	0.782	S	S	*	*			trans	24	95.1	152.7	-169.8	0	0	0	0	116
783	A	31.3	Very low	32.3	Very low	95 Å²	95	151.8 Å²	151.8	79%	0.785	79%	0.788	S	S	*	*				54	89.3	52.6	0	0	0	0	0	115.3	G781	G781-A783 PolarHBondContact O-N 3.47Å
784	R	31.6	Very low	32.4	Very low	215 Å²	215	155.5 Å²	155.5	81%	0.811	79%	0.791	S	S	*	*			trans	-154.6	108.4	152.4	-147	171.8	-75.1	-168.3	-2.1	113.5
785	K	32.3	Very low	32.4	Very low	204 Å²	204	152.5 Å²	152.5	89%	0.887	79%	0.788	S	S	*	*			trans	-67.2	140	153.1	-73.1	178.6	175.9	177.8	0	107.9
786	L	32.4	Very low	32.7	Very low	157 Å²	157	152 Å²	152	82%	0.822	79%	0.785	S	S	*	*			trans	-142.3	112.8	150.6	-90.1	-177.9	0	0	0	110.3
787	S	32.3	Very low	32.7	Very low	94 Å²	94	152.2 Å²	152.2	66%	0.657	78%	0.784	S	S	*	*			trans	-101.6	148	165.8	51.8	0	0	0	0	109.3
788	Q	32.5	Very low	32.9	Very low	150 Å²	150	150 Å²	150	70%	0.701	78%	0.776	S	S	*	*			trans	67.7	147.3	178.1	-53.2	171	-9.3	0	0	114.5	L384	L384-Q788 PolarHBondContact O-OE1 3.48Å
789	G	31.6	Very low	32.7	Very low	75 Å²	75	156.1 Å²	156.1	77%	0.773	78%	0.779	S	S	*	*			trans	155.6	82.2	-179.6	0	0	0	0	0	113.9
790	F	31.1	Very low	32.5	Very low	154 Å²	154	157.1 Å²	157.1	68%	0.675	78%	0.784	S	S	*	*			trans	-60	134.5	174.1	-84.3	-113.8	0	0	0	112.5	F386	F386-F790 WeakPolarHBondContact O-CE1 3.46Å; F386-F790 WeakPolarHBondContact O-CZ 3.45Å
791	R	32.4	Very low	32.3	Very low	244 Å²	244	152 Å²	152	92%	0.921	78%	0.778	S	S	*	*				-164.9	136.1	122.6	-110.8	167.7	-178.3	-179.2	-0.1	113.2
792	R	30.4	Very low	31.9	Very low	219 Å²	219	153.2 Å²	153.2	83%	0.826	78%	0.775	S	S	*	*			trans	-76.1	143	159.8	-68.8	172.5	170.4	159.8	-4.4	108.6
793	Q	36.8	Very low	31.9	Very low	199 Å²	199	154.9 Å²	154.9	93%	0.93	78%	0.775	S	S	*	*			trans	-112.5	149.9	144.6	-80.9	-173.7	-22.7	0	0	109.4
794	R	29.9	Very low	31.8	Very low	229 Å²	229	154.4 Å²	154.4	86%	0.864	77%	0.766	S	S	*	*			trans	-121.7	176.9	-178.3	-106.9	-178.8	169.6	179.9	-4.3	107.6
795	A	34.6	Very low	32.1	Very low	86 Å²	86	152 Å²	152	71%	0.711	76%	0.761	S	S	*	*			trans	79.4	146.3	-179.3	0	0	0	0	0	113.7
796	L	34.1	Very low	32.1	Very low	142 Å²	142	149.2 Å²	149.2	74%	0.743	76%	0.755	S	S	*	*			cis	-114.5	139.5	6.8	-75.5	160.2	0	0	0	113.4	Q798	L796-Q798 HydrophobicContact CD2-CG 4.34Å
797	P	31.8	Very low	32.1	Very low	106 Å²	106	149.1 Å²	149.1	69%	0.688	76%	0.755	S	S	*	*			trans	-114.9	111.4	147.5	33.6	-22.6	0	0	0	110
798	Q	36.4	Very low	32.1	Very low	155 Å²	155	149.8 Å²	149.8	72%	0.724	76%	0.757	S	S	*	*			trans	-138.2	123.1	169.6	-69.8	-176.8	-17	0	0	107.4	L796	L796-Q798 HydrophobicContact CD2-CG 4.34Å
799	Y	29.1	Very low	32	Very low	200 Å²	200	144.5 Å²	144.5	78%	0.784	74%	0.736	S	S	*	*				91.8	116.8	51	-89.7	-61.8	0	0	0	112.2
800	L	29	Very low	32	Very low	150 Å²	150	151.3 Å²	151.3	79%	0.785	74%	0.74	S	S	*	*			trans	68.8	155.6	154	-51.4	168	0	0	0	115.4
801	T	30.4	Very low	32.1	Very low	123 Å²	123	147.1 Å²	147.1	76%	0.755	74%	0.74	S	S	*	*			cis	-147.3	172.3	-3.3	-11.7	0	0	0	0	111.7
802	S	26.7	Very low	32	Very low	99 Å²	99	143 Å²	143	69%	0.692	74%	0.735	S	S	*	*			trans	-65	139.6	175	50.9	0	0	0	0	116.9
803	E	34.4	Very low	32.1	Very low	156 Å²	156	138.6 Å²	138.6	73%	0.729	74%	0.735	S	S	*	*				-152.1	129.9	124.2	-86.2	-157.2	120.5	0	0	106.5	K805	E803-K805 IonicContact OE1-NZ 3.99Å; E803-K805 PolarHBondContact OE1-NZ 3.3Å
804	S	29.1	Very low	31.7	Very low	86 Å²	86	135.3 Å²	135.3	60%	0.601	73%	0.728	S	S	*	*			cis	81.7	90.2	24.8	86.4	0	0	0	0	116.5
805	K	35.8	Very low	31.7	Very low	164 Å²	164	128.9 Å²	128.9	71%	0.713	72%	0.724	S	S	*	*			trans	-165.2	122.8	138.3	-95.9	131.7	-164.5	157.3	0	112.8	E803	E803-K805 IonicContact OE1-NZ 3.99Å; E803-K805 PolarHBondContact OE1-NZ 3.3Å
806	L	32.8	Very low	31.5	Very low	145 Å²	145	133.4 Å²	133.4	76%	0.759	73%	0.728	S	S	*	*			trans	45.9	112.7	133.2	-48.6	176.5	0	0	0	118.7
807	L	32.2	Very low	31.3	Very low	155 Å²	155	133.9 Å²	133.9	81%	0.812	73%	0.726	S	S	*	*				74.2	151.9	75.5	-75.1	178.1	0	0	0	114.8
808	P	33.9	Very low	31.1	Very low	108 Å²	108	133.8 Å²	133.8	70%	0.701	73%	0.728	S	S	*	*			cis	-126.6	-174.1	2.7	42.1	-27.1	0	0	0	115.1
809	S	28.6	Very low	30.7	Very low	39 Å²	39	131.1 Å²	131.1	27%	0.273	73%	0.725	S	S	.	*			trans	-111.2	132.2	177.4	54.5	0	0	0	0	113.5
810	Y	32.5	Very low	30.7	Very low	219 Å²	219	127.5 Å²	127.5	86%	0.859	72%	0.719	S	S	*	*			trans	-153	150.8	160.2	-74.6	-85.3	0	0	0	107.2
811	G	32.4	Very low	30.6	Very low	65 Å²	65	125 Å²	125	67%	0.67	71%	0.71	S	S	*	*			cis	175.5	141.3	-5	0	0	0	0	0	109
812	I	30.7	Very low	30.6	Very low	159 Å²	159	123.9 Å²	123.9	82%	0.815	70%	0.699	S	S	*	*			trans	-83.7	145.1	-175	-41.2	173.7	0	0	0	109.8	T814	I812-T814 HydrophobicContact CG2-CG2 4.47Å
813	P	32.7	Very low	31	Very low	126 Å²	126	123.9 Å²	123.9	82%	0.818	70%	0.699	S	S	*	*				-136.7	150.6	116.2	36.3	-25.8	0	0	0	114.5
814	T	29.5	Very low	31.1	Very low	130 Å²	130	122 Å²	122	80%	0.798	70%	0.701	S	S	*	*			trans	-85.4	142.1	174.4	51.3	0	0	0	0	112.1	I812	I812-T814 HydrophobicContact CG2-CG2 4.47Å
815	A	29.9	Very low	31.2	Very low	94 Å²	94	123 Å²	123	78%	0.777	70%	0.703	S	S	*	*			trans	-162.4	148.9	142.6	0	0	0	0	0	113.9
816	K	29.3	Very low	30.7	Very low	180 Å²	180	120.4 Å²	120.4	78%	0.783	70%	0.704	S	S	*	*			trans	-15	154.7	145.8	-58.1	159.5	173.2	-167.6	0	116
817	E	30.5	Very low	30.4	Very low	153 Å²	153	119.8 Å²	119.8	72%	0.715	70%	0.701	S	S	*	*			cis	-164.8	147.6	31	-143.4	142.6	-117.1	0	0	112.5
818	S	27.9	Very low	30.2	Very low	104 Å²	104	119.9 Å²	119.9	73%	0.727	70%	0.695	S	S	*	*			trans	47.3	159.1	142.6	90.7	0	0	0	0	122.1
819	C	28	Very low	29.8	Very low	99 Å²	99	119.3 Å²	119.3	67%	0.669	69%	0.693	S	S	*	*			cis	-159.2	145.3	12.5	-138.3	0	0	0	0	111.9
820	L	28.1	Very low	29.8	Very low	123 Å²	123	126.2 Å²	126.2	64%	0.644	72%	0.719	S	S	*	*			trans	49.3	116.9	145.7	-60.8	170.6	0	0	0	120.8
821	V	28.1	Very low	29.5	Very low	98 Å²	98	124.3 Å²	124.3	59%	0.594	72%	0.715	S	S	*	*				68.9	113.8	73.8	169.4	0	0	0	0	113.9
822	N	30.6	Very low	29.3	Very low	99 Å²	99	125.6 Å²	125.6	53%	0.529	71%	0.714	S	S	.	*				175.9	157.6	117.2	-100.3	-41.1	0	0	0	113.3	N545	N545-N822 WeakPolarHBondContact O-CB 3.43Å; N545-N822 PolarHBondContact O-ND2 2.77Å
823	S	34.5	Very low	29.4	Very low	99 Å²	99	124.8 Å²	124.8	69%	0.692	71%	0.711	S	S	*	*			trans	-133.3	149	165.5	59.1	0	0	0	0	110.5
824	P	36.8	Very low	29.2	Very low	118 Å²	118	125.6 Å²	125.6	77%	0.766	71%	0.708	S	S	*	*			trans	-131.1	148.5	136.1	33.6	-21.7	0	0	0	110.9
825	T	30.2	Very low	29.3	Very low	107 Å²	107	126.5 Å²	126.5	66%	0.656	71%	0.708	S	S	*	*			cis	79.3	115.8	39.2	-45.8	0	0	0	0	113.6
826	C	26.7	Very low	29.2	Very low	108 Å²	108	127.9 Å²	127.9	73%	0.73	70%	0.703	S	S	*	*			trans	71.3	160.1	155.3	-83.2	0	0	0	0	118.6
827	L	26.5	Very low	29.2	Very low	133 Å²	133	125 Å²	125	70%	0.696	70%	0.696	S	S	*	*			cis	-152.6	156.4	2.9	-101	141.1	0	0	0	112.4
828	K	26.4	Very low	29	Very low	157 Å²	157	128 Å²	128	68%	0.683	70%	0.701	S	S	*	*			trans	24.8	144.9	147.4	-63.3	171.9	-171.1	171.5	0	124.9
829	S	25.1	Very low	29	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	70%	0.696	S	S	*	*			trans	61	149.6	140.6	55.7	0	0	0	0	119.3
830	F	29.9	Very low	29	Very low	185 Å²	185	129.3 Å²	129.3	81%	0.811	70%	0.696	S	S	*	*			cis	-125.4	153.4	27.1	-81	-110.2	0	0	0	111.5
831	K	26.8	Very low	29.1	Very low	178 Å²	178	134.5 Å²	134.5	77%	0.774	71%	0.707	S	S	*	*				49.6	101	74.8	-88.1	-165.8	174	-165.1	0	112.4
832	S	26.7	Very low	29.2	Very low	92 Å²	92	135.1 Å²	135.1	64%	0.643	72%	0.716	S	S	*	*				83.1	153.2	100.5	78	0	0	0	0	110.8
833	D	32.4	Very low	29.3	Very low	142 Å²	142	133.5 Å²	133.5	76%	0.759	72%	0.723	S	S	*	*			cis	-128.7	-163.6	28.8	-61.1	-53	0	0	0	114.2
834	N	29.1	Very low	29.2	Very low	143 Å²	143	134 Å²	134	77%	0.765	73%	0.726	S	S	*	*			trans	-66	169.2	167.1	-44.7	-62.8	0	0	0	109.4
835	D	32.7	Very low	29	Very low	149 Å²	149	135.3 Å²	135.3	80%	0.797	73%	0.727	S	S	*	*				-162.4	-174.9	75.8	-125.7	-46.6	0	0	0	115.3
836	N	28.1	Very low	29.2	Very low	124 Å²	124	137.9 Å²	137.9	66%	0.663	74%	0.736	S	S	*	*			trans	-96.6	167.9	-159.7	-65.4	-92.6	0	0	0	116
837	N	28.1	Very low	29.4	Very low	120 Å²	120	139.5 Å²	139.5	64%	0.642	73%	0.734	S	S	*	*			trans	85.2	119.5	144.9	-71.4	-13.8	0	0	0	123.4
838	W	26.7	Very low	29.9	Very low	215 Å²	215	139.2 Å²	139.2	81%	0.814	74%	0.74	S	S	*	*				77.7	152.2	122	-68.6	24	0	0	0	119.1
839	I	27.3	Very low	30.1	Very low	121 Å²	121	138.7 Å²	138.7	62%	0.621	74%	0.74	S	S	*	*			cis	-157.3	155.3	-13.2	-118.6	-178.8	0	0	0	113
840	T	29.5	Very low	30.4	Very low	109 Å²	109	143.5 Å²	143.5	67%	0.669	75%	0.75	S	S	*	*			trans	3.7	148.3	165.4	71	0	0	0	0	125.3
841	R	28.3	Very low	30.8	Very low	232 Å²	232	140.1 Å²	140.1	88%	0.875	75%	0.746	S	S	*	*				141	149.9	128.5	-81.2	-174.3	-172.8	-151.9	2.2	112.7
842	S	31	Very low	30.9	Very low	112 Å²	112	139 Å²	139	78%	0.783	75%	0.747	S	S	*	*			cis	-172.7	152.2	-18.5	49.3	0	0	0	0	111.6
843	G	33.8	Very low	31.4	Very low	65 Å²	65	140.2 Å²	140.2	67%	0.67	75%	0.753	S	S	*	*			trans	121.4	114.7	173.6	0	0	0	0	0	112.5
844	S	31.9	Very low	31.3	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	76%	0.76	S	S	*	*				69.8	122.6	79.9	65.2	0	0	0	0	112.6
845	D	32.6	Very low	31.6	Very low	145 Å²	145	141.7 Å²	141.7	78%	0.775	76%	0.76	S	S	*	*			cis	-158.8	165.5	29.1	-115.9	-41.3	0	0	0	116.4
846	L	33.3	Very low	31.6	Very low	161 Å²	161	145.6 Å²	145.6	84%	0.843	76%	0.763	S	S	*	*			trans	69.2	140.8	158.2	-65	163.8	0	0	0	122.9
847	M	32.5	Very low	31.9	Very low	141 Å²	141	145.2 Å²	145.2	70%	0.695	77%	0.77	S	S	*	*			trans	-134	173.1	168	-63.5	-162.8	76.4	0	0	110.5	Q849	M847-Q849 HydrophobicContact CE-CG 3.67Å
848	P	36.2	Very low	32.3	Very low	127 Å²	127	145.8 Å²	145.8	83%	0.825	78%	0.778	S	S	*	*				-144.9	175.7	90.1	34.6	-15.7	0	0	0	115.9
849	Q	29.6	Very low	32.7	Very low	146 Å²	146	140.7 Å²	140.7	68%	0.682	78%	0.775	S	S	*	*			trans	-120	174.1	174.3	-55.6	-173	27.5	0	0	112.5	M847	M847-Q849 HydrophobicContact CE-CG 3.67Å
850	F	31.6	Very low	33.6	Very low	197 Å²	197	139.2 Å²	139.2	86%	0.864	77%	0.773	S	S	*	*			trans	153.2	168.4	135	-84.1	-50.1	0	0	0	112.7
851	P	37.8	Very low	33.9	Very low	114 Å²	114	144.7 Å²	144.7	74%	0.74	78%	0.783	S	S	*	*			cis	-135.4	-174.2	-36.1	37.8	-20.4	0	0	0	114.3
852	I	29.4	Very low	34.3	Very low	155 Å²	155	141.8 Å²	141.8	80%	0.795	78%	0.779	S	S	*	*			trans	-102.7	147.3	173.9	-58.3	165.5	0	0	0	110.8
853	P	37.1	Very low	34.8	Very low	117 Å²	117	141.7 Å²	141.7	76%	0.76	78%	0.776	S	S	*	*			trans	-100.8	139.2	172.7	36.2	-31.2	0	0	0	114.9
854	F	31.5	Very low	34.8	Very low	208 Å²	208	147.8 Å²	147.8	91%	0.912	79%	0.787	S	S	*	*			trans	-161	132.3	167.6	-125.4	-66.9	0	0	0	111
855	S	34.3	Very low	34.7	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	78%	0.784	S	S	*	*			trans	-173.2	151.7	168.1	64.3	0	0	0	0	110.8
856	R	33.3	Very low	34.6	Very low	231 Å²	231	147.9 Å²	147.9	87%	0.872	79%	0.794	S	S	*	*			cis	-149.8	-165.6	-7.1	-124.9	175.6	-174.5	-160.8	1.7	108.7
857	S	34.8	Very low	34.3	Very low	115 Å²	115	148.7 Å²	148.7	80%	0.804	79%	0.793	S	S	*	*			cis	-168.3	174.7	47.8	-64.6	0	0	0	0	113.4
858	T	36.5	Very low	34.2	Very low	133 Å²	133	150.3 Å²	150.3	82%	0.816	80%	0.803	S	S	*	*			trans	-107	166.8	174.6	45.2	0	0	0	0	112.2
859	S	34.7	Very low	34	Very low	107 Å²	107	148.7 Å²	148.7	75%	0.748	79%	0.791	S	S	*	*			cis	-173.9	-108.7	-21.6	-170.7	0	0	0	0	106.9
860	P	45.9	Very low	34.1	Very low	90 Å²	90	147.5 Å²	147.5	58%	0.584	79%	0.789	S	S	*	*				-119.2	170.3	-74.7	26.5	-7	0	0	0	114.7
861	Y	36.7	Very low	34	Very low	225 Å²	225	142.5 Å²	142.5	88%	0.882	77%	0.768	S	S	*	*				159.7	156.5	128.3	-91.8	-71.6	0	0	0	115.4
862	H	36.7	Very low	33.6	Very low	171 Å²	171	143.5 Å²	143.5	79%	0.792	77%	0.768	S	S	*	*			trans	-149.8	160.2	-175.1	-128.3	-35.9	0	0	0	106.8
863	P	41.2	Very low	33.7	Very low	110 Å²	110	140.8 Å²	140.8	71%	0.714	77%	0.768	S	S	*	*				-160	-169.6	81.3	42.6	-20.2	0	0	0	117.8
864	H	33.9	Very low	33.2	Very low	193 Å²	193	140.2 Å²	140.2	89%	0.894	77%	0.767	S	S	*	*			trans	-36.1	156.2	176.3	-52.1	-85.4	0	0	0	121.9
865	G	28.8	Very low	33.2	Very low	70 Å²	70	137.8 Å²	137.8	72%	0.722	76%	0.762	S	S	*	*			trans	156.4	123.8	138.1	0	0	0	0	0	119.7
866	L	31.6	Very low	32.9	Very low	187 Å²	187	138 Å²	138	98%	0.979	76%	0.761	S	S	*	*			trans	70.9	151.4	153.5	-69.1	161.8	0	0	0	122
867	E	27.2	Very low	32.6	Very low	177 Å²	177	133.9 Å²	133.9	83%	0.827	76%	0.761	S	S	*	*			trans	-108	160.4	179.6	-60.3	168.4	111.6	0	0	111.7
868	I	30.1	Very low	32.5	Very low	176 Å²	176	134 Å²	134	90%	0.903	76%	0.761	S	S	*	*			trans	-167.9	164.5	142.6	-102.3	156.7	0	0	0	109.2
869	V	30.9	Very low	32.2	Very low	93 Å²	93	136.6 Å²	136.6	56%	0.564	76%	0.762	S	S	*	*			trans	-140.4	132.2	-149.7	174.1	0	0	0	0	110.6	A1040	V869-A1040 HydrophobicContact CB-CB 4.39Å; V869-A1040 HydrophobicContact CG1-CB 3.28Å
870	D	31.7	Very low	32.2	Very low	120 Å²	120	138.8 Å²	138.8	64%	0.642	76%	0.76	S	S	*	*			trans	-164.7	160.9	146.9	-133.4	-31.4	0	0	0	115.2	S1038 A1040	D870-S1038 PolarHBondContact O-OG 2.59Å; D870-A1040 VanDerWaalsContact CA-CB 3.45Å; D870-A1040 VanDerWaalsContact O-CB 3.26Å; D870-A1040 WeakPolarHBondContact O-CB 3.4Å
871	E	29.9	Very low	31.6	Very low	92 Å²	92	139.1 Å²	139.1	43%	0.43	76%	0.764	S	S	.	*			trans	-131.3	-179.4	-162.8	-136.3	177	-142.4	0	0	115.9	A1040	E871-A1040 HydrophobicContact CB-CB 3.67Å; E871-A1040 VanDerWaalsContact CD-O 3.26Å; E871-A1040 HydrophobicContact CG-CB 3.93Å; E871-A1040 VanDerWaalsContact OE1-C 3.25Å
872	N	29.7	Very low	31.7	Very low	136 Å²	136	133.2 Å²	133.2	73%	0.727	75%	0.754	S	S	*	*			trans	75.2	112.2	160.5	-65.3	-58.4	0	0	0	121.3
873	A	30.8	Very low	31.5	Very low	98 Å²	98	136.5 Å²	136.5	81%	0.81	76%	0.761	S	S	*	*				178.6	82	127.8	0	0	0	0	0	115.7
874	S	27.2	Very low	31	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	77%	0.767	S	S	*	*				37.7	124.4	128.6	-58.8	0	0	0	0	125.1
875	I	30.7	Very low	31.1	Very low	157 Å²	157	136.4 Å²	136.4	81%	0.805	76%	0.764	S	S	*	*			trans	76.6	146.1	135.3	-59.9	166.8	0	0	0	118.2
876	P	29.6	Very low	31.3	Very low	113 Å²	113	142 Å²	142	73%	0.734	77%	0.771	S	S	*	*			cis	-120.2	169.8	-17.5	35.7	-21.2	0	0	0	114.3
877	V	27.1	Very low	31.4	Very low	143 Å²	143	141 Å²	141	87%	0.867	76%	0.762	S	S	*	*			trans	-128.5	123.4	157	178.8	0	0	0	0	109.4
878	S	32.2	Very low	31.8	Very low	117 Å²	117	141 Å²	141	82%	0.818	76%	0.764	S	S	*	*			trans	-84	143.7	179.3	48.7	0	0	0	0	112.4
879	K	29.4	Very low	32.2	Very low	189 Å²	189	137.4 Å²	137.4	82%	0.822	75%	0.75	S	S	*	*			trans	-88.1	155.3	-179.4	-58.7	171.6	-177.2	172.7	0	111.4
880	H	35.4	Very low	32.8	Very low	152 Å²	152	136.3 Å²	136.3	70%	0.704	74%	0.741	S	S	*	*			trans	160	145.3	138.5	-85.5	-50.5	0	0	0	109.6
881	S	32.8	Very low	33.2	Very low	98 Å²	98	143 Å²	143	69%	0.685	76%	0.757	S	S	*	*			cis	-161.1	175.6	-14.7	-120.4	0	0	0	0	109
882	P	39.9	Very low	33.8	Very low	101 Å²	101	148.6 Å²	148.6	66%	0.656	77%	0.774	S	S	*	*				-128.1	170.8	-123.9	43.9	-31.3	0	0	0	116.9
883	Y	31.2	Very low	34.2	Very low	240 Å²	240	145 Å²	145	94%	0.941	77%	0.769	S	S	*	*			trans	-153	92.6	142.3	-91.7	-66.7	0	0	0	110.2
884	I	30.3	Very low	34.5	Very low	166 Å²	166	148.9 Å²	148.9	85%	0.851	76%	0.763	S	S	*	*			trans	-136.5	127	168.7	-63.7	-179.3	0	0	0	107.7
885	T	37	Very low	35.1	Very low	134 Å²	134	149.7 Å²	149.7	82%	0.822	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-81.3	141	174	46.1	0	0	0	0	111
886	Q	32.3	Very low	35.3	Very low	188 Å²	188	150.3 Å²	150.3	88%	0.879	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-83.8	126.3	-166.3	-161.9	164.1	-4.8	0	0	112.3
887	E	34.9	Very low	35.5	Very low	167 Å²	167	154.9 Å²	154.9	78%	0.78	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-73.1	131.2	176.1	-64.7	-172.1	136.2	0	0	111.3
888	M	34.1	Very low	35.8	Very low	176 Å²	176	157.4 Å²	157.4	87%	0.867	76%	0.761	S	S	*	*			trans	-109.3	101	168.8	-69.8	-173.6	71.9	0	0	109.4
889	V	38.4	Very low	35.8	Very low	100 Å²	100	158.6 Å²	158.6	61%	0.606	76%	0.758	S	S	*	*			trans	-88.4	125.7	172.6	-177.4	0	0	0	0	109.3
890	D	44.2	Very low	35.9	Very low	71 Å²	71	157.9 Å²	157.9	38%	0.38	76%	0.762	S	S	.	*			trans	-76.2	165.7	176.3	86.2	-19.5	0	0	0	112.3	R892 G893 R894	D890-R892 PolarHBondContact O-N 3.32Å; D890-R892 WeakPolarHBondContact OD1-CA 3.26Å; D890-R892 PolarHBondContact OD1-N 3.39Å; D890-G893 PolarHBondContact O-N 3.41Å; D890-G893 VanDerWaalsContact O-N 3.16Å; D890-G893 PolarHBondContact OD1-N 3.24Å; D890-R894 PolarHBondContact OD1-N 3.37Å
891	R	39.8	Very low	35.8	Very low	261 Å²	261	158.3 Å²	158.3	99%	0.985	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	17.1	175.9	-63.9	-171.4	-177.4	-176.1	2	113.9
892	R	43.8	Very low	35.8	Very low	208 Å²	208	160.8 Å²	160.8	79%	0.785	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.5	8.3	176.7	-60.7	-176.5	173	-170.7	-2.2	112.7	D890 R894	D890-R892 PolarHBondContact O-N 3.32Å; D890-R892 WeakPolarHBondContact OD1-CA 3.26Å; D890-R892 PolarHBondContact OD1-N 3.39Å; R892-R894 VanDerWaalsContact C-N 3.31Å; R892-R894 PolarHBondContact O-N 2.93Å
893	G	37.3	Very low	35.3	Very low	61 Å²	61	166.8 Å²	166.8	63%	0.629	78%	0.779	S	S	*	*			trans	68.2	24.5	173.6	0	0	0	0	0	114.4	D890	D890-G893 PolarHBondContact O-N 3.41Å; D890-G893 VanDerWaalsContact O-N 3.16Å; D890-G893 PolarHBondContact OD1-N 3.24Å
894	R	37.3	Very low	35.2	Very low	179 Å²	179	161.7 Å²	161.7	68%	0.675	77%	0.768	S	S	*	*			trans	-97.5	120.6	178.2	-65.8	-173.6	-178.9	-170.9	0.3	110.9	D890 R892 Q896	D890-R894 PolarHBondContact OD1-N 3.37Å; R892-R894 VanDerWaalsContact C-N 3.31Å; R892-R894 PolarHBondContact O-N 2.93Å; R894-Q896 PolarHBondContact O-N 3.08Å
895	I	40.1	Very low	35.1	Very low	123 Å²	123	165.6 Å²	165.6	63%	0.631	77%	0.774	S	S	*	*			trans	-73	109.1	168.4	-57	172.8	0	0	0	107.9	Y897	I895-Y897 HydrophobicContact CG2-CD2 4.06Å; I895-Y897 HydrophobicContact CG2-CE2 3.93Å
896	Q	34.2	Very low	34.7	Very low	169 Å²	169	169.6 Å²	169.6	79%	0.79	77%	0.774	S	S	*	*			trans	-87.7	109.1	164.3	-75.3	-165.7	-6.9	0	0	109.4	R894 K898	R894-Q896 PolarHBondContact O-N 3.08Å; Q896-K898 PolarHBondContact O-N 2.81Å
897	Y	34.7	Very low	34.5	Very low	209 Å²	209	168.7 Å²	168.7	82%	0.82	77%	0.77	S	S	*	*			trans	-67.9	119.1	155.2	-80.2	-92.5	0	0	0	107.6	I895 D899	I895-Y897 HydrophobicContact CG2-CD2 4.06Å; I895-Y897 HydrophobicContact CG2-CE2 3.93Å; Y897-D899 PolarHBondContact O-N 2.97Å
898	K	32.1	Very low	34.3	Very low	197 Å²	197	166.7 Å²	166.7	86%	0.857	77%	0.774	S	S	*	*			trans	-85.3	108.6	179	-160.3	174.2	-173.1	179.6	0	108.6	Q896 L900	Q896-K898 PolarHBondContact O-N 2.81Å; K898-L900 PolarHBondContact O-N 2.88Å
899	D	33.1	Very low	34.2	Very low	141 Å²	141	161.9 Å²	161.9	75%	0.754	77%	0.77	S	S	*	*			trans	-57.4	131.1	-180	-79.2	-57.5	0	0	0	111.8	Y897	Y897-D899 PolarHBondContact O-N 2.97Å
900	L	31	Very low	33.6	Very low	174 Å²	174	164.6 Å²	164.6	91%	0.911	78%	0.781	S	S	*	*			trans	-105.7	66.3	163.4	-77.3	172.5	0	0	0	108.9	K898	K898-L900 PolarHBondContact O-N 2.88Å
901	H	33	Very low	32.9	Very low	162 Å²	162	169 Å²	169	75%	0.75	80%	0.804	S	S	*	*	S	Bend	trans	-137.6	150.7	172	-97.9	-31	0	0	0	111.8
902	D	34.1	Very low	32.5	Very low	150 Å²	150	164 Å²	164	80%	0.802	80%	0.795	S	S	*	*			trans	-61.5	128.4	-159.5	-48.7	-85.2	0	0	0	114.8
903	R	28.6	Very low	31.7	Very low	226 Å²	226	159.9 Å²	159.9	85%	0.853	79%	0.789	S	S	*	*			trans	172.8	140.3	161.4	-97.2	171.1	-141.4	-148	3	107.6
904	D	29.5	Very low	31.2	Very low	133 Å²	133	164.5 Å²	164.5	71%	0.711	79%	0.794	S	S	*	*			cis	-141	146.1	-4.9	-83.1	-63.1	0	0	0	108.3
905	Y	28.3	Very low	30.8	Very low	248 Å²	248	164.9 Å²	164.9	97%	0.973	80%	0.801	S	S	*	*			trans	-148.8	87.4	160.3	-104.6	-74.5	0	0	0	110.2
906	R	27	Very low	30.2	Very low	218 Å²	218	166.8 Å²	166.8	82%	0.823	81%	0.807	S	S	*	*			trans	-143.6	135.4	165.6	-154.9	178.6	-166.9	-176.1	1.1	106.9
907	E	29.1	Very low	30	Very low	169 Å²	169	167.8 Å²	167.8	79%	0.79	81%	0.809	S	S	*	*			trans	57.9	99.1	178.6	-67.2	154.7	-139.6	0	0	114.2
908	S	31.5	Very low	29.9	Very low	125 Å²	125	163.6 Å²	163.6	87%	0.874	80%	0.801	S	S	*	*				178.2	163.5	85.9	42.1	0	0	0	0	111.7
909	G	30.4	Very low	29.9	Very low	76 Å²	76	160 Å²	160	78%	0.784	80%	0.797	S	S	*	*			trans	85.2	106.8	159.8	0	0	0	0	0	116.6
910	N	27.4	Very low	29.8	Very low	156 Å²	156	160.3 Å²	160.3	83%	0.834	80%	0.799	S	S	*	*			trans	-60.9	146.9	158	-58.3	-37.7	0	0	0	109.9
911	L	28.6	Very low	30	Very low	163 Å²	163	158.9 Å²	158.9	85%	0.853	80%	0.798	S	S	*	*				171.8	154.6	113.7	-91.4	164.5	0	0	0	113.4
912	I	30.8	Very low	30	Very low	156 Å²	156	158.6 Å²	158.6	80%	0.8	80%	0.801	S	S	*	*			trans	70.8	114.2	166.9	-30.4	-165.8	0	0	0	118.5
913	N	27.4	Very low	29.7	Very low	123 Å²	123	158.9 Å²	158.9	66%	0.658	80%	0.802	S	S	*	*			trans	-61.3	165.2	173.2	-47.4	-8.8	0	0	0	115.2
914	E	27.2	Very low	29.9	Very low	157 Å²	157	155 Å²	155	73%	0.734	80%	0.798	S	S	*	*			trans	65.7	146.6	144.2	-73.1	152	169.6	0	0	116.8
915	F	28.2	Very low	30	Very low	187 Å²	187	154.9 Å²	154.9	82%	0.82	80%	0.798	S	S	*	*			cis	-131.1	154.7	36.9	-87.8	-102.1	0	0	0	115.4
916	H	28.1	Very low	30.3	Very low	163 Å²	163	149.6 Å²	149.6	76%	0.755	79%	0.786	S	S	*	*			trans	-70.6	151.2	157.8	-124.6	-98.1	0	0	0	110.2
917	F	29.5	Very low	30.7	Very low	190 Å²	190	146.5 Å²	146.5	83%	0.833	78%	0.781	S	S	*	*			trans	-142.8	112.6	160.3	-111.7	-78.9	0	0	0	111.3
918	D	33.1	Very low	30.9	Very low	121 Å²	121	144 Å²	144	65%	0.647	77%	0.773	S	S	*	*			trans	-76.9	141.2	164.7	-80	-69.1	0	0	0	110.3	N920	D918-N920 VanDerWaalsContact C-N 3.31Å; D918-N920 PolarHBondContact O-N 3.28Å; D918-N920 VanDerWaalsContact O-N 3.1Å
919	P	32.3	Very low	31.2	Very low	121 Å²	121	143.7 Å²	143.7	79%	0.786	76%	0.762	S	S	*	*	S	Bend	trans	-85.3	69.3	173.9	34.9	-34.2	0	0	0	110.8
920	N	31.3	Very low	31.4	Very low	148 Å²	148	145.8 Å²	145.8	79%	0.791	76%	0.755	S	S	*	*			trans	-159.2	163.6	170.3	-106.1	-42.6	0	0	0	113.2	D918	D918-N920 VanDerWaalsContact C-N 3.31Å; D918-N920 PolarHBondContact O-N 3.28Å; D918-N920 VanDerWaalsContact O-N 3.1Å
921	V	34.6	Very low	31.7	Very low	145 Å²	145	144.5 Å²	144.5	88%	0.879	75%	0.748	S	S	*	*			trans	77.7	134.1	-179.5	-171.6	0	0	0	0	115.1
922	N	32	Very low	31.8	Very low	155 Å²	155	143.1 Å²	143.1	83%	0.829	74%	0.741	S	S	*	*			trans	-98.4	153.4	-178.6	-158.2	-0.8	0	0	0	110.5
923	L	28.7	Very low	31.9	Very low	157 Å²	157	140.9 Å²	140.9	82%	0.822	74%	0.735	S	S	*	*			trans	-73	142.5	-168.9	-77.7	160.2	0	0	0	114.4
924	N	33.2	Very low	32	Very low	143 Å²	143	141.5 Å²	141.5	77%	0.765	74%	0.738	S	S	*	*			trans	-162.6	116.3	144.8	-112.2	-31.2	0	0	0	112.6
925	N	31.5	Very low	32.2	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	74%	0.735	S	S	*	*			trans	34.5	119.1	140.6	-55.7	-13.8	0	0	0	118.5
926	N	34.7	Very low	32.3	Very low	136 Å²	136	137.3 Å²	137.3	73%	0.727	73%	0.728	S	S	*	*				-176.6	153.8	57.6	-104.7	-24.5	0	0	0	115.1
927	H	35	Very low	32.3	Very low	154 Å²	154	136 Å²	136	71%	0.713	73%	0.727	S	S	*	*			trans	50.3	114.9	146.8	-76.2	-55	0	0	0	124.7
928	N	34.4	Very low	32.4	Very low	117 Å²	117	135 Å²	135	63%	0.626	73%	0.73	S	S	*	*				89.8	121.5	120.1	-78.3	41.6	0	0	0	124.6
929	D	36	Very low	32.3	Very low	118 Å²	118	137.2 Å²	137.2	63%	0.631	74%	0.736	S	S	*	*				89.9	96.1	125.4	-63	-15.4	0	0	0	123.4
930	N	34.9	Very low	32.1	Very low	119 Å²	119	138.3 Å²	138.3	64%	0.636	74%	0.736	S	S	*	*				80.4	103.4	114.4	-66.4	-40.5	0	0	0	122.3
931	N	33.2	Very low	31.7	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	74%	0.738	S	S	*	*				94.3	135.3	115.5	-67.6	-24.7	0	0	0	123.2
932	N	32.5	Very low	31.3	Very low	134 Å²	134	139.6 Å²	139.6	72%	0.717	73%	0.731	S	S	*	*			trans	74.7	92.2	145.6	-66.3	-8.5	0	0	0	121.7
933	T	32.3	Very low	31.1	Very low	109 Å²	109	136.5 Å²	136.5	67%	0.669	72%	0.721	S	S	*	*				29.4	127.5	109.6	55.9	0	0	0	0	119.5
934	N	30.3	Very low	31	Very low	136 Å²	136	133 Å²	133	73%	0.727	71%	0.707	S	S	*	*				-179.1	139.6	100.1	-102.1	-23.8	0	0	0	117.1
935	I	30.6	Very low	30.6	Very low	131 Å²	131	135.8 Å²	135.8	67%	0.672	71%	0.707	S	S	*	*			trans	73.4	116.1	131.7	-69.9	170.5	0	0	0	121.9
936	N	30.5	Very low	30.4	Very low	125 Å²	125	136.3 Å²	136.3	67%	0.668	70%	0.703	S	S	*	*			trans	68.1	119.4	140.1	-67.1	0.8	0	0	0	123.9
937	N	28.6	Very low	29.9	Very low	136 Å²	136	137.6 Å²	137.6	73%	0.727	70%	0.702	S	S	*	*				56.6	116.2	122.7	-53.2	-14.3	0	0	0	119.9
938	N	31.5	Very low	29.4	Very low	167 Å²	167	136.2 Å²	136.2	89%	0.893	70%	0.7	S	S	*	*				-147.5	145.9	117.9	-115.6	-44.1	0	0	0	112.4
939	H	29.9	Very low	29.2	Very low	169 Å²	169	135.9 Å²	135.9	78%	0.782	70%	0.695	S	S	*	*			trans	-73.6	137.5	167.6	-69.7	-81	0	0	0	109.4
940	N	27.6	Very low	28.7	Very low	144 Å²	144	134.4 Å²	134.4	77%	0.77	69%	0.687	S	S	*	*				-173.3	155.9	105.3	-96.9	-38.8	0	0	0	115.6
941	Y	24.8	Very low	28.4	Very low	214 Å²	214	131.1 Å²	131.1	84%	0.839	67%	0.673	S	S	*	*			trans	-27.4	160.9	168.7	-73.7	-95.6	0	0	0	120.9
942	S	25.7	Very low	28.1	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	66%	0.662	S	S	*	*			trans	85.9	107.8	152.9	-157.9	0	0	0	0	116.1
943	S	26.7	Very low	27.9	Very low	89 Å²	89	127.8 Å²	127.8	62%	0.622	66%	0.662	S	S	*	*				-151.4	159.8	76.5	22.2	0	0	0	0	110.9
944	T	27.5	Very low	27.7	Very low	83 Å²	83	128.3 Å²	128.3	51%	0.509	66%	0.655	S	S	.	*				45.6	148.4	68.7	50.7	0	0	0	0	113.3	K946	T944-K946 HydrophobicContact CG2-CD 4.15Å; T944-K946 HydrophobicContact CG2-CG 4.1Å
945	W	25.2	Very low	28	Very low	202 Å²	202	126.6 Å²	126.6	77%	0.765	65%	0.652	S	S	*	*			cis	-136.5	127.6	40.8	-70.7	77	0	0	0	111.2
946	K	26.2	Very low	27.9	Very low	143 Å²	143	127.2 Å²	127.2	62%	0.622	66%	0.656	S	S	*	*				62	114.3	78.3	-75.3	172.5	172.4	170.4	0	113.5	T944 N948	T944-K946 HydrophobicContact CG2-CD 4.15Å; T944-K946 HydrophobicContact CG2-CG 4.1Å; K946-N948 PolarHBondContact O-N 3.23Å
947	F	24.4	Very low	28	Very low	164 Å²	164	125.8 Å²	125.8	72%	0.719	66%	0.656	S	S	*	*			trans	-30.4	125.9	138.3	-97.3	-111.7	0	0	0	111.6
948	N	25.9	Very low	28.1	Very low	125 Å²	125	127.1 Å²	127.1	67%	0.668	66%	0.658	S	S	*	*				-159	159.2	115.9	-135.9	15.5	0	0	0	112.4	K946	K946-N948 PolarHBondContact O-N 3.23Å
949	Q	28.5	Very low	28	Very low	110 Å²	110	126.8 Å²	126.8	51%	0.514	65%	0.651	S	S	.	*			trans	-92.6	-169.5	162	-38.3	165.6	-5.6	0	0	108	T447 P448	T447-Q949 HydrophobicContact CG2-CB 4.27Å; P448-Q949 HydrophobicContact CB-CB 3.83Å; P448-Q949 HydrophobicContact CB-CG 4.05Å; P448-Q949 HydrophobicContact CG-CB 3.75Å
950	N	26.4	Very low	28	Very low	87 Å²	87	125.9 Å²	125.9	47%	0.465	65%	0.651	S	S	.	*			trans	103.9	124.4	165.4	-134	15.7	0	0	0	120.5	N446 T447 P448	N446-N950 WeakPolarHBondContact CA-OD1 3.48Å; N446-N950 WeakPolarHBondContact CB-OD1 3.39Å; N446-N950 PolarHBondContact OD1-OD1 2.87Å; T447-N950 PolarHBondContact N-OD1 3.45Å; T447-N950 PolarHBondContact OG1-N 2.96Å; P448-N950 WeakPolarHBondContact CD-OD1 3.49Å; P448-N950 HydrophobicContact CG-CB 3.67Å
951	S	28.3	Very low	28.1	Very low	49 Å²	49	125.8 Å²	125.8	34%	0.343	65%	0.651	S	S	.	*			trans	99.5	138.7	137	-57.4	0	0	0	0	122.2	N445 N446	N445-S951 PolarHBondContact ND2-O 3.35Å; N445-S951 PolarHBondContact OD1-O 3.36Å; N446-S951 WeakPolarHBondContact OD1-CB 3.24Å; N446-S951 PolarHBondContact OD1-OG 3.15Å
952	N	26.9	Very low	28.5	Very low	89 Å²	89	121 Å²	121	48%	0.476	65%	0.649	S	S	.	*			trans	-23.9	152.6	155	-74.4	-14.1	0	0	0	116.4	N445 N446	N445-N952 WeakPolarHBondContact ND2-CA 3.43Å; N445-N952 PolarHBondContact ND2-N 3.33Å; N446-N952 PolarHBondContact ND2-ND2 3.22Å; N446-N952 PolarHBondContact ND2-OD1 2.77Å
953	C	28.5	Very low	28.8	Very low	105 Å²	105	120.2 Å²	120.2	71%	0.709	64%	0.643	S	S	*	*			cis	-157.3	-172.3	26.4	-136.7	0	0	0	0	115.8
954	F	28.8	Very low	29.1	Very low	121 Å²	121	122.8 Å²	122.8	53%	0.531	65%	0.65	S	S	.	*			trans	-66.3	-179.8	179.2	-95.5	-105.7	0	0	0	115.9	Q443	Q443-F954 HydrophobicContact CG-CE1 4.4Å; Q443-F954 HydrophobicContact CG-CE2 3.48Å; Q443-F954 VanDerWaalsContact CG-CE2 3.48Å; Q443-F954 HydrophobicContact CG-CZ 3.42Å; Q443-F954 VanDerWaalsContact CG-CZ 3.42Å; Q443-F954 VanDerWaalsContact NE2-CZ 3.3Å
955	P	35	Very low	29.4	Very low	100 Å²	100	123.8 Å²	123.8	65%	0.649	66%	0.66	S	S	*	*			cis	-140.1	169.9	8.1	33.1	-10.8	0	0	0	119.5
956	N	30.1	Very low	29.7	Very low	143 Å²	143	119.9 Å²	119.9	77%	0.765	65%	0.652	S	S	*	*			trans	65	155.4	141.1	-73.1	0.4	0	0	0	121.8
957	S	32.8	Very low	30	Very low	95 Å²	95	121.8 Å²	121.8	66%	0.664	66%	0.656	S	S	*	*			cis	-163.9	147.5	-6.5	38	0	0	0	0	114.2
958	Q	30.5	Very low	30.5	Very low	164 Å²	164	121.2 Å²	121.2	77%	0.766	66%	0.656	S	S	*	*			trans	52.6	114.5	140.8	-64.2	179	1.7	0	0	120.9
959	Q	28.1	Very low	30.7	Very low	160 Å²	160	122.2 Å²	122.2	75%	0.748	66%	0.656	S	S	*	*				80.2	125.4	94.5	-71.3	-176.3	-2.7	0	0	116.4
960	L	31	Very low	30.9	Very low	150 Å²	150	123.8 Å²	123.8	79%	0.785	67%	0.667	S	S	*	*				179.4	116.7	109.9	-95.9	167	0	0	0	114.9
961	N	28.4	Very low	31	Very low	142 Å²	142	128 Å²	128	76%	0.759	68%	0.684	S	S	*	*			trans	9.1	162	147.8	-62.6	-11	0	0	0	125.2
962	S	33.8	Very low	31.3	Very low	114 Å²	114	130.8 Å²	130.8	80%	0.797	70%	0.701	S	S	*	*			trans	98.2	144.2	145.8	81.2	0	0	0	0	117.9
963	S	31.3	Very low	31.5	Very low	89 Å²	89	132.1 Å²	132.1	62%	0.622	71%	0.712	S	S	*	*			cis	-169.6	171.9	-20.5	50.6	0	0	0	0	111.3
964	N	33.8	Very low	31.4	Very low	144 Å²	144	134.6 Å²	134.6	77%	0.77	71%	0.713	S	S	*	*			trans	71.7	154.6	161.9	-59.9	-23.1	0	0	0	116.4
965	S	34.5	Very low	31.3	Very low	104 Å²	104	134.9 Å²	134.9	73%	0.727	72%	0.721	S	S	*	*			cis	-171.3	158.7	-6.1	147.4	0	0	0	0	108.3
966	M	31.3	Very low	31.1	Very low	119 Å²	119	138.9 Å²	138.9	59%	0.586	73%	0.73	S	S	*	*			cis	-178.2	169.9	-20.5	-165.3	179.6	-40.2	0	0	107.4
967	Y	32.2	Very low	31	Very low	183 Å²	183	136 Å²	136	72%	0.718	72%	0.722	S	S	*	*			trans	76.7	124.9	172.9	-60.3	-78.7	0	0	0	117.1
968	H	33.7	Very low	30.9	Very low	152 Å²	152	137.8 Å²	137.8	70%	0.704	72%	0.724	S	S	*	*				85.4	140.6	50.8	-84.9	-77.2	0	0	0	112.5
969	H	31.5	Very low	31.1	Very low	147 Å²	147	137.7 Å²	137.7	68%	0.681	72%	0.723	S	S	*	*			cis	-167.1	-175.9	-3.6	-162.9	24.4	0	0	0	110.5
970	L	31.7	Very low	31.3	Very low	143 Å²	143	138.1 Å²	138.1	75%	0.749	73%	0.727	S	S	*	*			trans	70	108.3	159.1	-58.7	-179.2	0	0	0	120.7
971	Q	29.3	Very low	31.5	Very low	175 Å²	175	135.4 Å²	135.4	82%	0.818	72%	0.72	S	S	*	*			trans	-79.4	-162.5	134.8	-54.2	-176.7	-24.6	0	0	108.2
972	P	35	Very low	31.8	Very low	107 Å²	107	140.1 Å²	140.1	70%	0.695	73%	0.727	S	S	*	*			cis	-142.3	-154.6	-0.5	28.9	-0.7	0	0	0	114.9
973	V	30.2	Very low	31.8	Very low	117 Å²	117	139.5 Å²	139.5	71%	0.709	72%	0.723	S	S	*	*			trans	94.7	93.7	155	-167.8	0	0	0	0	119.1
974	E	26.7	Very low	31.9	Very low	157 Å²	157	143 Å²	143	73%	0.734	73%	0.731	S	S	*	*				45.2	127.3	120.8	-58.4	-158	125.4	0	0	124.4
975	N	27.2	Very low	31.9	Very low	128 Å²	128	141.8 Å²	141.8	68%	0.684	72%	0.724	S	S	*	*				70.2	159.1	126.3	-66.7	-36	0	0	0	122.6
976	Q	30.4	Very low	31.8	Very low	183 Å²	183	141.7 Å²	141.7	86%	0.855	72%	0.715	S	S	*	*			trans	73.9	136.7	168.6	-47.3	-169.1	37.3	0	0	116.7
977	S	27.5	Very low	31.9	Very low	83 Å²	83	138.4 Å²	138.4	58%	0.58	70%	0.703	S	S	*	*			cis	164.4	157.8	-38.3	51.3	0	0	0	0	107.3
978	N	30.7	Very low	31.9	Very low	133 Å²	133	135.9 Å²	135.9	71%	0.711	70%	0.698	S	S	*	*			trans	72.2	161	176.9	-37.3	-61.4	0	0	0	113.9
979	H	34.2	Very low	31.8	Very low	162 Å²	162	134.5 Å²	134.5	75%	0.75	70%	0.7	S	S	*	*			cis	-151.8	163.4	18.9	-125.1	-48.6	0	0	0	113
980	M	33.2	Very low	31.9	Very low	169 Å²	169	132.5 Å²	132.5	83%	0.833	70%	0.703	S	S	*	*			trans	76	139.6	163	-62.8	-176.9	-176.1	0	0	118.1
981	S	34.2	Very low	32	Very low	92 Å²	92	131 Å²	131	64%	0.643	71%	0.705	S	S	*	*			cis	-166.1	137.3	-7.2	-104.6	0	0	0	0	113.6
982	R	34.8	Very low	32.2	Very low	241 Å²	241	127.3 Å²	127.3	91%	0.909	70%	0.704	S	S	*	*			trans	65.1	145.2	163.7	-59.5	171.6	174.8	164.8	-2.7	116
983	S	34.4	Very low	32.1	Very low	101 Å²	101	129.7 Å²	129.7	71%	0.706	71%	0.711	S	S	*	*			cis	178.2	154.5	-9.8	48.8	0	0	0	0	107.8
984	M	32.9	Very low	32.3	Very low	162 Å²	162	130.4 Å²	130.4	80%	0.798	72%	0.718	S	S	*	*			cis	-172.6	158.9	-2	-115.2	172.1	164.1	0	0	110.4
985	I	34.2	Very low	32.6	Very low	119 Å²	119	128 Å²	128	61%	0.61	72%	0.719	S	S	*	*			trans	62.7	126.1	151.1	-63	165.5	0	0	0	119.1
986	L	31.8	Very low	33	Very low	102 Å²	102	127.2 Å²	127.2	53%	0.534	72%	0.723	S	S	.	*			cis	-167.2	155.4	-18.8	-150.1	83.2	0	0	0	113.2	T368 S369	T368-L986 CarbonylContact C-O 3.54Å; T368-L986 CarbonylContact O-C 3.19Å; T368-L986 WeakPolarHBondContact O-CB 3.2Å; T368-L986 VanDerWaalsContact O-O 3.05Å; S369-L986 CarbonylContact C-O 3.49Å; S369-L986 PolarHBondContact N-O 3.49Å
987	S	33.3	Very low	32.9	Very low	50 Å²	50	122.8 Å²	122.8	35%	0.35	72%	0.718	S	S	.	*			trans	41.9	134.8	150.7	120.2	0	0	0	0	127.5	G367 T368	G367-S987 PolarHBondContact O-OG 3.18Å; T368-S987 WeakPolarHBondContact O-CA 3.39Å; T368-S987 WeakPolarHBondContact O-CB 3.4Å; T368-S987 PolarHBondContact O-N 2.94Å; T368-S987 PolarHBondContact O-OG 3.3Å
988	Q	32.7	Very low	33.2	Very low	131 Å²	131	129.3 Å²	129.3	61%	0.612	73%	0.731	S	S	*	*			trans	72	138.2	137.6	-63.4	171.7	22.7	0	0	120.7	A366 G367	A366-Q988 PolarHBondContact O-NE2 2.95Å; G367-Q988 VanDerWaalsContact N-OE1 3.13Å
989	T	31.7	Very low	33.3	Very low	122 Å²	122	129 Å²	129	75%	0.748	73%	0.73	S	S	*	*			cis	-161.1	169.3	0.9	7.6	0	0	0	0	113.6
990	S	34.3	Very low	33.1	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	73%	0.727	S	S	*	*			trans	78	101.2	156.2	71.9	0	0	0	0	122.8
991	S	32.4	Very low	33.1	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	73%	0.731	S	S	*	*			trans	57.4	110.5	130.3	63.9	0	0	0	0	122.7
992	A	34.9	Very low	32.9	Very low	97 Å²	97	130.3 Å²	130.3	80%	0.802	73%	0.734	S	S	*	*				-178.9	149	106.6	0	0	0	0	0	111.3
993	D	32	Very low	32.8	Very low	157 Å²	157	127.7 Å²	127.7	84%	0.84	73%	0.731	S	S	*	*			trans	-70.7	151.2	-178.7	-62.4	-80.3	0	0	0	114.2
994	P	34	Very low	32.9	Very low	131 Å²	131	127.9 Å²	127.9	85%	0.851	73%	0.731	S	S	*	*				-139.3	125	118.6	35	-22.3	0	0	0	113.9
995	S	34.4	Very low	32.8	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	74%	0.738	S	S	*	*			trans	-107.9	150.9	169.2	58.3	0	0	0	0	111.3
996	S	34	Very low	32.4	Very low	112 Å²	112	134 Å²	134	78%	0.783	75%	0.749	S	S	*	*			cis	-169.2	128.9	-26.2	49.2	0	0	0	0	107.5
997	A	29.1	Very low	32.5	Very low	90 Å²	90	137.3 Å²	137.3	74%	0.744	77%	0.766	S	S	*	*			trans	-85.8	136	169.6	0	0	0	0	0	110.5
998	Y	33.2	Very low	32.4	Very low	219 Å²	219	140 Å²	140	86%	0.859	78%	0.777	S	S	*	*			trans	166.8	155	160.4	-87.9	-49.6	0	0	0	107.5
999	N	33.5	Very low	32.5	Very low	127 Å²	127	140.7 Å²	140.7	68%	0.679	78%	0.784	S	S	*	*			cis	-146.7	173.9	-0.3	-137.5	-32.5	0	0	0	111.6
1000	L	31	Very low	32.7	Very low	134 Å²	134	141.4 Å²	141.4	70%	0.702	78%	0.779	S	S	*	*			trans	-74.5	158.5	172.7	-62.8	93.8	0	0	0	112.4
1001	L	32.7	Very low	32.7	Very low	173 Å²	173	142.4 Å²	142.4	91%	0.906	78%	0.776	S	S	*	*			trans	-135.9	137.4	143.5	-142.3	86.6	0	0	0	110.5
1002	M	28.7	Very low	32.8	Very low	143 Å²	143	145 Å²	145	70%	0.704	78%	0.782	S	S	*	*			trans	-93.4	158.4	172.6	-72.7	-84.2	-167.6	0	0	110.1
1003	H	33.4	Very low	32.6	Very low	186 Å²	186	147.6 Å²	147.6	86%	0.861	78%	0.777	S	S	*	*				-176.7	146.2	111.4	-99.7	-73.9	0	0	0	111.8
1004	P	35.7	Very low	32.6	Very low	106 Å²	106	148.4 Å²	148.4	69%	0.688	78%	0.78	S	S	*	*			trans	-109.6	161.8	-175.7	40.1	-33.3	0	0	0	114.2
1005	L	32	Very low	32.3	Very low	181 Å²	181	146.9 Å²	146.9	95%	0.948	76%	0.764	S	S	*	*			trans	-134.8	149.3	156.3	-76.6	178.4	0	0	0	110.9
1006	R	26.1	Very low	32.3	Very low	227 Å²	227	150.2 Å²	150.2	86%	0.857	77%	0.773	S	S	*	*			trans	-101.5	162.6	177.5	-66	171.5	168.1	157.8	-8	110.4
1007	I	34	Very low	32.1	Very low	172 Å²	172	153.2 Å²	153.2	88%	0.882	77%	0.772	S	S	*	*				-166.5	149.5	124	-97.2	150.9	0	0	0	108.2
1008	N	30.4	Very low	32.6	Very low	107 Å²	107	154.5 Å²	154.5	57%	0.572	77%	0.773	S	S	*	*			trans	-106.3	157.1	-171.7	-63.3	9.6	0	0	0	112.3
1009	N	35.4	Very low	32.7	Very low	145 Å²	145	150.2 Å²	150.2	78%	0.775	77%	0.771	S	S	*	*				173.1	132.1	121.7	-83.7	-0.3	0	0	0	107.6
1010	E	34.8	Very low	32.6	Very low	137 Å²	137	151.3 Å²	151.3	64%	0.64	78%	0.777	S	S	*	*			cis	68.5	127.7	46.2	-62.2	-163.3	-128.6	0	0	113
1011	N	35.1	Very low	32.7	Very low	126 Å²	126	149.7 Å²	149.7	67%	0.674	78%	0.777	S	S	*	*			cis	-151.9	161.5	-7.9	-89.1	-36.8	0	0	0	109.5
1012	N	34.5	Very low	32.7	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	77%	0.769	S	S	*	*			trans	-164.1	106.3	146.8	-114.9	-29.3	0	0	0	111
1013	E	29.7	Very low	32.8	Very low	150 Å²	150	149.7 Å²	149.7	70%	0.701	78%	0.778	S	S	*	*			trans	-80.4	149.8	174.8	-64.9	-165.4	130.8	0	0	111.9	N1015	E1013-N1015 PolarHBondContact OE2-ND2 3.19Å; E1013-N1015 VanDerWaalsContact OE2-ND2 3.1Å
1014	I	33.5	Very low	32.8	Very low	175 Å²	175	149.4 Å²	149.4	90%	0.897	78%	0.782	S	S	*	*			trans	-127.8	124.7	133.9	-61.8	-175.7	0	0	0	107.8
1015	N	27.4	Very low	32.6	Very low	98 Å²	98	148 Å²	148	52%	0.524	78%	0.779	S	S	.	*			trans	-62.2	146.8	-176.3	-104.1	-105.3	0	0	0	113.5	E1013	E1013-N1015 PolarHBondContact OE2-ND2 3.19Å; E1013-N1015 VanDerWaalsContact OE2-ND2 3.1Å
1016	L	33.3	Very low	32.7	Very low	177 Å²	177	147.1 Å²	147.1	93%	0.927	78%	0.775	S	S	*	*			trans	-160.3	143.6	130.3	-106.2	169.3	0	0	0	110.7
1017	K	30.7	Very low	32.8	Very low	176 Å²	176	141.4 Å²	141.4	77%	0.765	77%	0.77	S	S	*	*			trans	-89.7	148.2	-160.8	-62.9	174.9	179.1	175.6	0	114.3
1018	P	38.7	Very low	32.6	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	76%	0.764	S	S	*	*			trans	-76.9	168	159.3	36.3	-35.8	0	0	0	111
1019	P	35.9	Very low	32.6	Very low	128 Å²	128	140.9 Å²	140.9	83%	0.831	77%	0.774	S	S	*	*				-151.8	179.5	104.8	39.5	-21.8	0	0	0	116.8
1020	N	30.8	Very low	32.3	Very low	151 Å²	151	139.8 Å²	139.8	81%	0.807	77%	0.772	S	S	*	*			trans	-84.2	151.9	-170.6	-64	-58.6	0	0	0	117.1
1021	S	33.2	Very low	32.1	Very low	100 Å²	100	143.4 Å²	143.4	70%	0.699	78%	0.781	S	S	*	*			trans	60.7	131.5	134.5	72.9	0	0	0	0	122.9
1022	A	33.1	Very low	31.8	Very low	89 Å²	89	146.3 Å²	146.3	74%	0.736	79%	0.788	S	S	*	*				-156.5	151.9	126.6	0	0	0	0	0	111.3
1023	Y	30.8	Very low	31.8	Very low	226 Å²	226	142.9 Å²	142.9	89%	0.886	78%	0.777	S	S	*	*			trans	-94.7	148.5	169.8	-76.2	-112.7	0	0	0	110
1024	L	33.9	Very low	32	Very low	181 Å²	181	141.7 Å²	141.7	95%	0.948	78%	0.782	S	S	*	*				-166.6	-178.3	123.7	-105.6	164.7	0	0	0	110.9
1025	A	31.3	Very low	31.7	Very low	76 Å²	76	141.8 Å²	141.8	63%	0.628	78%	0.777	S	S	*	*			trans	-109.1	-172.3	-155.7	0	0	0	0	0	115.4
1026	D	34	Very low	31.8	Very low	163 Å²	163	146.1 Å²	146.1	87%	0.872	79%	0.794	S	S	*	*			trans	86.1	162.5	163.3	-61.6	-38.9	0	0	0	120.4
1027	S	28.8	Very low	31.5	Very low	106 Å²	106	148.1 Å²	148.1	74%	0.741	79%	0.791	S	S	*	*			trans	-117.7	-171.7	-156	-58.5	0	0	0	0	111.3
1028	P	29.8	Very low	31.4	Very low	118 Å²	118	144 Å²	144	77%	0.766	78%	0.784	S	S	*	*				-119.1	120	-51.6	28.6	-13.2	0	0	0	109.7	V1030	P1028-V1030 PolarHBondContact O-N 3.15Å
1029	I	30.7	Very low	31	Very low	150 Å²	150	143.1 Å²	143.1	77%	0.769	78%	0.78	S	S	*	*			trans	-87.4	104.9	-167	-62	-177.8	0	0	0	112.8	Y1031	I1029-Y1031 HydrophobicContact CG2-CD2 3.39Å; I1029-Y1031 HydrophobicContact CG2-CE2 3.75Å
1030	V	28.3	Very low	30.6	Very low	122 Å²	122	137.4 Å²	137.4	74%	0.739	74%	0.744	S	S	*	*			trans	-82	132.6	155	173.9	0	0	0	0	108.5	P1028	P1028-V1030 PolarHBondContact O-N 3.15Å
1031	Y	31.7	Very low	31	Very low	213 Å²	213	135.6 Å²	135.6	84%	0.835	74%	0.744	S	S	*	*			trans	-128.9	140.5	158	-97.8	-71.6	0	0	0	112.9	I1029	I1029-Y1031 HydrophobicContact CG2-CD2 3.39Å; I1029-Y1031 HydrophobicContact CG2-CE2 3.75Å
1032	K	27	Very low	31.2	Very low	188 Å²	188	136 Å²	136	82%	0.817	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-89	166.3	173.2	-68.2	177.4	178.1	175.1	0	110.3
1033	S	34.4	Very low	31.1	Very low	96 Å²	96	136.7 Å²	136.7	67%	0.671	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-60.2	165.6	169.2	53.7	0	0	0	0	113.6
1034	P	34	Very low	31.1	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-103.2	151.9	131.1	-12.4	29.9	0	0	0	112.4
1035	F	28.9	Very low	31	Very low	178 Å²	178	130.1 Å²	130.1	78%	0.781	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-77.7	156	163.4	-87.5	-121.7	0	0	0	110.2
1036	Q	28.4	Very low	31	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	74%	0.744	S	S	*	*				-175.4	152.7	102.9	-97.2	172.9	-14.3	0	0	113.6
1037	Y	28	Very low	31	Very low	219 Å²	219	133.8 Å²	133.8	86%	0.859	74%	0.74	S	S	*	*			trans	-80.7	155.2	167.1	-92.2	-114.8	0	0	0	109.1
1038	S	26.9	Very low	31.2	Very low	90 Å²	90	137 Å²	137	63%	0.629	75%	0.748	S	S	*	*				-143.1	-174.1	71.5	63.4	0	0	0	0	115.6	D870	D870-S1038 PolarHBondContact O-OG 2.59Å
1039	S	30.9	Very low	31	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	75%	0.746	S	S	*	*			trans	-162.5	141.2	171.8	57.8	0	0	0	0	109.6
1040	A	28.3	Very low	31.1	Very low	9 Å²	9	136.4 Å²	136.4	7%	0.074	75%	0.75	C	S	.	*			trans	-151.2	72.6	-163.7	0	0	0	0	0	115.3	V869 D870 E871 P1042	V869-A1040 HydrophobicContact CB-CB 4.39Å; V869-A1040 HydrophobicContact CG1-CB 3.28Å; D870-A1040 VanDerWaalsContact CA-CB 3.45Å; D870-A1040 VanDerWaalsContact O-CB 3.26Å; D870-A1040 WeakPolarHBondContact O-CB 3.4Å; E871-A1040 HydrophobicContact CB-CB 3.67Å; E871-A1040 VanDerWaalsContact CD-O 3.26Å; E871-A1040 HydrophobicContact CG-CB 3.93Å; E871-A1040 VanDerWaalsContact OE1-C 3.25Å; A1040-P1042 WeakPolarHBondContact O-CD 3.37Å
1041	S	39.2	Very low	31.1	Very low	113 Å²	113	134.6 Å²	134.6	79%	0.79	74%	0.739	S	S	*	*			trans	-74.7	137.4	171.2	-47.9	0	0	0	0	113.2
1042	P	36.5	Very low	31.1	Very low	109 Å²	109	132.3 Å²	132.3	71%	0.708	74%	0.74	S	S	*	*			trans	-123.2	158.2	151.2	37.3	-26.5	0	0	0	111.5	A1040	A1040-P1042 WeakPolarHBondContact O-CD 3.37Å
1043	S	30.8	Very low	31.3	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	73%	0.727	S	S	*	*			cis	-169.5	143.3	-14.7	51.8	0	0	0	0	110.6
1044	V	30.5	Very low	31.2	Very low	124 Å²	124	127.2 Å²	127.2	75%	0.752	72%	0.718	S	S	*	*			trans	45.5	113.3	141	-177	0	0	0	0	119.2
1045	T	33.5	Very low	31.3	Very low	145 Å²	145	126.6 Å²	126.6	89%	0.89	70%	0.7	S	S	*	*				-158.1	151.9	121	5	0	0	0	0	114.5
1046	K	29.8	Very low	31.6	Very low	193 Å²	193	122.7 Å²	122.7	84%	0.839	69%	0.687	S	S	*	*			trans	-61.2	169	-164.1	-78	172.6	179.2	175.3	0	117.6
1047	P	35.5	Very low	31.8	Very low	123 Å²	123	119.2 Å²	119.2	80%	0.799	67%	0.667	S	S	*	*			trans	-90.5	156	-163.9	36.2	-36.5	0	0	0	114.5
1048	L	32.7	Very low	32.1	Very low	174 Å²	174	116.3 Å²	116.3	91%	0.911	66%	0.658	S	S	*	*			trans	-141.6	124.8	162.5	-104.1	172.6	0	0	0	112.3
1049	T	25.8	Very low	32.4	Very low	116 Å²	116	122.5 Å²	122.5	71%	0.712	67%	0.668	S	S	*	*			trans	-72.1	140.5	166.3	-46.6	0	0	0	0	109.9
1050	T	31.5	Very low	32.6	Very low	139 Å²	139	123.3 Å²	123.3	85%	0.853	67%	0.674	S	S	*	*			trans	-153.2	139.8	148.2	-79.4	0	0	0	0	110.6
1051	T	28.2	Very low	33.1	Very low	85 Å²	85	132.2 Å²	132.2	52%	0.521	71%	0.706	S	S	.	*			trans	-125.3	143.2	-167.6	-63	0	0	0	0	109.6	I1053	T1051-I1053 HydrophobicContact CG2-CD1 3.26Å; T1051-I1053 HydrophobicContact CG2-CG1 3.51Å
1052	I	31.4	Very low	33.1	Very low	164 Å²	164	132.6 Å²	132.6	84%	0.841	71%	0.705	S	S	*	*			trans	-174.9	117.8	152.5	-92.3	141	0	0	0	105.3
1053	I	32.5	Very low	33	Very low	109 Å²	109	131.7 Å²	131.7	56%	0.559	69%	0.694	S	S	*	*			cis	86.2	105	24.4	-58.8	-172.5	0	0	0	116.4	T1051 R1055	T1051-I1053 HydrophobicContact CG2-CD1 3.26Å; T1051-I1053 HydrophobicContact CG2-CG1 3.51Å; I1053-R1055 HydrophobicContact CG2-CG 3.54Å
1054	S	32.4	Very low	33.1	Very low	68 Å²	68	133.4 Å²	133.4	48%	0.476	69%	0.694	S	S	.	*				-150.9	123.5	121.4	-76.3	0	0	0	0	107.3
1055	R	34.9	Very low	33.2	Very low	112 Å²	112	132.6 Å²	132.6	42%	0.423	69%	0.694	S	S	.	*				82.1	141.6	51.6	-70.6	-177.4	85.2	163.4	2.8	112.8	I1053 Y1057	I1053-R1055 HydrophobicContact CG2-CG 3.54Å; R1055-Y1057 PolarHBondContact NH2-OH 2.95Å; R1055-Y1057 VanDerWaalsContact NH2-OH 3.1Å
1056	D	35	Very low	33	Very low	96 Å²	96	130.8 Å²	130.8	51%	0.513	69%	0.688	S	S	.	*			cis	-153.2	178.7	-4.1	-115.5	-6.7	0	0	0	108.1
1057	Y	34.2	Very low	33.1	Very low	117 Å²	117	125.8 Å²	125.8	46%	0.459	68%	0.682	S	S	.	*			cis	-160.4	172.3	2.3	-114.8	-30.2	0	0	0	105.6	N509 R1055	N509-Y1057 PolarHBondContact OD1-OH 2.95Å; R1055-Y1057 PolarHBondContact NH2-OH 2.95Å; R1055-Y1057 VanDerWaalsContact NH2-OH 3.1Å
1058	F	33.5	Very low	32.9	Very low	157 Å²	157	125.6 Å²	125.6	69%	0.689	68%	0.684	S	S	*	*			cis	-119.8	-157.9	-8.6	-79.3	-73.3	0	0	0	107.3
1059	R	33.4	Very low	32.7	Very low	220 Å²	220	128.7 Å²	128.7	83%	0.83	68%	0.683	S	S	*	*			cis	73.3	155.1	10.5	-70.8	176.3	-179.5	-92.9	-5.2	116.1
1060	S	34.6	Very low	32.8	Very low	115 Å²	115	131.1 Å²	131.1	80%	0.804	69%	0.686	S	S	*	*			cis	-132.4	167.7	13.6	56.4	0	0	0	0	116.5
1061	R	39.9	Very low	32.5	Very low	196 Å²	196	133.2 Å²	133.2	74%	0.74	68%	0.68	S	S	*	*			trans	-117.1	-174.8	168.2	-69.8	-177.6	164.1	-166.3	-2.4	109.9	D1063	R1061-D1063 VanDerWaalsContact CD-OD1 3.29Å; R1061-D1063 WeakPolarHBondContact CD-OD1 3.29Å; R1061-D1063 IonicContact CZ-OD1 3.24Å; R1061-D1063 IonicContact NE-OD1 3.31Å; R1061-D1063 IonicContact NH1-OD1 3.52Å; R1061-D1063 PolarHBondContact NH1-OD1 2.77Å
1062	P	39.3	Very low	32.4	Very low	120 Å²	120	138.1 Å²	138.1	78%	0.779	69%	0.69	S	S	*	*				-127.4	164.7	87.5	5.9	17.5	0	0	0	113.4
1063	D	33.3	Very low	32.2	Very low	90 Å²	90	136 Å²	136	48%	0.481	69%	0.685	S	S	.	*			cis	80.6	146.6	23.5	-60.8	-16.2	0	0	0	113.6	R1061	R1061-D1063 VanDerWaalsContact CD-OD1 3.29Å; R1061-D1063 WeakPolarHBondContact CD-OD1 3.29Å; R1061-D1063 IonicContact CZ-OD1 3.24Å; R1061-D1063 IonicContact NE-OD1 3.31Å; R1061-D1063 IonicContact NH1-OD1 3.52Å; R1061-D1063 PolarHBondContact NH1-OD1 2.77Å
1064	I	33.5	Very low	31.9	Very low	138 Å²	138	134.4 Å²	134.4	71%	0.708	68%	0.684	S	S	*	*			cis	-164.9	169	2.7	-120.9	167.8	0	0	0	111.1
1065	S	31.7	Very low	31.7	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	70%	0.703	S	S	*	*			trans	67.4	165.3	159.4	67.7	0	0	0	0	121
1066	S	30.7	Very low	31.5	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	72%	0.715	S	S	*	*			cis	-169.5	171.7	-36.1	64.3	0	0	0	0	112.4
1067	A	30.2	Very low	31.4	Very low	88 Å²	88	140.9 Å²	140.9	73%	0.727	72%	0.723	S	S	*	*			trans	77.5	166	150.2	0	0	0	0	0	122.4
1068	S	32.7	Very low	31.3	Very low	119 Å²	119	141.2 Å²	141.2	83%	0.832	73%	0.732	S	S	*	*			trans	73.2	99.3	161.7	-57.4	0	0	0	0	120.9
1069	R	27.8	Very low	31.3	Very low	239 Å²	239	140.4 Å²	140.4	90%	0.902	73%	0.73	S	S	*	*			trans	-65.8	155.5	141.3	-66.1	175.6	171.7	-178	-2.8	109
1070	Q	27.9	Very low	31.2	Very low	166 Å²	166	136.8 Å²	136.8	78%	0.776	72%	0.721	S	S	*	*				169.9	141.4	114.5	-90	-168.4	-29.1	0	0	112.4
1071	Y	25.8	Very low	31	Very low	183 Å²	183	136.9 Å²	136.9	72%	0.718	71%	0.712	S	S	*	*			trans	44.2	144.6	134.3	-69	-114	0	0	0	120.2
1072	Y	25.8	Very low	30.6	Very low	188 Å²	188	133 Å²	133	74%	0.737	71%	0.71	S	S	*	*			cis	-170.2	163.9	-1.1	-138.2	-143.5	0	0	0	108.9
1073	V	26.5	Very low	30.1	Very low	119 Å²	119	132.6 Å²	132.6	72%	0.721	71%	0.706	S	S	*	*			trans	56.9	142.9	143.4	156.2	0	0	0	0	120.3
1074	S	27.1	Very low	30	Very low	77 Å²	77	133.9 Å²	133.9	54%	0.538	72%	0.717	S	S	.	*			cis	-175.8	158.6	-16.9	67.3	0	0	0	0	111.3
1075	Q	28.3	Very low	29.9	Very low	191 Å²	191	138.6 Å²	138.6	89%	0.893	73%	0.726	S	S	*	*			trans	63.3	149.7	156	-63.9	172.9	44.2	0	0	116.7
1076	S	30.2	Very low	30	Very low	95 Å²	95	144.9 Å²	144.9	66%	0.664	73%	0.734	S	S	*	*			cis	-141.6	-160.4	-3.4	61.3	0	0	0	0	107.9
1077	N	33.2	Very low	30.2	Very low	126 Å²	126	144.9 Å²	144.9	67%	0.674	73%	0.731	S	S	*	*			cis	-152.6	161.3	0.4	-123.5	-15.4	0	0	0	106.5
1078	N	31.6	Very low	30.2	Very low	123 Å²	123	146.1 Å²	146.1	66%	0.658	73%	0.73	S	S	*	*				42	139.6	82.4	-62.2	-47	0	0	0	116.1
1079	H	34.8	Very low	30	Very low	140 Å²	140	148.2 Å²	148.2	65%	0.648	73%	0.731	S	S	*	*			cis	-166.8	164.7	12.2	-126.4	33.4	0	0	0	107.2
1080	F	30.8	Very low	30	Very low	144 Å²	144	142 Å²	142	63%	0.632	72%	0.724	S	S	*	*			cis	-172.1	156.8	-13.5	-147.1	-154.7	0	0	0	109.6
1081	N	30	Very low	30	Very low	117 Å²	117	141.6 Å²	141.6	63%	0.626	73%	0.726	S	S	*	*			trans	59.4	-177.7	152.5	-74.1	2.3	0	0	0	117.7
1082	T	30.5	Very low	30.3	Very low	114 Å²	114	136.4 Å²	136.4	70%	0.699	72%	0.721	S	S	*	*			cis	-159.9	168	-36.6	33.1	0	0	0	0	108.5
1083	T	30.5	Very low	30.7	Very low	112 Å²	112	135.5 Å²	135.5	69%	0.687	72%	0.723	S	S	*	*			cis	179	164.2	-30.7	-79.7	0	0	0	0	108.1
1084	T	30	Very low	31.1	Very low	118 Å²	118	135.9 Å²	135.9	72%	0.724	72%	0.721	S	S	*	*			trans	83.9	146	160	13.2	0	0	0	0	122.5
1085	R	32	Very low	31.5	Very low	237 Å²	237	138.2 Å²	138.2	89%	0.894	73%	0.728	S	S	*	*			trans	84.4	114.4	148.4	-75.2	171.9	-174.3	-140.3	-0.2	121.9
1086	R	33.1	Very low	31.8	Very low	239 Å²	239	132.2 Å²	132.2	90%	0.902	71%	0.707	S	S	*	*			trans	-55.7	161.6	143.1	-80.2	-176.8	178	-166.8	0.2	110.6
1087	P	35	Very low	32	Very low	108 Å²	108	137.4 Å²	137.4	70%	0.701	71%	0.713	S	S	*	*			cis	-153.7	176.1	44.7	43.7	-22	0	0	0	120.5
1088	T	30.4	Very low	32.2	Very low	114 Å²	114	138.1 Å²	138.1	70%	0.699	72%	0.716	S	S	*	*			trans	45.1	121.2	146.9	51.3	0	0	0	0	124.1
1089	L	28	Very low	32.4	Very low	162 Å²	162	141 Å²	141	85%	0.848	72%	0.723	S	S	*	*			trans	73.2	145.4	132.7	-73.2	166.7	0	0	0	122
1090	S	29	Very low	32.3	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	72%	0.72	S	S	*	*			trans	73.2	151.1	165.3	84.1	0	0	0	0	116.8
1091	I	28.1	Very low	32.5	Very low	157 Å²	157	136.8 Å²	136.8	81%	0.805	73%	0.728	S	S	*	*			cis	-161.7	157.1	-28.6	-117.5	163.4	0	0	0	108.3
1092	A	30.9	Very low	32.6	Very low	74 Å²	74	140.2 Å²	140.2	61%	0.612	74%	0.738	S	S	*	*			trans	68.5	126.1	166.3	0	0	0	0	0	117.8
1093	Q	34.8	Very low	32.8	Very low	169 Å²	169	139.5 Å²	139.5	79%	0.79	74%	0.738	S	S	*	*				75.3	145.8	98	-67.5	-178.3	9.2	0	0	114.2
1094	N	34.3	Very low	32.7	Very low	126 Å²	126	143.3 Å²	143.3	67%	0.674	75%	0.745	S	S	*	*			cis	-162.1	173.5	-3.6	-108.1	-12.9	0	0	0	106.4
1095	N	36	Very low	32.7	Very low	127 Å²	127	141.4 Å²	141.4	68%	0.679	74%	0.736	S	S	*	*			cis	-159.9	170.1	12.3	-145.8	-17.9	0	0	0	112
1096	S	34.1	Very low	32.5	Very low	65 Å²	65	137.9 Å²	137.9	46%	0.455	73%	0.73	S	S	.	*			trans	37.4	131.6	143.6	68.3	0	0	0	0	120.5
1097	Y	35.7	Very low	32.4	Very low	203 Å²	203	134.6 Å²	134.6	80%	0.796	72%	0.724	S	S	*	*			cis	-161.5	165.2	42.8	-67.2	-83.7	0	0	0	107.8
1098	L	35.8	Very low	32.3	Very low	141 Å²	141	136.4 Å²	136.4	74%	0.738	73%	0.728	S	S	*	*			cis	-163.6	-179.6	-13.1	-99.2	168.5	0	0	0	105.3
1099	K	35.8	Very low	32.4	Very low	185 Å²	185	137.4 Å²	137.4	80%	0.804	73%	0.728	S	S	*	*			cis	-145	122.1	7	-152.4	161.5	-170.6	177	0	108
1100	A	32.7	Very low	32.4	Very low	71 Å²	71	135.8 Å²	135.8	59%	0.587	72%	0.72	S	S	*	*			trans	-95.3	-177.1	166.9	0	0	0	0	0	109.8	F1102	A1100-F1102 HydrophobicContact CB-CD2 4.05Å; A1100-F1102 HydrophobicContact CB-CE2 4.22Å
1101	P	36.7	Very low	32.6	Very low	124 Å²	124	138.7 Å²	138.7	81%	0.805	72%	0.721	S	S	*	*				-146.8	-173	75	26.7	-2.4	0	0	0	114.5
1102	F	31.4	Very low	32.9	Very low	188 Å²	188	134.9 Å²	134.9	83%	0.825	71%	0.713	S	S	*	*				-161.2	168.7	-53.9	-123.9	-80.3	0	0	0	107.2	A1100	A1100-F1102 HydrophobicContact CB-CD2 4.05Å; A1100-F1102 HydrophobicContact CB-CE2 4.22Å
1103	S	33.7	Very low	33.1	Very low	100 Å²	100	137 Å²	137	70%	0.699	72%	0.718	S	S	*	*			trans	-97.3	177.3	166.8	71.4	0	0	0	0	112.2
1104	K	29.5	Very low	33.1	Very low	192 Å²	192	135.5 Å²	135.5	84%	0.835	72%	0.716	S	S	*	*			trans	106.4	154.7	-179.9	-69.6	-177.8	177.4	-169.6	0	114.2
1105	S	29.4	Very low	33.1	Very low	78 Å²	78	134.3 Å²	134.3	55%	0.545	72%	0.717	S	S	.	*			cis	-170.4	170.4	-26.3	50.5	0	0	0	0	108.8
1106	E	28.7	Very low	33.3	Very low	162 Å²	162	136.2 Å²	136.2	76%	0.757	73%	0.726	S	S	*	*			trans	70	128.1	153.1	-69.6	155.2	135.9	0	0	121.6
1107	H	30.7	Very low	33.4	Very low	170 Å²	170	137.9 Å²	137.9	79%	0.787	74%	0.736	S	S	*	*			trans	41.6	123.8	143.4	-70.2	-82.1	0	0	0	122.4
1108	N	32.6	Very low	33.2	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	74%	0.738	S	S	*	*				-138.9	123.9	122.4	-109.3	-44.5	0	0	0	112.4
1109	L	31.6	Very low	33.2	Very low	134 Å²	134	138 Å²	138	70%	0.702	74%	0.744	S	S	*	*			trans	65.1	97.2	151.3	-56.1	172.6	0	0	0	122.2
1110	L	28.2	Very low	33.1	Very low	128 Å²	128	136.9 Å²	136.9	67%	0.67	74%	0.742	S	S	*	*				93.1	123.6	120	-67.9	174	0	0	0	122.6
1111	H	33.9	Very low	33	Very low	172 Å²	172	140.3 Å²	140.3	80%	0.796	75%	0.75	S	S	*	*			trans	67.5	137	155.9	-59.6	-57.5	0	0	0	119.8
1112	A	34.9	Very low	32.7	Very low	76 Å²	76	146.5 Å²	146.5	63%	0.628	76%	0.757	S	S	*	*			cis	-164.6	162.3	-15.5	0	0	0	0	0	112.1
1113	V	35.2	Very low	32.7	Very low	120 Å²	120	147.8 Å²	147.8	73%	0.727	76%	0.757	S	S	*	*			trans	57.8	110.7	155.2	-67.6	0	0	0	0	122.5
1114	D	34.4	Very low	32.6	Very low	137 Å²	137	153 Å²	153	73%	0.733	77%	0.767	S	S	*	*				78.7	106.4	114.3	-58	0.3	0	0	0	123.9
1115	S	35.1	Very low	32.6	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	76%	0.759	S	S	*	*				96.6	130.6	107.8	-69.2	0	0	0	0	123.8
1116	L	39.6	Very low	32.8	Very low	166 Å²	166	152.9 Å²	152.9	87%	0.869	77%	0.772	S	S	*	*			trans	80	152.9	148	-67.6	168.5	0	0	0	119.2
1117	P	35.7	Very low	33	Very low	101 Å²	101	150.7 Å²	150.7	66%	0.656	77%	0.77	S	S	*	*			trans	-137	-167.9	-133	45.7	-28.3	0	0	0	116.2
1118	E	31.5	Very low	33.1	Very low	180 Å²	180	148.9 Å²	148.9	84%	0.841	77%	0.771	S	S	*	*			trans	61	105	161.9	-64.3	-171.2	148.3	0	0	118.9
1119	L	36	Very low	33.3	Very low	165 Å²	165	150 Å²	150	86%	0.864	77%	0.771	S	S	*	*				-167.9	165.8	115.5	-101.1	163.1	0	0	0	112.7
1120	E	33.6	Very low	33.3	Very low	162 Å²	162	150.4 Å²	150.4	76%	0.757	77%	0.774	S	S	*	*			trans	-50.9	132	-155.7	-64.4	174.3	106.5	0	0	121.1
1121	N	31	Very low	33.7	Very low	143 Å²	143	151.1 Å²	151.1	77%	0.765	78%	0.779	S	S	*	*				31.5	110.8	128	-68.3	-44.9	0	0	0	120.5
1122	R	30.2	Very low	33.5	Very low	254 Å²	254	147.9 Å²	147.9	96%	0.958	78%	0.775	S	S	*	*				-154.1	103.7	128.1	-107.9	167.9	-151.2	-113.5	2.4	110.9
1123	R	30.7	Very low	33.4	Very low	216 Å²	216	155.5 Å²	155.5	82%	0.815	79%	0.789	S	S	*	*			trans	-78.3	135.7	168.5	-84.2	-177.6	171.3	174.3	-1	110
1124	F	33	Very low	33.1	Very low	208 Å²	208	157.4 Å²	157.4	91%	0.912	80%	0.795	S	S	*	*			trans	-100.5	131.7	150.3	-102.1	-89.6	0	0	0	108.5
1125	Q	29.8	Very low	33.1	Very low	140 Å²	140	158.1 Å²	158.1	65%	0.654	80%	0.797	S	S	*	*			trans	-117.1	159.4	163.9	-76	-166.8	-12.5	0	0	109.1
1126	P	33.5	Very low	32.8	Very low	128 Å²	128	161.6 Å²	161.6	83%	0.831	80%	0.802	S	S	*	*			trans	-66.6	138.5	171.3	-14	29.7	0	0	0	110.5
1127	T	32.4	Very low	32.4	Very low	116 Å²	116	165 Å²	165	71%	0.712	81%	0.805	S	S	*	*			trans	-75.9	123.2	-173.7	47.5	0	0	0	0	113.4
1128	V	32.3	Very low	32.1	Very low	133 Å²	133	164.8 Å²	164.8	81%	0.806	81%	0.806	S	S	*	*			trans	-112.7	134.4	142.2	179.2	0	0	0	0	105.1
1129	E	36.1	Very low	32.3	Very low	169 Å²	169	162.9 Å²	162.9	79%	0.79	81%	0.807	S	S	*	*			trans	-127.1	132.3	-177.6	-69	-175.7	158.7	0	0	110.4
1130	D	32.9	Very low	32	Very low	143 Å²	143	162.1 Å²	162.1	77%	0.765	80%	0.803	S	S	*	*			trans	-130.9	171.6	-178.2	-96.6	-46.2	0	0	0	109.7
1131	D	35.2	Very low	32.2	Very low	144 Å²	144	159.2 Å²	159.2	77%	0.77	80%	0.799	S	S	*	*			trans	65.6	110.3	154.2	-77.3	-24.7	0	0	0	122.7
1132	S	30	Very low	32.3	Very low	103 Å²	103	159.2 Å²	159.2	72%	0.72	80%	0.797	S	S	*	*				83.2	143	122.2	81.8	0	0	0	0	121.3
1133	Y	32.3	Very low	32.3	Very low	236 Å²	236	153.2 Å²	153.2	93%	0.925	79%	0.789	S	S	*	*			trans	-143.4	136.6	151.2	-102.6	-87.7	0	0	0	108.6
1134	L	30.1	Very low	32.3	Very low	161 Å²	161	146.7 Å²	146.7	84%	0.843	78%	0.776	S	S	*	*			trans	-127.7	142.8	178.7	-117.4	172.4	0	0	0	108.5
1135	I	33.1	Very low	32.2	Very low	151 Å²	151	146.1 Å²	146.1	77%	0.774	77%	0.773	S	S	*	*			trans	-136.9	132.7	166	-60.8	-177	0	0	0	107.9
1136	E	28.8	Very low	32.2	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.813	78%	0.775	S	S	*	*			trans	-79.4	162.2	178.7	-54.1	175.3	111.5	0	0	111.9
1137	Y	33.2	Very low	32.1	Very low	238 Å²	238	144.6 Å²	144.6	93%	0.933	77%	0.769	S	S	*	*				-159.1	153.7	124.4	-98	-61.6	0	0	0	110.1
1138	S	28.9	Very low	32.2	Very low	97 Å²	97	147 Å²	147	68%	0.678	77%	0.77	S	S	*	*			trans	-106.8	140.6	-167.3	174.4	0	0	0	0	112.5
1139	T	34.4	Very low	32.2	Very low	140 Å²	140	147.2 Å²	147.2	86%	0.859	77%	0.767	S	S	*	*				-169.4	141.4	122.9	15.7	0	0	0	0	113.1
1140	N	30.4	Very low	32	Very low	148 Å²	148	145.3 Å²	145.3	79%	0.791	77%	0.767	S	S	*	*			trans	-87.2	174	167.9	-94	-57.8	0	0	0	109.3
1141	P	38.2	Very low	31.8	Very low	101 Å²	101	145.9 Å²	145.9	66%	0.656	77%	0.77	S	S	*	*			cis	-154.6	-176.1	34.5	44.8	-23.3	0	0	0	119.8
1142	I	31.8	Very low	31.5	Very low	143 Å²	143	144.8 Å²	144.8	73%	0.733	77%	0.77	S	S	*	*			trans	72.4	109.1	149.3	-79.9	157.1	0	0	0	117.1
1143	V	31.1	Very low	31.6	Very low	129 Å²	129	145.6 Å²	145.6	78%	0.782	78%	0.776	S	S	*	*				80.2	127.5	71.4	155.8	0	0	0	0	112.5
1144	S	30.9	Very low	31.6	Very low	79 Å²	79	141.9 Å²	141.9	55%	0.552	77%	0.771	S	S	*	*			cis	-170.3	165.2	-9	64.3	0	0	0	0	112.2
1145	K	30.7	Very low	31.5	Very low	196 Å²	196	141.9 Å²	141.9	85%	0.852	77%	0.766	S	S	*	*			trans	56.9	134.8	155.4	-62.3	160.5	-176.5	173	0	116.2
1146	S	30.3	Very low	31.3	Very low	98 Å²	98	141 Å²	141	69%	0.685	76%	0.762	S	S	*	*				-176.4	143.1	57.3	-161.3	0	0	0	0	113.1
1147	L	31.9	Very low	31.3	Very low	137 Å²	137	140.3 Å²	140.3	72%	0.717	76%	0.761	S	S	*	*			trans	51.8	117.7	147.8	-66.7	169.9	0	0	0	122.6
1148	K	33.9	Very low	31	Very low	167 Å²	167	137.3 Å²	137.3	73%	0.726	76%	0.761	S	S	*	*			trans	86.5	113.9	131.1	-71.7	171.5	173.4	170.7	0	121.4
1149	N	31.8	Very low	31	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	76%	0.762	S	S	*	*				89.6	113.5	130	-66.4	11.8	0	0	0	121.5
1150	T	31.5	Very low	30.7	Very low	128 Å²	128	143.3 Å²	143.3	79%	0.785	76%	0.763	S	S	*	*			trans	75	127.1	136.5	51.9	0	0	0	0	121.4
1151	N	29.7	Very low	30.6	Very low	155 Å²	155	141.4 Å²	141.4	83%	0.829	76%	0.761	S	S	*	*			trans	62.3	100.1	161.9	-69.8	3.1	0	0	0	119.4
1152	P	29.4	Very low	30.2	Very low	121 Å²	121	146.5 Å²	146.5	79%	0.786	77%	0.769	S	S	*	*			trans	-88.2	113.3	159.4	33.4	-28.1	0	0	0	111.4
1153	S	32.3	Very low	29.9	Very low	121 Å²	121	148.1 Å²	148.1	85%	0.846	77%	0.773	S	S	*	*			trans	-170.1	59.3	154.9	-80.1	0	0	0	0	111.1
1154	I	31.9	Very low	29.9	Very low	158 Å²	158	147 Å²	147	81%	0.81	77%	0.771	S	S	*	*			trans	-64.6	118.4	159.3	-69.8	160.9	0	0	0	105.4
1155	E	27.3	Very low	29.8	Very low	160 Å²	160	151.4 Å²	151.4	75%	0.748	79%	0.789	S	S	*	*				67.3	141.7	51.1	-155.7	-177.2	-130.4	0	0	112.7
1156	I	28.7	Very low	29.9	Very low	133 Å²	133	149.9 Å²	149.9	68%	0.682	79%	0.789	S	S	*	*			trans	64	131.9	179.6	-17.9	179.1	0	0	0	112.1
1157	M	29.8	Very low	30	Very low	160 Å²	160	150.3 Å²	150.3	79%	0.788	79%	0.792	S	S	*	*			cis	-138.4	111.9	26.5	-61.1	170.8	-159.6	0	0	113.6	K1159	M1157-K1159 HydrophobicContact CB-CB 4.11Å; M1157-K1159 PolarHBondContact O-N 3.37Å
1158	N	27.2	Very low	29.9	Very low	175 Å²	175	153.2 Å²	153.2	94%	0.936	80%	0.799	S	S	*	*			trans	-74.2	94.4	136.6	-96.8	-48.7	0	0	0	106.9
1159	K	29.1	Very low	29.9	Very low	161 Å²	161	150.2 Å²	150.2	70%	0.7	80%	0.799	S	S	*	*			trans	-161.8	73.1	175.5	-122.4	169.4	-172.2	-179.6	0	115.3	M1157	M1157-K1159 HydrophobicContact CB-CB 4.11Å; M1157-K1159 PolarHBondContact O-N 3.37Å
1160	F	27.2	Very low	30	Very low	201 Å²	201	148.1 Å²	148.1	88%	0.882	80%	0.795	S	S	*	*			trans	-141.3	51.8	149.9	-103.6	-68.2	0	0	0	111.4
1161	S	27.8	Very low	30.1	Very low	108 Å²	108	148.6 Å²	148.6	76%	0.755	79%	0.791	S	S	*	*			trans	-115.8	86.2	157	58.5	0	0	0	0	106.8
1162	Y	30	Very low	30.2	Very low	208 Å²	208	147.3 Å²	147.3	82%	0.816	79%	0.785	S	S	*	*			trans	-67.9	149	179.6	-124.4	-89.3	0	0	0	110.3
1163	Q	26.3	Very low	30.5	Very low	177 Å²	177	149.2 Å²	149.2	83%	0.827	78%	0.783	S	S	*	*			trans	-78.1	133.6	-171.8	-60.8	161	-77	0	0	111.8
1164	S	31.3	Very low	30.5	Very low	105 Å²	105	149.9 Å²	149.9	73%	0.734	78%	0.776	S	S	*	*			trans	-165.8	85.1	142.2	37.6	0	0	0	0	111.5	L1166	S1164-L1166 PolarHBondContact O-N 3.1Å; S1164-L1166 VanDerWaalsContact O-N 3.11Å
1165	N	27.1	Very low	30.4	Very low	172 Å²	172	149.3 Å²	149.3	92%	0.92	77%	0.774	S	S	*	*			trans	-69.9	98.1	154.1	-80.6	-19	0	0	0	107.5
1166	L	33.7	Very low	30.5	Very low	164 Å²	164	149 Å²	149	86%	0.859	77%	0.773	S	S	*	*			trans	-127	144.3	160.5	-79.3	177.9	0	0	0	110.3	S1164	S1164-L1166 PolarHBondContact O-N 3.1Å; S1164-L1166 VanDerWaalsContact O-N 3.11Å
1167	S	33.1	Very low	30.8	Very low	108 Å²	108	149.5 Å²	149.5	76%	0.755	77%	0.772	S	S	*	*			trans	-75.8	164	-159.7	49.9	0	0	0	0	114.7
1168	K	29.6	Very low	30.9	Very low	198 Å²	198	146.5 Å²	146.5	86%	0.861	77%	0.766	S	S	*	*			trans	-24.8	141.1	147.1	-54.2	173.6	177.6	179.4	0	111.1
1169	S	33.3	Very low	31.2	Very low	104 Å²	104	143.3 Å²	143.3	73%	0.727	76%	0.758	S	S	*	*				-177.1	174.8	59.2	53.6	0	0	0	0	113.9
1170	S	33.5	Very low	31.5	Very low	94 Å²	94	144.1 Å²	144.1	66%	0.657	76%	0.761	S	S	*	*			trans	90.6	115.5	145.7	-58.6	0	0	0	0	121.6
1171	I	34.8	Very low	32	Very low	137 Å²	137	140.2 Å²	140.2	70%	0.703	76%	0.756	S	S	*	*				82.7	96.1	129.3	-60.6	169.1	0	0	0	118.7
1172	D	30.6	Very low	32.2	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	76%	0.762	S	S	*	*				41.7	125.1	117.6	-37.5	-40.9	0	0	0	120.9
1173	H	35.3	Very low	32.2	Very low	160 Å²	160	137.1 Å²	137.1	74%	0.741	75%	0.752	S	S	*	*				-175.2	144.4	93.5	-114.1	-85.1	0	0	0	114.8
1174	L	32.5	Very low	32.5	Very low	136 Å²	136	134.4 Å²	134.4	71%	0.712	74%	0.743	S	S	*	*			trans	62.9	124.5	161	-51	-179.2	0	0	0	118.3
1175	L	29.5	Very low	32.5	Very low	146 Å²	146	139.5 Å²	139.5	76%	0.764	75%	0.747	S	S	*	*				66.4	113.1	63.1	-73.7	167	0	0	0	111.8
1176	E	31	Very low	32.8	Very low	153 Å²	153	138 Å²	138	72%	0.715	73%	0.733	S	S	*	*				-171.3	165.4	57.7	-82.1	-148.9	133	0	0	116
1177	H	35	Very low	32.8	Very low	143 Å²	143	136.5 Å²	136.5	66%	0.662	72%	0.724	S	S	*	*			trans	54.8	88.5	144.6	-68	112.7	0	0	0	125.2
1178	S	30.8	Very low	32.6	Very low	97 Å²	97	141.3 Å²	141.3	68%	0.678	73%	0.726	S	S	*	*				73.1	145.4	110.5	66.6	0	0	0	0	126
1179	S	34.2	Very low	33	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	71%	0.714	S	S	*	*			trans	75.3	93.7	147	41.9	0	0	0	0	123.2
1180	K	34.7	Very low	33.1	Very low	179 Å²	179	138.4 Å²	138.4	78%	0.778	72%	0.722	S	S	*	*			trans	36.2	148.4	133	-73.2	-177.9	178.3	173.9	0	123.3
1181	P	37.7	Very low	33	Very low	118 Å²	118	142.6 Å²	142.6	77%	0.766	73%	0.732	S	S	*	*			trans	-110.6	171.5	-166.4	43.1	-35.6	0	0	0	115.9
1182	N	31.1	Very low	33	Very low	163 Å²	163	145.3 Å²	145.3	87%	0.872	74%	0.741	S	S	*	*			trans	-166.1	155.8	149.1	-125.2	-26.5	0	0	0	117
1183	S	31.9	Very low	33.2	Very low	88 Å²	88	142.3 Å²	142.3	62%	0.615	73%	0.734	S	S	*	*			trans	74.4	108	140.2	-174.3	0	0	0	0	124.6
1184	L	32.2	Very low	33	Very low	121 Å²	121	141.9 Å²	141.9	63%	0.634	74%	0.735	S	S	*	*				44.3	141.8	125.6	-68.9	134.1	0	0	0	124	F1186	L1184-F1186 HydrophobicContact CB-CD2 4.38Å
1185	Y	31	Very low	33	Very low	211 Å²	211	142.2 Å²	142.2	83%	0.827	74%	0.738	S	S	*	*				-140.3	140.6	120.2	-80.8	-84.5	0	0	0	108.3
1186	F	32.6	Very low	33.2	Very low	141 Å²	141	148 Å²	148	62%	0.618	76%	0.764	S	S	*	*			cis	74.3	148.9	47.5	-80.6	-66.3	0	0	0	113.7	L1184	L1184-F1186 HydrophobicContact CB-CD2 4.38Å
1187	I	33.5	Very low	33.3	Very low	133 Å²	133	147.7 Å²	147.7	68%	0.682	77%	0.767	S	S	*	*			cis	-148.9	149	24.1	-117.4	139.6	0	0	0	108.3
1188	R	30.5	Very low	33.2	Very low	209 Å²	209	147.9 Å²	147.9	79%	0.789	77%	0.772	S	S	*	*				65.7	169.7	66.6	-102.8	-173.8	-171	-159.3	5.2	114.1
1189	P	37.3	Very low	33.3	Very low	95 Å²	95	150.8 Å²	150.8	62%	0.617	78%	0.777	S	S	*	*			cis	-134.6	-178.7	-25.4	39.8	-23.5	0	0	0	113.7
1190	T	35.8	Very low	33.3	Very low	146 Å²	146	153.3 Å²	153.3	90%	0.896	78%	0.779	S	S	*	*				-174.1	163.3	118.4	20.4	0	0	0	0	110.7
1191	Q	30.7	Very low	33.2	Very low	182 Å²	182	151.7 Å²	151.7	85%	0.85	78%	0.779	S	S	*	*			trans	-150.9	130.4	-169.9	-179.1	165.1	-2.5	0	0	112.1
1192	H	35.6	Very low	32.9	Very low	193 Å²	193	153.9 Å²	153.9	89%	0.894	78%	0.78	S	S	*	*			trans	-167	157.8	158.9	-91.7	-78.3	0	0	0	107.4
1193	A	33.8	Very low	33	Very low	66 Å²	66	153.3 Å²	153.3	55%	0.545	77%	0.773	S	S	.	*			cis	176.6	143	-33.5	0	0	0	0	0	107.6
1194	I	31.3	Very low	33.1	Very low	151 Å²	151	158.3 Å²	158.3	77%	0.774	79%	0.785	S	S	*	*			trans	76.3	141.4	153.3	-66.5	161.5	0	0	0	117.9
1195	D	32.7	Very low	33.2	Very low	144 Å²	144	161.4 Å²	161.4	77%	0.77	80%	0.798	S	S	*	*			trans	52.3	84.8	165.5	-57.2	-15.6	0	0	0	121.2
1196	M	33.1	Very low	33.4	Very low	266 Å²	266	156.9 Å²	156.9	100%	1.31	80%	0.795	S	S	*	*				-170.2	0	92.4	-97	-169.3	173.7	0	0	112.2

Retrieved 1,196 of 1,196 residues in 1330.4 ms (Link to these results)

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