PyMOL generated image of ligand binding residues prediction for T1124
Click here to download PDB file of this model with the superposition of all identified ligands.
Predicted ligand binding residues are shown as blue sticks in the image above.
Binding site: 163, 166, 167, 170, 173, 202, 203, 204, 208, 225, 229, 253, 254, 268, 269, 270, 272, 320
Most likely ligands at each site (Type): SAH
Centroid ligands at each site (TypeID): ERT390
All ligands in clusters (Type-Frequency): SAH-6, ERT-1, 56D-1, FE-1, AGI-1, SAM-1
Likely+centroid ligands at each site: SAH385
EC numbers: 2.1.1.-;2.1.1.4;
GO terms: 0000166;0005524;0008168;0008171;0016740;0017000;0032259;0046872;0005829;0006412;0017096;0030187;0034641;0044281;0046219;
JSmol view of ligand binding residues prediction for T1124
The server makes use of the FunFOLDQA Quality Assessment protocol for improved prediction selection:
Roche, D. B., Buenavista, M. T. & McGuffin, L. J. (2012) FunFOLDQA: A Quality Assessment Tool for Protein-Ligand Binding Site Residue Predictions. PLoS ONE, 7, e38219. PubMed
BDTalign = 0.5047693405450342
Identity = 0.21935794
Rescaled BLOSUM62 = 0.29699248
Equivalent Residue Ligand Distance = 0.30044383
Model Quality = 0.74330527
Predicted BDT score = 0.79639566
Predicted MCC score = 0.38598418
r=TYR; n=163; a=OH; | I=0.00000; O=0.50674; N=0.00000; P=0.00000; | SAH=0.43543; ERT=0.00122; 56D=0.00023; AGI=0.00247; SAM=0.06739;
r=TYR; n=163; a=HH; | I=0.01521; O=0.50491; N=0.00000; P=0.00000; | SAH=0.42782; ERT=0.00346; 56D=0.00123; FE=0.01521; AGI=0.00589; SAM=0.06650;
r=TYR; n=163; a=CZ; | I=0.00000; O=0.43304; N=0.00000; P=0.00000; | SAH=0.36997; ERT=0.00101; 56D=0.00018; AGI=0.00432; SAM=0.05757;
r=TYR; n=163; a=HE2; | I=0.08312; O=0.42836; N=0.00000; P=0.00000; | SAH=0.32732; ERT=0.01148; 56D=0.00663; FE=0.08312; AGI=0.03221; SAM=0.05071;
r=TYR; n=163; a=CD2; | I=0.00000; O=0.23073; N=0.00000; P=0.00000; | SAH=0.17007; ERT=0.00249; 56D=0.00132; AGI=0.02849; SAM=0.02836;
r=TYR; n=163; a=CE1; | I=0.00000; O=0.36659; N=0.00000; P=0.00000; | SAH=0.31831; AGI=0.00101; SAM=0.04726;
r=TYR; n=163; a=CE2; | I=0.02016; O=0.37839; N=0.00000; P=0.00000; | SAH=0.30528; ERT=0.00384; 56D=0.00192; FE=0.02016; AGI=0.01887; SAM=0.04848;
r=TYR; n=163; a=HE1; | I=0.00000; O=0.37380; N=0.00000; P=0.00000; | SAH=0.32706; SAM=0.04674;
r=TYR; n=163; a=O; | I=0.00000; O=0.04749; N=0.00000; P=0.00000; | SAH=0.03899; ERT=0.00022; AGI=0.00503; SAM=0.00324;
r=TYR; n=163; a=CG; | I=0.00000; O=0.16251; N=0.00000; P=0.00000; | SAH=0.12996; ERT=0.00029; AGI=0.01142; SAM=0.02083;
r=TYR; n=163; a=CD1; | I=0.00000; O=0.23052; N=0.00000; P=0.00000; | SAH=0.19775; AGI=0.00168; SAM=0.03109;
r=TYR; n=163; a=HD2; | I=0.02432; O=0.17393; N=0.00000; P=0.00000; | SAH=0.08955; ERT=0.00584; 56D=0.00380; FE=0.02432; AGI=0.05777; SAM=0.01697;
r=TYR; n=163; a=HD1; | I=0.00000; O=0.16426; N=0.00000; P=0.00000; | SAH=0.14013; AGI=0.00029; SAM=0.02384;
r=TYR; n=163; a=CB; | I=0.00000; O=0.07139; N=0.00000; P=0.00000; | SAH=0.03975; AGI=0.02527; SAM=0.00638;
r=TYR; n=163; a=CA; | I=0.00000; O=0.06741; N=0.00000; P=0.00000; | SAH=0.01670; ERT=0.00033; AGI=0.04811; SAM=0.00227;
r=TYR; n=163; a=C; | I=0.00000; O=0.03453; N=0.00000; P=0.00000; | SAH=0.02371; AGI=0.00843; SAM=0.00239;
r=TYR; n=163; a=HA; | I=0.00000; O=0.09979; N=0.00000; P=0.00000; | SAH=0.01470; ERT=0.00224; 56D=0.00084; AGI=0.07965; SAM=0.00236;
r=TYR; n=163; a=HB2; | I=0.00000; O=0.05310; N=0.00000; P=0.00000; | SAH=0.03537; AGI=0.01150; SAM=0.00623;
r=TYR; n=163; a=HB3; | I=0.00000; O=0.08864; N=0.00000; P=0.00000; | SAH=0.02631; ERT=0.00019; AGI=0.05742; SAM=0.00472;
r=TYR; n=163; a=N; | I=0.00000; O=0.18174; N=0.00000; P=0.00000; | SAH=0.00103; AGI=0.18071;
r=TYR; n=163; a=H; | I=0.00000; O=0.19308; N=0.00000; P=0.00000; | AGI=0.19308;
r=LEU; n=166; a=HG; | I=0.00000; O=0.14929; N=0.00000; P=0.00000; | SAH=0.01287; ERT=0.05890; 56D=0.02371; AGI=0.05110; SAM=0.00271;
r=LEU; n=166; a=C; | I=0.00000; O=0.02342; N=0.00000; P=0.00000; | SAH=0.00904; ERT=0.00751; 56D=0.00193; AGI=0.00396; SAM=0.00098;
r=LEU; n=166; a=O; | I=0.00000; O=0.03107; N=0.00000; P=0.00000; | SAH=0.00768; ERT=0.01527; 56D=0.00374; AGI=0.00257; SAM=0.00180;
r=LEU; n=166; a=CG; | I=0.00000; O=0.18538; N=0.00000; P=0.00000; | SAH=0.00313; ERT=0.06765; 56D=0.02490; AGI=0.08879; SAM=0.00090;
r=LEU; n=166; a=CD2; | I=0.02764; O=0.33524; N=0.00000; P=0.00000; | SAH=0.00358; ERT=0.09117; 56D=0.04910; FE=0.02764; AGI=0.18943; SAM=0.00197;
r=LEU; n=166; a=HB3; | I=0.00000; O=0.09016; N=0.00000; P=0.00000; | SAH=0.00688; ERT=0.01454; 56D=0.00553; AGI=0.06216; SAM=0.00104;
r=LEU; n=166; a=HD21; | I=0.04623; O=0.25582; N=0.00000; P=0.00000; | SAH=0.01205; ERT=0.05539; 56D=0.03551; FE=0.04623; AGI=0.14854; SAM=0.00432;
r=LEU; n=166; a=HD22; | I=0.08031; O=0.40242; N=0.00000; P=0.00000; | SAH=0.00538; ERT=0.12535; 56D=0.07334; FE=0.08031; AGI=0.19563; SAM=0.00272;
r=LEU; n=166; a=HD23; | I=0.01378; O=0.37743; N=0.00000; P=0.00000; | ERT=0.08392; 56D=0.04312; FE=0.01378; AGI=0.24984; SAM=0.00056;
r=LEU; n=166; a=N; | I=0.00000; O=0.02495; N=0.00000; P=0.00000; | ERT=0.00203; AGI=0.02293;
r=LEU; n=166; a=CA; | I=0.00000; O=0.03434; N=0.00000; P=0.00000; | ERT=0.01115; 56D=0.00248; AGI=0.02070;
r=LEU; n=166; a=CB; | I=0.00000; O=0.13125; N=0.00000; P=0.00000; | SAH=0.00057; ERT=0.03065; 56D=0.00977; AGI=0.09026;
r=LEU; n=166; a=CD1; | I=0.00000; O=0.18152; N=0.00000; P=0.00000; | ERT=0.09319; 56D=0.02208; AGI=0.06626;
r=LEU; n=166; a=H; | I=0.00000; O=0.03984; N=0.00000; P=0.00000; | ERT=0.00118; AGI=0.03866;
r=LEU; n=166; a=HA; | I=0.00000; O=0.03158; N=0.00000; P=0.00000; | ERT=0.01484; 56D=0.00190; AGI=0.01484;
r=LEU; n=166; a=HB2; | I=0.00000; O=0.15046; N=0.00000; P=0.00000; | ERT=0.02022; 56D=0.00597; AGI=0.12427;
r=LEU; n=166; a=HD11; | I=0.00000; O=0.26371; N=0.00000; P=0.00000; | SAH=0.00028; ERT=0.14092; 56D=0.03845; AGI=0.08405;
r=LEU; n=166; a=HD12; | I=0.00000; O=0.15359; N=0.00000; P=0.00000; | ERT=0.06595; 56D=0.01369; AGI=0.07395;
r=LEU; n=166; a=HD13; | I=0.00000; O=0.10685; N=0.00000; P=0.00000; | ERT=0.07102; 56D=0.01106; AGI=0.02478;
r=VAL; n=167; a=CG2; | I=0.00000; O=0.26703; N=0.00000; P=0.00000; | SAH=0.23502; ERT=0.00031; 56D=0.00023; SAM=0.03148;
r=VAL; n=167; a=HG21; | I=0.00000; O=0.21301; N=0.00000; P=0.00000; | SAH=0.18674; ERT=0.00032; 56D=0.00016; SAM=0.02580;
r=VAL; n=167; a=HG22; | I=0.00000; O=0.28197; N=0.00000; P=0.00000; | SAH=0.25039; ERT=0.00013; SAM=0.03145;
r=VAL; n=167; a=HG23; | I=0.00000; O=0.35738; N=0.00000; P=0.00000; | SAH=0.30887; ERT=0.00210; 56D=0.00088; AGI=0.00042; SAM=0.04511;
r=VAL; n=167; a=CA; | I=0.00000; O=0.07641; N=0.00000; P=0.00000; | SAH=0.06593; ERT=0.00116; 56D=0.00067; SAM=0.00866;
r=VAL; n=167; a=C; | I=0.00000; O=0.04491; N=0.00000; P=0.00000; | SAH=0.03696; ERT=0.00018; 56D=0.00029; SAM=0.00748;
r=VAL; n=167; a=O; | I=0.00000; O=0.07972; N=0.00000; P=0.00000; | SAH=0.06467; ERT=0.00102; 56D=0.00041; SAM=0.01362;
r=VAL; n=167; a=CB; | I=0.00000; O=0.14384; N=0.00000; P=0.00000; | SAH=0.12996; ERT=0.00017; 56D=0.00019; SAM=0.01353;
r=VAL; n=167; a=HA; | I=0.00000; O=0.12022; N=0.00000; P=0.00000; | SAH=0.09665; ERT=0.00482; 56D=0.00240; AGI=0.00129; SAM=0.01506;
r=VAL; n=167; a=HB; | I=0.00000; O=0.18019; N=0.00000; P=0.00000; | SAH=0.16268; ERT=0.00049; 56D=0.00021; AGI=0.00025; SAM=0.01656;
r=VAL; n=167; a=CG1; | I=0.00000; O=0.08076; N=0.00000; P=0.00000; | SAH=0.07547; SAM=0.00530;
r=VAL; n=167; a=HG12; | I=0.00000; O=0.05365; N=0.00000; P=0.00000; | SAH=0.04981; SAM=0.00384;
r=VAL; n=167; a=HG13; | I=0.00000; O=0.11609; N=0.00000; P=0.00000; | SAH=0.10848; SAM=0.00761;
r=VAL; n=167; a=N; | I=0.00000; O=0.03251; N=0.00000; P=0.00000; | SAH=0.02581; ERT=0.00207; 56D=0.00078; AGI=0.00100; SAM=0.00285;
r=VAL; n=167; a=H; | I=0.00000; O=0.03314; N=0.00000; P=0.00000; | SAH=0.02780; ERT=0.00100; 56D=0.00025; AGI=0.00184; SAM=0.00226;
r=VAL; n=167; a=HG11; | I=0.00000; O=0.04590; N=0.00000; P=0.00000; | SAH=0.04386; SAM=0.00205;
r=ILE; n=170; a=HG12; | I=0.00000; O=0.16714; N=0.00000; P=0.00000; | SAH=0.09948; ERT=0.03751; 56D=0.01031; AGI=0.00200; SAM=0.01784;
r=ILE; n=170; a=HD11; | I=0.03240; O=0.31219; N=0.00000; P=0.00000; | SAH=0.11044; ERT=0.10189; 56D=0.04822; FE=0.03240; AGI=0.03041; SAM=0.02122;
r=ILE; n=170; a=HD13; | I=0.02114; O=0.28396; N=0.00000; P=0.00000; | SAH=0.15983; ERT=0.05124; 56D=0.02422; FE=0.02114; AGI=0.01830; SAM=0.03038;
r=ILE; n=170; a=O; | I=0.00000; O=0.12857; N=0.00000; P=0.00000; | SAH=0.03558; ERT=0.08359; 56D=0.00373; AGI=0.00012; SAM=0.00556;
r=ILE; n=170; a=CG1; | I=0.00000; O=0.13913; N=0.00000; P=0.00000; | SAH=0.05379; ERT=0.05220; 56D=0.01583; AGI=0.00547; SAM=0.01184;
r=ILE; n=170; a=CD1; | I=0.01863; O=0.25738; N=0.00000; P=0.00000; | SAH=0.09669; ERT=0.08093; 56D=0.03517; FE=0.01863; AGI=0.02477; SAM=0.01981;
r=ILE; n=170; a=HG13; | I=0.00000; O=0.09022; N=0.00000; P=0.00000; | SAH=0.03883; ERT=0.02920; 56D=0.00938; AGI=0.00344; SAM=0.00937;
r=ILE; n=170; a=HD12; | I=0.03391; O=0.24722; N=0.00000; P=0.00000; | SAH=0.05326; ERT=0.09372; 56D=0.04437; FE=0.03391; AGI=0.04446; SAM=0.01141;
r=ILE; n=170; a=C; | I=0.00000; O=0.07756; N=0.00000; P=0.00000; | SAH=0.02309; ERT=0.04735; 56D=0.00217; SAM=0.00495;
r=ILE; n=170; a=CB; | I=0.00000; O=0.14634; N=0.00000; P=0.00000; | SAH=0.01559; ERT=0.09999; 56D=0.01983; AGI=0.00655; SAM=0.00438;
r=ILE; n=170; a=HB; | I=0.00000; O=0.20050; N=0.00000; P=0.00000; | SAH=0.01953; ERT=0.13863; 56D=0.02923; AGI=0.00848; SAM=0.00463;
r=ILE; n=170; a=N; | I=0.00000; O=0.03151; N=0.00000; P=0.00000; | SAH=0.00417; ERT=0.02366; 56D=0.00191; SAM=0.00177;
r=ILE; n=170; a=CA; | I=0.00000; O=0.07041; N=0.00000; P=0.00000; | SAH=0.00731; ERT=0.05491; 56D=0.00469; AGI=0.00084; SAM=0.00266;
r=ILE; n=170; a=H; | I=0.00000; O=0.03119; N=0.00000; P=0.00000; | SAH=0.01015; ERT=0.01446; 56D=0.00189; SAM=0.00468;
r=ILE; n=170; a=CG2; | I=0.00000; O=0.20207; N=0.00000; P=0.00000; | SAH=0.00312; ERT=0.15043; 56D=0.02909; AGI=0.01834; SAM=0.00108;
r=ILE; n=170; a=HG21; | I=0.00000; O=0.29133; N=0.00000; P=0.00000; | SAH=0.00480; ERT=0.18369; 56D=0.05716; AGI=0.04440; SAM=0.00128;
r=ILE; n=170; a=HG22; | I=0.00000; O=0.16073; N=0.00000; P=0.00000; | SAH=0.00236; ERT=0.12206; 56D=0.02037; AGI=0.01533; SAM=0.00061;
r=ILE; n=170; a=HA; | I=0.00000; O=0.09984; N=0.00000; P=0.00000; | SAH=0.00115; ERT=0.09305; 56D=0.00415; AGI=0.00080; SAM=0.00068;
r=ILE; n=170; a=HG23; | I=0.00000; O=0.21471; N=0.00000; P=0.00000; | ERT=0.18206; 56D=0.01953; AGI=0.01287; SAM=0.00024;
r=TRP; n=173; a=HE3; | I=0.00000; O=0.34265; N=0.00000; P=0.00000; | SAH=0.09155; ERT=0.16728; 56D=0.05712; AGI=0.01338; SAM=0.01332;
r=TRP; n=173; a=CE3; | I=0.00000; O=0.32698; N=0.00000; P=0.00000; | SAH=0.03334; ERT=0.20335; 56D=0.06489; AGI=0.01993; SAM=0.00547;
r=TRP; n=173; a=HB3; | I=0.00000; O=0.27392; N=0.00000; P=0.00000; | SAH=0.07777; ERT=0.17462; 56D=0.01420; AGI=0.00029; SAM=0.00705;
r=TRP; n=173; a=HZ3; | I=0.15869; O=0.36868; N=0.00000; P=0.00000; | SAH=0.04595; ERT=0.16582; 56D=0.09104; FE=0.15869; AGI=0.05739; SAM=0.00848;
r=TRP; n=173; a=CA; | I=0.00000; O=0.30150; N=0.00000; P=0.00000; | SAH=0.01787; ERT=0.27919; 56D=0.00376; SAM=0.00068;
r=TRP; n=173; a=C; | I=0.00000; O=0.28049; N=0.00000; P=0.00000; | SAH=0.03771; ERT=0.24087; 56D=0.00109; SAM=0.00081;
r=TRP; n=173; a=O; | I=0.00000; O=0.30593; N=0.00000; P=0.00000; | SAH=0.02248; ERT=0.28265; 56D=0.00080;
r=TRP; n=173; a=CB; | I=0.00000; O=0.30467; N=0.00000; P=0.00000; | SAH=0.03553; ERT=0.24851; 56D=0.01790; AGI=0.00019; SAM=0.00253;
r=TRP; n=173; a=CG; | I=0.00000; O=0.35971; N=0.00000; P=0.00000; | SAH=0.01058; ERT=0.31242; 56D=0.03393; AGI=0.00164; SAM=0.00115;
r=TRP; n=173; a=CD2; | I=0.00000; O=0.34785; N=0.00000; P=0.00000; | SAH=0.01064; ERT=0.27061; 56D=0.05549; AGI=0.00949; SAM=0.00161;
r=TRP; n=173; a=CZ3; | I=0.04410; O=0.34593; N=0.00000; P=0.00000; | SAH=0.02036; ERT=0.19527; 56D=0.08365; FE=0.04410; AGI=0.04295; SAM=0.00370;
r=TRP; n=173; a=H; | I=0.00000; O=0.22066; N=0.00000; P=0.00000; | SAH=0.01840; ERT=0.19892; 56D=0.00178; SAM=0.00156;
r=TRP; n=173; a=HB2; | I=0.00000; O=0.31724; N=0.00000; P=0.00000; | SAH=0.04484; ERT=0.24486; 56D=0.02472; AGI=0.00018; SAM=0.00264;
r=TRP; n=173; a=N; | I=0.00000; O=0.25697; N=0.00000; P=0.00000; | SAH=0.01134; ERT=0.24393; 56D=0.00130; SAM=0.00039;
r=TRP; n=173; a=CH2; | I=0.02938; O=0.48055; N=0.00000; P=0.00000; | SAH=0.00305; ERT=0.29903; 56D=0.11707; FE=0.02938; AGI=0.06074; SAM=0.00066;
r=TRP; n=173; a=HH2; | I=0.07503; O=0.50169; N=0.00000; P=0.00000; | SAH=0.00178; ERT=0.28386; 56D=0.13324; FE=0.07503; AGI=0.08245; SAM=0.00036;
r=TRP; n=173; a=CE2; | I=0.00000; O=0.47610; N=0.00000; P=0.00000; | SAH=0.00094; ERT=0.39093; 56D=0.06779; AGI=0.01645;
r=TRP; n=173; a=NE1; | I=0.00000; O=0.50779; N=0.00000; P=0.00000; | ERT=0.46271; 56D=0.04061; AGI=0.00447;
r=TRP; n=173; a=CZ2; | I=0.00000; O=0.50989; N=0.00000; P=0.00000; | SAH=0.00021; ERT=0.38126; 56D=0.08999; AGI=0.03843;
r=TRP; n=173; a=HZ2; | I=0.00000; O=0.47537; N=0.00000; P=0.00000; | ERT=0.37769; 56D=0.06515; AGI=0.03253;
r=TRP; n=173; a=CD1; | I=0.00000; O=0.49286; N=0.00000; P=0.00000; | SAH=0.00097; ERT=0.46197; 56D=0.02879; AGI=0.00113;
r=TRP; n=173; a=HE1; | I=0.00000; O=0.46657; N=0.00000; P=0.00000; | ERT=0.44035; 56D=0.02363; AGI=0.00260;
r=TRP; n=173; a=HA; | I=0.00000; O=0.40115; N=0.00000; P=0.00000; | SAH=0.00398; ERT=0.39339; 56D=0.00378;
r=TRP; n=173; a=HD1; | I=0.00000; O=0.48471; N=0.00000; P=0.00000; | SAH=0.00030; ERT=0.47347; 56D=0.01094;
r=GLY; n=202; a=N; | I=0.00000; O=0.25480; N=0.00000; P=0.00000; | SAH=0.22417; SAM=0.03063;
r=GLY; n=202; a=CA; | I=0.00000; O=0.44933; N=0.00000; P=0.00000; | SAH=0.39259; SAM=0.05674;
r=GLY; n=202; a=C; | I=0.00000; O=0.42352; N=0.00000; P=0.00000; | SAH=0.37545; SAM=0.04807;
r=GLY; n=202; a=O; | I=0.00000; O=0.53112; N=0.00000; P=0.00000; | SAH=0.47171; ERT=0.00017; SAM=0.05924;
r=GLY; n=202; a=H; | I=0.00000; O=0.21161; N=0.00000; P=0.00000; | SAH=0.18467; SAM=0.02694;
r=GLY; n=202; a=HA2; | I=0.00000; O=0.52721; N=0.00000; P=0.00000; | SAH=0.45975; SAM=0.06746;
r=GLY; n=202; a=HA3; | I=0.00000; O=0.50478; N=0.00000; P=0.00000; | SAH=0.43681; SAM=0.06797;
r=CYS; n=203; a=N; | I=0.00000; O=0.25935; N=0.00000; P=0.00000; | SAH=0.23277; SAM=0.02658;
r=CYS; n=203; a=CA; | I=0.00000; O=0.21811; N=0.00000; P=0.00000; | SAH=0.19741; SAM=0.02070;
r=CYS; n=203; a=C; | I=0.00000; O=0.32040; N=0.00000; P=0.00000; | SAH=0.28839; SAM=0.03200;
r=CYS; n=203; a=O; | I=0.00000; O=0.33110; N=0.00000; P=0.00000; | SAH=0.29845; SAM=0.03265;
r=CYS; n=203; a=CB; | I=0.00000; O=0.07425; N=0.00000; P=0.00000; | SAH=0.06795; SAM=0.00629;
r=CYS; n=203; a=SG; | I=0.00000; O=0.03820; N=0.00000; P=0.00000; | SAH=0.03535; SAM=0.00285;
r=CYS; n=203; a=H; | I=0.00000; O=0.18916; N=0.00000; P=0.00000; | SAH=0.17015; SAM=0.01901;
r=CYS; n=203; a=HA; | I=0.00000; O=0.26449; N=0.00000; P=0.00000; | SAH=0.24060; SAM=0.02389;
r=CYS; n=203; a=HB2; | I=0.00000; O=0.05306; N=0.00000; P=0.00000; | SAH=0.04887; SAM=0.00419;
r=CYS; n=203; a=HB3; | I=0.00000; O=0.08821; N=0.00000; P=0.00000; | SAH=0.08151; SAM=0.00670;
r=CYS; n=203; a=HG; | I=0.00000; O=0.01916; N=0.00000; P=0.00000; | SAH=0.01743; SAM=0.00173;
r=GLY; n=204; a=N; | I=0.00000; O=0.35201; N=0.00000; P=0.00000; | SAH=0.31396; SAM=0.03805;
r=GLY; n=204; a=CA; | I=0.00000; O=0.33847; N=0.00000; P=0.00000; | SAH=0.30081; SAM=0.03765;
r=GLY; n=204; a=C; | I=0.00000; O=0.16627; N=0.00000; P=0.00000; | SAH=0.14952; SAM=0.01675;
r=GLY; n=204; a=O; | I=0.00000; O=0.09615; N=0.00000; P=0.00000; | SAH=0.08840; SAM=0.00775;
r=GLY; n=204; a=H; | I=0.00000; O=0.36069; N=0.00000; P=0.00000; | SAH=0.31991; SAM=0.04077;
r=GLY; n=204; a=HA2; | I=0.00000; O=0.33342; N=0.00000; P=0.00000; | SAH=0.29515; SAM=0.03827;
r=GLY; n=204; a=HA3; | I=0.00000; O=0.44444; N=0.00000; P=0.00000; | SAH=0.39375; ERT=0.00020; SAM=0.05050;
r=TYR; n=208; a=N; | I=0.00000; O=0.28503; N=0.00000; P=0.00000; | SAH=0.27227; ERT=0.00677; SAM=0.00599;
r=TYR; n=208; a=CA; | I=0.00000; O=0.24030; N=0.00000; P=0.00000; | SAH=0.22859; ERT=0.00870; SAM=0.00302;
r=TYR; n=208; a=C; | I=0.00000; O=0.09893; N=0.00000; P=0.00000; | SAH=0.09784; ERT=0.00109;
r=TYR; n=208; a=CB; | I=0.00000; O=0.41469; N=0.00000; P=0.00000; | SAH=0.39149; ERT=0.01352; SAM=0.00968;
r=TYR; n=208; a=CG; | I=0.00000; O=0.52934; N=0.00000; P=0.00000; | SAH=0.46596; ERT=0.03898; SAM=0.02441;
r=TYR; n=208; a=CD1; | I=0.00000; O=0.45414; N=0.00000; P=0.00000; | SAH=0.37721; ERT=0.06429; SAM=0.01265;
r=TYR; n=208; a=CD2; | I=0.00000; O=0.56730; N=0.00000; P=0.00000; | SAH=0.48621; ERT=0.03632; SAM=0.04477;
r=TYR; n=208; a=CE1; | I=0.00000; O=0.45456; N=0.00000; P=0.00000; | SAH=0.34202; ERT=0.09492; 56D=0.00068; SAM=0.01694;
r=TYR; n=208; a=CE2; | I=0.00000; O=0.50280; N=0.00000; P=0.00000; | SAH=0.41364; ERT=0.04749; 56D=0.00111; SAM=0.04056;
r=TYR; n=208; a=CZ; | I=0.00000; O=0.50292; N=0.00000; P=0.00000; | SAH=0.38543; ERT=0.08303; 56D=0.00275; SAM=0.03172;
r=TYR; n=208; a=OH; | I=0.00000; O=0.44807; N=0.00000; P=0.00000; | SAH=0.30024; ERT=0.10938; 56D=0.01237; AGI=0.00024; SAM=0.02585;
r=TYR; n=208; a=H; | I=0.00000; O=0.41162; N=0.00000; P=0.00000; | SAH=0.38693; ERT=0.00757; SAM=0.01712;
r=TYR; n=208; a=HA; | I=0.00000; O=0.18982; N=0.00000; P=0.00000; | SAH=0.17081; ERT=0.01752; SAM=0.00149;
r=TYR; n=208; a=HB2; | I=0.00000; O=0.46556; N=0.00000; P=0.00000; | SAH=0.44311; ERT=0.00591; SAM=0.01654;
r=TYR; n=208; a=HB3; | I=0.00000; O=0.28514; N=0.00000; P=0.00000; | SAH=0.27188; ERT=0.00952; SAM=0.00374;
r=TYR; n=208; a=HD1; | I=0.00000; O=0.29442; N=0.00000; P=0.00000; | SAH=0.24199; ERT=0.04878; SAM=0.00366;
r=TYR; n=208; a=HD2; | I=0.00000; O=0.53001; N=0.00000; P=0.00000; | SAH=0.46435; ERT=0.01943; SAM=0.04623;
r=TYR; n=208; a=HE1; | I=0.00000; O=0.35012; N=0.00000; P=0.00000; | SAH=0.22545; ERT=0.11598; 56D=0.00129; SAM=0.00740;
r=TYR; n=208; a=HE2; | I=0.00000; O=0.49001; N=0.00000; P=0.00000; | SAH=0.40483; ERT=0.03979; 56D=0.00226; SAM=0.04314;
r=TYR; n=208; a=HH; | I=0.00000; O=0.37881; N=0.00000; P=0.00000; | SAH=0.21806; ERT=0.12887; 56D=0.01587; AGI=0.00011; SAM=0.01590;
r=TYR; n=208; a=O; | I=0.00000; O=0.03110; N=0.00000; P=0.00000; | SAH=0.03041; ERT=0.00069;
r=ASP; n=225; a=OD2; | I=0.00000; O=0.42389; N=0.00000; P=0.00000; | SAH=0.37205; SAM=0.05184;
r=ASP; n=225; a=CG; | I=0.00000; O=0.39717; N=0.00000; P=0.00000; | SAH=0.34432; SAM=0.05286;
r=ASP; n=225; a=HB3; | I=0.00000; O=0.15646; N=0.00000; P=0.00000; | SAH=0.13910; SAM=0.01736;
r=ASP; n=225; a=OD1; | I=0.00000; O=0.44724; N=0.00000; P=0.00000; | SAH=0.38314; SAM=0.06410;
r=ASP; n=225; a=CA; | I=0.00000; O=0.18198; N=0.00000; P=0.00000; | SAH=0.15305; SAM=0.02892;
r=ASP; n=225; a=CB; | I=0.00000; O=0.19789; N=0.00000; P=0.00000; | SAH=0.17202; SAM=0.02587;
r=ASP; n=225; a=HA; | I=0.00000; O=0.30462; N=0.00000; P=0.00000; | SAH=0.25385; SAM=0.05077;
r=ASP; n=225; a=HB2; | I=0.00000; O=0.10956; N=0.00000; P=0.00000; | SAH=0.09598; SAM=0.01358;
r=ASP; n=225; a=C; | I=0.00000; O=0.13542; N=0.00000; P=0.00000; | SAH=0.11113; SAM=0.02429;
r=ASP; n=225; a=N; | I=0.00000; O=0.12757; N=0.00000; P=0.00000; | SAH=0.10734; SAM=0.02023;
r=ASP; n=225; a=O; | I=0.00000; O=0.09005; N=0.00000; P=0.00000; | SAH=0.07172; SAM=0.01832;
r=ASP; n=225; a=H; | I=0.00000; O=0.09241; N=0.00000; P=0.00000; | SAH=0.07631; SAM=0.01610;
r=ILE; n=229; a=HG23; | I=0.00000; O=0.28051; N=0.00000; P=0.00000; | SAH=0.24877; SAM=0.03174;
r=ILE; n=229; a=CG2; | I=0.00000; O=0.19800; N=0.00000; P=0.00000; | SAH=0.17707; SAM=0.02093;
r=ILE; n=229; a=HG21; | I=0.00000; O=0.18294; N=0.00000; P=0.00000; | SAH=0.16634; SAM=0.01659;
r=ILE; n=229; a=HG22; | I=0.00000; O=0.15585; N=0.00000; P=0.00000; | SAH=0.14075; SAM=0.01510;
r=ILE; n=229; a=HG12; | I=0.00000; O=0.24797; N=0.00000; P=0.00000; | SAH=0.21403; SAM=0.03394;
r=ILE; n=229; a=CB; | I=0.00000; O=0.12933; N=0.00000; P=0.00000; | SAH=0.11258; SAM=0.01675;
r=ILE; n=229; a=CG1; | I=0.00000; O=0.15808; N=0.00000; P=0.00000; | SAH=0.13522; SAM=0.02286;
r=ILE; n=229; a=CD1; | I=0.00000; O=0.14831; N=0.00000; P=0.00000; | SAH=0.13005; SAM=0.01825;
r=ILE; n=229; a=HB; | I=0.00000; O=0.11988; N=0.00000; P=0.00000; | SAH=0.10315; SAM=0.01673;
r=ILE; n=229; a=HD11; | I=0.00000; O=0.14005; N=0.00000; P=0.00000; | SAH=0.12108; SAM=0.01897;
r=ILE; n=229; a=HD13; | I=0.00000; O=0.19800; N=0.00000; P=0.00000; | SAH=0.17678; SAM=0.02122;
r=ILE; n=229; a=CA; | I=0.00000; O=0.05880; N=0.00000; P=0.00000; | SAH=0.05201; SAM=0.00679;
r=ILE; n=229; a=HG13; | I=0.00000; O=0.10281; N=0.00000; P=0.00000; | SAH=0.08547; SAM=0.01735;
r=ILE; n=229; a=HD12; | I=0.00000; O=0.09463; N=0.00000; P=0.00000; | SAH=0.08439; SAM=0.01024;
r=ILE; n=229; a=C; | I=0.00000; O=0.03359; N=0.00000; P=0.00000; | SAH=0.03029; SAM=0.00330;
r=ILE; n=229; a=O; | I=0.00000; O=0.02609; N=0.00000; P=0.00000; | SAH=0.02432; SAM=0.00177;
r=ILE; n=229; a=HA; | I=0.00000; O=0.05555; N=0.00000; P=0.00000; | SAH=0.05045; SAM=0.00510;
r=ILE; n=229; a=N; | I=0.00000; O=0.04065; N=0.00000; P=0.00000; | SAH=0.03429; SAM=0.00636;
r=ILE; n=229; a=H; | I=0.00000; O=0.04044; N=0.00000; P=0.00000; | SAH=0.03259; SAM=0.00785;
r=PHE; n=253; a=CE1; | I=0.00000; O=0.61224; N=0.00000; P=0.00000; | SAH=0.51246; SAM=0.09978;
r=PHE; n=253; a=CZ; | I=0.00000; O=0.56472; N=0.00000; P=0.00000; | SAH=0.47126; SAM=0.09347;
r=PHE; n=253; a=HE1; | I=0.00000; O=0.68321; N=0.00000; P=0.00000; | SAH=0.57484; SAM=0.10838;
r=PHE; n=253; a=HZ; | I=0.00000; O=0.54975; N=0.00000; P=0.00000; | SAH=0.46164; SAM=0.08811;
r=PHE; n=253; a=CD1; | I=0.00000; O=0.55465; N=0.00000; P=0.00000; | SAH=0.45974; SAM=0.09491;
r=PHE; n=253; a=HD1; | I=0.00000; O=0.51985; N=0.00000; P=0.00000; | SAH=0.43104; SAM=0.08881;
r=PHE; n=253; a=CG; | I=0.00000; O=0.49024; N=0.00000; P=0.00000; | SAH=0.39879; SAM=0.09145;
r=PHE; n=253; a=CD2; | I=0.00000; O=0.43903; N=0.00000; P=0.00000; | SAH=0.35198; SAM=0.08705;
r=PHE; n=253; a=CE2; | I=0.00000; O=0.49366; N=0.00000; P=0.00000; | SAH=0.40227; SAM=0.09139;
r=PHE; n=253; a=HB2; | I=0.00000; O=0.33098; N=0.00000; P=0.00000; | SAH=0.26468; SAM=0.06630;
r=PHE; n=253; a=HE2; | I=0.00000; O=0.37311; N=0.00000; P=0.00000; | SAH=0.30111; SAM=0.07200;
r=PHE; n=253; a=CB; | I=0.00000; O=0.36642; N=0.00000; P=0.00000; | SAH=0.28886; SAM=0.07757;
r=PHE; n=253; a=H; | I=0.00000; O=0.44963; N=0.00000; P=0.00000; | SAH=0.35465; SAM=0.09498;
r=PHE; n=253; a=N; | I=0.00000; O=0.38485; N=0.00000; P=0.00000; | SAH=0.28882; SAM=0.09602;
r=PHE; n=253; a=CA; | I=0.00000; O=0.30122; N=0.00000; P=0.00000; | SAH=0.21990; SAM=0.08132;
r=PHE; n=253; a=C; | I=0.00000; O=0.19791; N=0.00000; P=0.00000; | SAH=0.13192; SAM=0.06599;
r=PHE; n=253; a=O; | I=0.00000; O=0.09834; N=0.00000; P=0.00000; | SAH=0.06001; SAM=0.03833;
r=PHE; n=253; a=HA; | I=0.00000; O=0.17071; N=0.00000; P=0.00000; | SAH=0.11386; SAM=0.05685;
r=PHE; n=253; a=HB3; | I=0.00000; O=0.25919; N=0.00000; P=0.00000; | SAH=0.20111; SAM=0.05808;
r=PHE; n=253; a=HD2; | I=0.00000; O=0.30990; N=0.00000; P=0.00000; | SAH=0.24049; SAM=0.06941;
r=TRP; n=254; a=HE1; | I=0.00000; O=0.39371; N=0.00000; P=0.00000; | SAH=0.31294; SAM=0.08077;
r=TRP; n=254; a=N; | I=0.00000; O=0.22998; N=0.00000; P=0.00000; | SAH=0.15430; SAM=0.07568;
r=TRP; n=254; a=CA; | I=0.00000; O=0.13172; N=0.00000; P=0.00000; | SAH=0.07660; SAM=0.05512;
r=TRP; n=254; a=C; | I=0.00000; O=0.05359; N=0.00000; P=0.00000; | SAH=0.02149; SAM=0.03210;
r=TRP; n=254; a=CB; | I=0.00000; O=0.15146; N=0.00000; P=0.00000; | SAH=0.09359; SAM=0.05788;
r=TRP; n=254; a=CG; | I=0.00000; O=0.21208; N=0.00000; P=0.00000; | SAH=0.15175; SAM=0.06034;
r=TRP; n=254; a=CD1; | I=0.00000; O=0.29810; N=0.00000; P=0.00000; | SAH=0.22361; SAM=0.07449;
r=TRP; n=254; a=CD2; | I=0.00000; O=0.18091; N=0.00000; P=0.00000; | SAH=0.13414; SAM=0.04677;
r=TRP; n=254; a=CE2; | I=0.00000; O=0.21662; N=0.00000; P=0.00000; | SAH=0.16732; SAM=0.04930;
r=TRP; n=254; a=CE3; | I=0.00000; O=0.10329; N=0.00000; P=0.00000; | SAH=0.07950; SAM=0.02379;
r=TRP; n=254; a=NE1; | I=0.00000; O=0.32040; N=0.00000; P=0.00000; | SAH=0.24824; SAM=0.07216;
r=TRP; n=254; a=CZ2; | I=0.00000; O=0.17068; N=0.00000; P=0.00000; | SAH=0.13875; SAM=0.03193;
r=TRP; n=254; a=CH2; | I=0.00000; O=0.10463; N=0.00000; P=0.00000; | SAH=0.09135; SAM=0.01329;
r=TRP; n=254; a=H; | I=0.00000; O=0.31598; N=0.00000; P=0.00000; | SAH=0.22804; SAM=0.08794;
r=TRP; n=254; a=HA; | I=0.00000; O=0.10602; N=0.00000; P=0.00000; | SAH=0.06608; SAM=0.03995;
r=TRP; n=254; a=HB2; | I=0.00000; O=0.09161; N=0.00000; P=0.00000; | SAH=0.05020; SAM=0.04141;
r=TRP; n=254; a=HB3; | I=0.00000; O=0.15543; N=0.00000; P=0.00000; | SAH=0.09278; SAM=0.06265;
r=TRP; n=254; a=HD1; | I=0.00000; O=0.32574; N=0.00000; P=0.00000; | SAH=0.24356; SAM=0.08218;
r=TRP; n=254; a=HE3; | I=0.00000; O=0.07107; N=0.00000; P=0.00000; | SAH=0.05186; SAM=0.01922;
r=TRP; n=254; a=HZ2; | I=0.00000; O=0.17249; N=0.00000; P=0.00000; | SAH=0.14283; SAM=0.02966;
r=TRP; n=254; a=CZ3; | I=0.00000; O=0.08751; N=0.00000; P=0.00000; | SAH=0.07476; SAM=0.01275;
r=TRP; n=254; a=HH2; | I=0.00000; O=0.08489; N=0.00000; P=0.00000; | SAH=0.07799; SAM=0.00691;
r=TRP; n=254; a=O; | I=0.00000; O=0.03661; N=0.00000; P=0.00000; | SAH=0.00922; SAM=0.02740;
r=TRP; n=254; a=HZ3; | I=0.00000; O=0.04842; N=0.00000; P=0.00000; | SAH=0.04361; SAM=0.00481;
r=ALA; n=268; a=N; | I=0.00000; O=0.28231; N=0.00000; P=0.00000; | SAH=0.26121; ERT=0.00048; SAM=0.02061;
r=ALA; n=268; a=CA; | I=0.00000; O=0.36708; N=0.00000; P=0.00000; | SAH=0.33209; ERT=0.00382; 56D=0.00169; AGI=0.00033; SAM=0.02915;
r=ALA; n=268; a=C; | I=0.01444; O=0.37007; N=0.00000; P=0.00000; | SAH=0.31841; ERT=0.00780; 56D=0.00573; FE=0.01444; AGI=0.00250; SAM=0.03563;
r=ALA; n=268; a=O; | I=0.01831; O=0.42498; N=0.00000; P=0.00000; | SAH=0.36590; ERT=0.00694; 56D=0.00355; FE=0.01831; AGI=0.00278; SAM=0.04581;
r=ALA; n=268; a=CB; | I=0.00000; O=0.45118; N=0.00000; P=0.00000; | SAH=0.40355; ERT=0.00958; 56D=0.00112; AGI=0.00013; SAM=0.03680;
r=ALA; n=268; a=H; | I=0.00000; O=0.29517; N=0.00000; P=0.00000; | SAH=0.27086; ERT=0.00033; SAM=0.02398;
r=ALA; n=268; a=HA; | I=0.00000; O=0.26985; N=0.00000; P=0.00000; | SAH=0.24587; ERT=0.00418; 56D=0.00275; AGI=0.00030; SAM=0.01675;
r=ALA; n=268; a=HB1; | I=0.00000; O=0.44256; N=0.00000; P=0.00000; | SAH=0.40532; ERT=0.00898; 56D=0.00017; SAM=0.02809;
r=ALA; n=268; a=HB2; | I=0.00000; O=0.45923; N=0.00000; P=0.00000; | SAH=0.39450; ERT=0.02381; 56D=0.00373; AGI=0.00023; SAM=0.03696;
r=ALA; n=268; a=HB3; | I=0.00000; O=0.49426; N=0.00000; P=0.00000; | SAH=0.44171; ERT=0.00674; 56D=0.00049; AGI=0.00011; SAM=0.04522;
r=ASN; n=269; a=N; | I=0.05167; O=0.28597; N=0.00000; P=0.00000; | SAH=0.22280; ERT=0.01441; 56D=0.01700; FE=0.05167; AGI=0.00646; SAM=0.02530;
r=ASN; n=269; a=CA; | I=0.32755; O=0.27820; N=0.00000; P=0.00000; | SAH=0.17824; ERT=0.02391; 56D=0.03206; FE=0.32755; AGI=0.01759; SAM=0.02640;
r=ASN; n=269; a=C; | I=0.47168; O=0.24168; N=0.00000; P=0.00000; | SAH=0.16741; ERT=0.01376; 56D=0.01643; FE=0.47168; AGI=0.01670; SAM=0.02737;
r=ASN; n=269; a=O; | I=0.71509; O=0.28346; N=0.00000; P=0.00000; | SAH=0.19477; ERT=0.01555; 56D=0.01785; FE=0.71509; AGI=0.02343; SAM=0.03187;
r=ASN; n=269; a=CB; | I=0.37722; O=0.38010; N=0.00000; P=0.00000; | SAH=0.23166; ERT=0.04065; 56D=0.04548; FE=0.37722; AGI=0.02565; SAM=0.03665;
r=ASN; n=269; a=CG; | I=0.15204; O=0.37961; N=0.00000; P=0.00000; | SAH=0.20453; ERT=0.06739; 56D=0.05800; FE=0.15204; AGI=0.02290; SAM=0.02679;
r=ASN; n=269; a=ND2; | I=0.04187; O=0.44105; N=0.00000; P=0.00000; | SAH=0.26050; ERT=0.08298; 56D=0.05083; FE=0.04187; AGI=0.01518; SAM=0.03156;
r=ASN; n=269; a=OD1; | I=0.13079; O=0.27514; N=0.00000; P=0.00000; | SAH=0.10265; ERT=0.07417; 56D=0.06431; FE=0.13079; AGI=0.02202; SAM=0.01198;
r=ASN; n=269; a=H; | I=0.02633; O=0.20708; N=0.00000; P=0.00000; | SAH=0.15713; ERT=0.01277; 56D=0.01879; FE=0.02633; AGI=0.00431; SAM=0.01408;
r=ASN; n=269; a=HA; | I=0.43632; O=0.21311; N=0.00000; P=0.00000; | SAH=0.10133; ERT=0.02975; 56D=0.04567; FE=0.43632; AGI=0.02249; SAM=0.01386;
r=ASN; n=269; a=HB2; | I=0.18981; O=0.46146; N=0.00000; P=0.00000; | SAH=0.32978; ERT=0.03214; 56D=0.03196; FE=0.18981; AGI=0.01907; SAM=0.04851;
r=ASN; n=269; a=HB3; | I=0.71922; O=0.36538; N=0.00000; P=0.00000; | SAH=0.18534; ERT=0.05001; 56D=0.05548; FE=0.71922; AGI=0.04137; SAM=0.03318;
r=ASN; n=269; a=HD21; | I=0.03206; O=0.48271; N=0.00000; P=0.00000; | SAH=0.32319; ERT=0.06641; 56D=0.03973; FE=0.03206; AGI=0.01243; SAM=0.04095;
r=ASN; n=269; a=HD22; | I=0.01621; O=0.40814; N=0.00000; P=0.00000; | SAH=0.20822; ERT=0.11290; 56D=0.05351; FE=0.01621; AGI=0.01080; SAM=0.02270;
r=ILE; n=270; a=N; | I=0.19775; O=0.14950; N=0.00000; P=0.00000; | SAH=0.11512; ERT=0.00504; 56D=0.00518; FE=0.19775; AGI=0.00765; SAM=0.01650;
r=ILE; n=270; a=CA; | I=0.13056; O=0.12720; N=0.00000; P=0.00000; | SAH=0.10563; ERT=0.00141; 56D=0.00112; FE=0.13056; AGI=0.00435; SAM=0.01468;
r=ILE; n=270; a=CB; | I=0.01513; O=0.11632; N=0.00000; P=0.00000; | SAH=0.10404; ERT=0.00027; FE=0.01513; AGI=0.00060; SAM=0.01141;
r=ILE; n=270; a=CG1; | I=0.00000; O=0.21300; N=0.00000; P=0.00000; | SAH=0.18964; ERT=0.00032; AGI=0.00038; SAM=0.02266;
r=ILE; n=270; a=CD1; | I=0.00000; O=0.39954; N=0.00000; P=0.00000; | SAH=0.35056; ERT=0.00050; AGI=0.00080; SAM=0.04768;
r=ILE; n=270; a=H; | I=0.08250; O=0.11055; N=0.00000; P=0.00000; | SAH=0.08736; ERT=0.00352; 56D=0.00471; FE=0.08250; AGI=0.00495; SAM=0.01002;
r=ILE; n=270; a=HA; | I=0.22877; O=0.20566; N=0.00000; P=0.00000; | SAH=0.16972; ERT=0.00207; 56D=0.00153; FE=0.22877; AGI=0.00709; SAM=0.02525;
r=ILE; n=270; a=HB; | I=0.00000; O=0.06431; N=0.00000; P=0.00000; | SAH=0.05857; ERT=0.00014; AGI=0.00027; SAM=0.00532;
r=ILE; n=270; a=HG12; | I=0.00000; O=0.24069; N=0.00000; P=0.00000; | SAH=0.21282; ERT=0.00079; 56D=0.00015; AGI=0.00067; SAM=0.02625;
r=ILE; n=270; a=HG13; | I=0.00000; O=0.15964; N=0.00000; P=0.00000; | SAH=0.14464; SAM=0.01501;
r=ILE; n=270; a=HG22; | I=0.00000; O=0.12652; N=0.00000; P=0.00000; | SAH=0.11618; SAM=0.01034;
r=ILE; n=270; a=HD11; | I=0.04872; O=0.42246; N=0.00000; P=0.00000; | SAH=0.36479; ERT=0.00175; 56D=0.00044; FE=0.04872; AGI=0.00345; SAM=0.05204;
r=ILE; n=270; a=HD12; | I=0.00000; O=0.47080; N=0.00000; P=0.00000; | SAH=0.41434; ERT=0.00046; AGI=0.00040; SAM=0.05560;
r=ILE; n=270; a=HD13; | I=0.00000; O=0.43892; N=0.00000; P=0.00000; | SAH=0.38416; ERT=0.00012; AGI=0.00038; SAM=0.05427;
r=ILE; n=270; a=C; | I=0.14875; O=0.05793; N=0.00000; P=0.00000; | SAH=0.04588; ERT=0.00077; 56D=0.00108; FE=0.14875; AGI=0.00452; SAM=0.00569;
r=ILE; n=270; a=CG2; | I=0.00000; O=0.12663; N=0.00000; P=0.00000; | SAH=0.11558; AGI=0.00012; SAM=0.01093;
r=ILE; n=270; a=HG21; | I=0.00000; O=0.21374; N=0.00000; P=0.00000; | SAH=0.18975; AGI=0.00037; SAM=0.02362;
r=ILE; n=270; a=O; | I=0.17098; O=0.05824; N=0.00000; P=0.00000; | SAH=0.04725; ERT=0.00041; 56D=0.00050; FE=0.17098; AGI=0.00420; SAM=0.00588;
r=ILE; n=270; a=HG23; | I=0.00000; O=0.07142; N=0.00000; P=0.00000; | SAH=0.06684; SAM=0.00458;
r=HIS; n=272; a=HE1; | I=0.96015; O=0.29977; N=0.00000; P=0.00000; | SAH=0.08263; ERT=0.05823; 56D=0.07753; FE=0.96015; AGI=0.06481; SAM=0.01656;
r=HIS; n=272; a=ND1; | I=0.93543; O=0.21449; N=0.00000; P=0.00000; | SAH=0.01649; ERT=0.03901; 56D=0.08468; FE=0.93543; AGI=0.06911; SAM=0.00520;
r=HIS; n=272; a=CE1; | I=0.98299; O=0.28016; N=0.00000; P=0.00000; | SAH=0.04381; ERT=0.05690; 56D=0.08679; FE=0.98299; AGI=0.08075; SAM=0.01191;
r=HIS; n=272; a=NE2; | I=0.99742; O=0.30121; N=0.00000; P=0.00000; | SAH=0.02821; ERT=0.05976; 56D=0.08880; FE=0.99742; AGI=0.11280; SAM=0.01163;
r=HIS; n=272; a=HD1; | I=0.77333; O=0.17462; N=0.00000; P=0.00000; | SAH=0.01314; ERT=0.03143; 56D=0.07933; FE=0.77333; AGI=0.04782; SAM=0.00291;
r=HIS; n=272; a=CD2; | I=0.99097; O=0.24546; N=0.00000; P=0.00000; | SAH=0.00601; ERT=0.03473; 56D=0.08405; FE=0.99097; AGI=0.11547; SAM=0.00521;
r=HIS; n=272; a=CG; | I=0.94971; O=0.18336; N=0.00000; P=0.00000; | SAH=0.00382; ERT=0.02316; 56D=0.07555; FE=0.94971; AGI=0.07861; SAM=0.00221;
r=HIS; n=272; a=CB; | I=0.71396; O=0.08350; N=0.00000; P=0.00000; | ERT=0.00539; 56D=0.04192; FE=0.71396; AGI=0.03570; SAM=0.00049;
r=HIS; n=272; a=H; | I=0.34518; O=0.05367; N=0.00000; P=0.00000; | SAH=0.00347; ERT=0.00379; 56D=0.02237; FE=0.34518; AGI=0.02300; SAM=0.00105;
r=HIS; n=272; a=HD2; | I=0.98474; O=0.24424; N=0.00000; P=0.00000; | SAH=0.00100; ERT=0.02409; 56D=0.08379; FE=0.98474; AGI=0.13264; SAM=0.00273;
r=HIS; n=272; a=N; | I=0.27222; O=0.03586; N=0.00000; P=0.00000; | SAH=0.00099; ERT=0.00130; 56D=0.01407; FE=0.27222; AGI=0.01950;
r=HIS; n=272; a=CA; | I=0.41463; O=0.04044; N=0.00000; P=0.00000; | ERT=0.00115; 56D=0.01855; FE=0.41463; AGI=0.02074;
r=HIS; n=272; a=C; | I=0.50662; O=0.04341; N=0.00000; P=0.00000; | 56D=0.01692; FE=0.50662; AGI=0.02649;
r=HIS; n=272; a=HB2; | I=0.68772; O=0.07250; N=0.00000; P=0.00000; | ERT=0.00305; 56D=0.03863; FE=0.68772; AGI=0.03082;
r=HIS; n=272; a=HB3; | I=0.46645; O=0.07088; N=0.00000; P=0.00000; | ERT=0.00422; 56D=0.04257; FE=0.46645; AGI=0.02408;
r=HIS; n=272; a=O; | I=0.34946; O=0.02617; N=0.00000; P=0.00000; | 56D=0.01059; FE=0.34946; AGI=0.01559;
r=HIS; n=272; a=HA; | I=0.14295; O=0.03346; N=0.00000; P=0.00000; | 56D=0.01934; FE=0.14295; AGI=0.01412;
r=PHE; n=320; a=HZ; | I=0.94808; O=0.48569; N=0.00000; P=0.00000; | SAH=0.00143; ERT=0.14465; 56D=0.18212; FE=0.94808; AGI=0.15604; SAM=0.00145;
r=PHE; n=320; a=CZ; | I=0.80193; O=0.42575; N=0.00000; P=0.00000; | ERT=0.11968; 56D=0.17524; FE=0.80193; AGI=0.13048; SAM=0.00035;
r=PHE; n=320; a=HE2; | I=0.48600; O=0.54750; N=0.00000; P=0.00000; | ERT=0.24124; 56D=0.17978; FE=0.48600; AGI=0.12625; SAM=0.00024;
r=PHE; n=320; a=O; | I=0.01652; O=0.01998; N=0.00000; P=0.00000; | 56D=0.00766; FE=0.01652; AGI=0.01231;
r=PHE; n=320; a=CB; | I=0.00000; O=0.03385; N=0.00000; P=0.00000; | ERT=0.01310; 56D=0.01185; AGI=0.00890;
r=PHE; n=320; a=CG; | I=0.06471; O=0.08867; N=0.00000; P=0.00000; | ERT=0.02407; 56D=0.03746; FE=0.06471; AGI=0.02713;
r=PHE; n=320; a=CD1; | I=0.16714; O=0.08367; N=0.00000; P=0.00000; | ERT=0.01274; 56D=0.04396; FE=0.16714; AGI=0.02697;
r=PHE; n=320; a=CD2; | I=0.11610; O=0.23370; N=0.00000; P=0.00000; | ERT=0.09181; 56D=0.08308; FE=0.11610; AGI=0.05881;
r=PHE; n=320; a=CE1; | I=0.60739; O=0.19952; N=0.00000; P=0.00000; | ERT=0.03243; 56D=0.09907; FE=0.60739; AGI=0.06802;
r=PHE; n=320; a=CE2; | I=0.47684; O=0.45703; N=0.00000; P=0.00000; | ERT=0.17323; 56D=0.16939; FE=0.47684; AGI=0.11440;
r=PHE; n=320; a=HA; | I=0.00000; O=0.03087; N=0.00000; P=0.00000; | ERT=0.01681; 56D=0.00179; AGI=0.01228;
r=PHE; n=320; a=HB2; | I=0.00000; O=0.04731; N=0.00000; P=0.00000; | ERT=0.02941; 56D=0.01127; AGI=0.00663;
r=PHE; n=320; a=HB3; | I=0.00000; O=0.02343; N=0.00000; P=0.00000; | ERT=0.00452; 56D=0.01313; AGI=0.00578;
r=PHE; n=320; a=HD1; | I=0.06969; O=0.04111; N=0.00000; P=0.00000; | ERT=0.00131; 56D=0.02673; FE=0.06969; AGI=0.01307;
r=PHE; n=320; a=HD2; | I=0.03667; O=0.23263; N=0.00000; P=0.00000; | ERT=0.12498; 56D=0.05975; FE=0.03667; AGI=0.04790;
r=PHE; n=320; a=HE1; | I=0.71178; O=0.15818; N=0.00000; P=0.00000; | ERT=0.01916; 56D=0.08232; FE=0.71178; AGI=0.05670;
r=PHE; n=320; a=CA; | I=0.00000; O=0.04197; N=0.00000; P=0.00000; | ERT=0.01991; AGI=0.02206;
r=PHE; n=320; a=C; | I=0.00000; O=0.01769; N=0.00000; P=0.00000; | AGI=0.01769;
r=PHE; n=320; a=N; | I=0.00000; O=0.03475; N=0.00000; P=0.00000; | ERT=0.03475;
r=PHE; n=320; a=H; | I=0.00000; O=0.03916; N=0.00000; P=0.00000; | ERT=0.03916;