REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 30-MAR-07 2PCS COMPND CONSERVED PROTEIN; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS KAUSTOPHILUS; SOURCE 3 ORGANISM_TAXID: 235909; SOURCE 4 STRAIN: HTA426; SOURCE 5 GENE: GKP20; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_VECTOR: PET; SOURCE 11 EXPRESSION_SYSTEM_PLASMID: MODIFIED PET26 AUTHOR J.B.BONANNO,J.GILMORE,K.T.BAIN,B.WU,R.ROMERO,D.SMITH,S.WASSERMAN, AUTHOR 2 J.M.SAUDER,S.K.BURLEY,S.C.ALMO,NEW YORK SGX RESEARCH CENTER FOR AUTHOR 3 STRUCTURAL GENOMICS (NYSGXRC) HET UNL A 161 30 SITE 1 AC1 7 LEU A 20 LEU A 26 ILE A 63 TYR A 74 >LEU.A 1 12.40 11.92 40.50 11.77 13.76 41.51 12.09 12.84 41.01 3 0 5.98 -999 ? C77 UNL A 161 >ASN^A 2 7.93 8.72 38.14 9.51 7.27 37.92 8.72 8.00 38.03 2 0 10.51 -999 ? C73 UNL A 161 >GLY^A 3 5.79 12.71 37.67 5.99 12.34 36.93 5.89 12.52 37.30 1 0 8.08 -999 ? C71 UNL A 161 >ASN^A 4 2.25 12.57 34.85 0.69 12.12 36.21 1.47 12.35 35.53 2 0 11.63 -999 ? C70 UNL A 161 >GLY^A 5 0.75 16.73 35.08 0.94 16.56 34.31 0.84 16.65 34.70 1 0 8.90 -999 ? C69 UNL A 161 >SER^A 6 -1.02 19.26 32.96 -3.21 18.40 33.45 -2.11 18.83 33.20 2 0 11.59 -999 ? C69 UNL A 161 >ILE^A 7 -0.33 23.77 32.11 0.52 23.96 33.38 0.10 23.87 32.75 3 0 9.17 -999 ? C69 UNL A 161 >GLU^A 8 -6.57 23.72 31.03 -8.47 23.86 32.01 -7.52 23.79 31.52 2 0 17.07 -999 ? C69 UNL A 161 >LEU^A 9 -1.56 27.24 27.79 0.42 26.61 28.48 -0.57 26.92 28.13 3 0 10.73 -999 ? C64 UNL A 161 >LYS^A 10 -4.28 30.68 26.85 -7.13 33.47 31.62 -5.70 32.07 29.24 2 0 20.06 -999 ? C67 UNL A 161 >GLY.A 11 -3.54 30.22 23.16 -4.01 29.54 23.46 -3.78 29.88 23.31 1 0 15.63 -999 ? C64 UNL A 161 >THR~A 12 -4.07 27.80 20.32 -4.48 28.86 18.49 -4.27 28.33 19.40 2 0 17.62 -999 ? C61 UNL A 161 >VAL~A 13 -2.08 24.59 19.94 -2.48 22.46 19.63 -2.28 23.53 19.79 3 0 13.77 -999 ? C64 UNL A 161 >GLU~A 14 0.26 27.78 15.06 2.23 27.01 14.56 1.25 27.40 14.81 2 0 14.02 -999 ? C61 UNL A 161 >GLU~A 15 -1.23 31.27 19.02 -3.26 31.87 19.41 -2.25 31.57 19.22 2 0 17.69 -999 ? C61 UNL A 161 >VAL~A 16 1.91 27.20 22.23 0.86 26.27 23.92 1.39 26.73 23.07 3 0 10.04 -999 ? C64 UNL A 161 >TRP~A 17 5.12 23.74 16.97 5.89 20.16 18.45 5.51 21.95 17.71 3 0 8.71 -999 ? C61 UNL A 161 >SER~A 18 5.78 27.90 18.38 4.74 30.06 18.32 5.26 28.98 18.35 2 0 11.68 -999 ? C61 UNL A 161 >LYS~A 19 6.90 29.13 21.88 6.69 34.37 21.02 6.80 31.75 21.45 2 0 13.24 -999 ? C61 UNL A 161 >LEU~A 20 6.93 24.56 23.22 5.76 24.14 25.00 6.35 24.35 24.11 3 0 -4.78 -999 ? C61 UNL A 161s >MET~A 21 10.07 25.19 19.86 9.66 21.96 19.26 9.87 23.58 19.56 2 0 5.60 -999 ? C61 UNL A 161 >ASP~A 22 10.92 29.87 20.08 11.78 31.59 19.21 11.35 30.73 19.64 2 0 10.86 -999 ? C60 UNL A 161 >PRO~A 23 16.13 27.73 19.49 14.67 28.30 21.11 15.40 28.01 20.30 3 0 7.20 -999 ? C59 UNL A 161 >SER~A 24 15.47 32.03 22.43 14.87 32.95 20.23 15.17 32.49 21.33 2 0 11.19 -999 ? C59 UNL A 161 >ILE~A 25 10.77 31.64 23.52 9.86 32.81 23.68 10.32 32.22 23.60 3 0 10.00 -999 ? C61 UNL A 161 >LEU~A 26 13.50 27.34 25.47 12.26 25.78 24.51 12.88 26.56 24.99 3 0 -3.99 -999 ? C59 UNL A 161s >SER~A 27 16.44 30.17 27.30 18.66 30.98 27.19 17.55 30.58 27.24 2 0 8.99 -999 ? C59 UNL A 161 >LYS~A 28 14.38 32.96 28.80 14.77 37.76 24.56 14.58 35.36 26.68 2 0 14.72 -999 ? C59 UNL A 161 >CYH~A 29 11.76 30.65 30.39 9.74 31.41 28.59 10.75 31.03 29.49 2 0 9.30 -999 ? C62 UNL A 161 >ILE~A 30 15.17 27.14 31.19 15.77 26.02 30.64 15.47 26.58 30.92 3 0 4.78 -999 ? C86 UNL A 161 >MET.A 31 15.17 29.16 35.31 14.42 29.77 39.12 14.80 29.46 37.21 2 0 7.63 -999 ? C86 UNL A 161 >GLY.A 32 18.87 29.77 35.71 18.52 29.81 34.97 18.70 29.79 35.34 1 0 6.90 -999 ? C85 UNL A 161 >CYH^A 33 19.42 29.41 32.00 19.25 28.25 29.54 19.34 28.83 30.77 2 0 7.72 -999 ? C85 UNL A 161 >LYS^A 34 22.18 31.79 30.89 27.02 34.66 33.59 24.60 33.22 32.24 2 0 15.60 -999 ? C85 UNL A 161 >SER^A 35 22.50 30.29 27.42 24.90 30.13 27.65 23.70 30.21 27.53 2 0 12.55 -999 ? C59 UNL A 161 >LEU^A 36 19.55 27.37 24.93 18.29 25.60 25.28 18.92 26.49 25.10 3 0 5.40 -999 ? C59 UNL A 161 >GLU^A 37 26.02 26.83 21.61 27.98 25.95 21.86 27.00 26.39 21.74 2 0 14.01 -999 ? C59 UNL A 161 >LEU^A 38 22.09 25.00 18.24 20.76 24.06 16.75 21.42 24.53 17.49 3 0 10.52 -999 ? C59 UNL A 161 >ILE^A 39 25.89 21.35 20.84 25.86 21.09 22.15 25.87 21.22 21.49 3 0 11.96 -999 ? C59 UNL A 161 >GLY^A 40 23.48 19.34 17.24 22.97 19.99 17.38 23.22 19.66 17.31 1 0 12.58 -999 ? C59 UNL A 161 >GLU.A 41 18.59 17.65 13.78 17.99 16.12 12.42 18.29 16.89 13.10 2 0 14.54 -999 ? C60 UNL A 161 >ASP.A 42 16.34 18.37 17.65 15.33 18.97 15.82 15.84 18.67 16.73 2 0 9.64 -999 ? C60 UNL A 161 >LYS^A 43 20.22 19.23 20.71 23.62 14.24 21.50 21.92 16.74 21.11 2 0 13.13 -999 ? C59 UNL A 161 >TYR^A 44 19.23 23.33 22.18 17.52 23.62 20.00 18.37 23.47 21.09 3 0 5.71 -999 ? C59 UNL A 161 >LYS^A 45 23.73 22.81 25.72 29.37 21.74 27.90 26.55 22.27 26.81 2 0 13.48 -999 ? C82 UNL A 161 >ALA^A 46 22.33 24.79 28.56 20.96 24.43 29.07 21.64 24.61 28.81 2 0 6.58 -999 ? C84 UNL A 161 >ASP^A 47 25.45 27.80 30.68 26.34 28.87 32.36 25.90 28.33 31.52 2 0 11.73 -999 ? C85 UNL A 161 >LEU^A 48 21.33 25.48 34.52 19.76 24.72 33.20 20.54 25.10 33.86 3 0 4.71 -999 ? C85 UNL A 161 >GLN^A 49 25.07 29.82 36.53 26.27 31.53 36.12 25.67 30.68 36.33 2 0 12.95 -999 ? C85 UNL A 161 >ILE^A 50 19.83 26.26 39.71 19.18 25.33 39.24 19.50 25.79 39.47 3 0 4.80 -999 ? C80 UNL A 161 >GLY.A 51 19.87 29.91 42.89 19.41 29.26 42.79 19.64 29.58 42.84 1 0 9.66 -999 ? C80 UNL A 161 >ILE~A 52 16.25 26.75 44.09 15.01 26.20 43.74 15.63 26.47 43.91 3 0 7.77 -999 ? C78 UNL A 161 >ALA~A 53 18.92 27.15 47.98 18.37 27.75 49.32 18.65 27.45 48.65 2 0 11.97 -999 ? C78 UNL A 161 >ALA~A 54 18.01 23.45 48.28 16.59 22.83 48.32 17.30 23.14 48.30 2 0 8.36 -999 ? C78 UNL A 161 >VAL~A 55 19.68 22.73 44.91 17.85 22.26 43.68 18.77 22.49 44.30 3 0 4.81 -999 ? C79 UNL A 161 >LYS~A 56 21.87 25.78 44.49 24.51 30.37 45.17 23.19 28.07 44.83 2 0 12.38 -999 ? C80 UNL A 161 >GLY^A 57 24.65 25.13 41.99 24.13 25.68 41.66 24.39 25.41 41.83 1 0 7.52 -999 ? C80 UNL A 161 >LYS^A 58 25.97 25.48 38.47 29.15 31.05 39.13 27.56 28.26 38.80 2 0 14.26 -999 ? C80 UNL A 161 >TYR^A 59 23.27 22.02 37.79 22.55 21.59 40.45 22.91 21.80 39.12 3 0 3.97 -999 ? C80 UNL A 161 >ASP^A 60 26.93 21.72 31.81 28.19 23.42 32.06 27.56 22.57 31.93 2 0 10.70 -999 ? C81 UNL A 161 >ALA^A 61 22.70 20.20 30.71 21.30 20.79 31.13 22.00 20.49 30.92 2 0 5.16 -999 ? C82 UNL A 161 >ILE^A 62 23.15 17.26 26.80 24.05 17.92 25.97 23.60 17.59 26.38 3 0 10.20 -999 ? C82 UNL A 161 >ILE^A 63 18.00 20.18 26.45 17.20 21.08 27.18 17.60 20.63 26.82 3 0 -3.92 -999 ? C58 UNL A 161s >GLU^A 64 18.19 15.22 21.23 18.91 13.32 20.59 18.55 14.27 20.91 2 0 11.56 -999 ? C60 UNL A 161 >VAL^A 65 14.18 17.29 21.50 13.13 19.25 21.36 13.65 18.27 21.43 3 0 5.04 -999 ? C60 UNL A 161 >THR^A 66 13.10 13.98 19.83 14.17 12.64 21.10 13.63 13.31 20.46 2 0 10.20 -999 ? C60 UNL A 161 >ASP^A 67 9.41 11.33 19.47 7.80 10.02 18.91 8.60 10.68 19.19 2 0 13.88 -999 ? C61 UNL A 161 >ILE^A 68 9.85 16.67 16.64 10.58 17.98 16.79 10.22 17.32 16.71 3 0 9.40 -999 ? C60 UNL A 161 >LYS^A 69 5.39 15.85 15.88 5.76 10.69 15.57 5.58 13.27 15.72 2 0 15.57 -999 ? C61 UNL A 161 >PRO.A 70 6.17 19.17 13.51 4.54 18.67 14.98 5.36 18.92 14.24 3 0 12.23 -999 ? C61 UNL A 161 >PRO.A 71 0.27 21.80 15.61 2.25 20.71 15.81 1.26 21.25 15.71 3 0 13.06 -999 ? C61 UNL A 161 >TYR.A 72 0.23 16.74 17.80 0.79 14.48 16.24 0.51 15.61 17.02 3 0 14.38 -999 ? C61 UNL A 161 >HIS^A 73 4.15 13.70 20.75 5.21 12.14 21.64 4.68 12.92 21.20 3 0 11.65 -999 ? C61 UNL A 161 >TYR^A 74 8.19 18.12 22.16 7.95 20.19 24.07 8.07 19.15 23.11 3 0 -4.36 -999 ? C61 UNL A 161s >LYS^A 75 9.90 14.00 23.78 8.27 8.01 22.72 9.09 11.01 23.25 2 0 12.58 -999 ? C72 UNL A 161 >LEU^A 76 12.52 16.61 26.76 12.38 18.73 26.26 12.45 17.67 26.51 3 0 -4.83 -999 ? C72 UNL A 161s >LEU^A 77 16.84 12.88 25.97 16.12 11.09 24.93 16.48 11.98 25.45 3 0 8.66 -999 ? C72 UNL A 161 >VAL^A 78 17.93 15.70 29.54 17.14 17.52 30.51 17.54 16.61 30.02 3 0 5.38 -999 ? C84 UNL A 161 >ASN^A 79 22.50 14.24 30.05 21.68 12.43 29.31 22.09 13.34 29.68 2 0 9.42 -999 ? C82 UNL A 161 >GLY^A 80 22.52 17.58 33.50 22.77 16.78 33.69 22.65 17.18 33.60 1 0 4.88 -999 ? C82 UNL A 161 >GLU^A 81 27.51 15.91 35.99 29.31 16.92 36.61 28.41 16.42 36.30 2 0 10.93 -999 ? C81 UNL A 161 >GLY^A 82 27.27 19.81 38.23 27.22 19.07 38.58 27.25 19.44 38.40 1 0 8.40 -999 ? C80 UNL A 161 >GLY.A 83 28.98 20.29 41.56 28.28 19.96 41.33 28.63 20.12 41.44 1 0 9.88 -999 ? C79 UNL A 161 >PRO.A 84 25.15 21.56 43.05 26.34 19.59 43.09 25.75 20.58 43.07 3 0 7.05 -999 ? C79 UNL A 161 >GLY^A 85 25.23 16.17 41.46 25.15 16.84 40.95 25.19 16.51 41.21 1 0 6.72 -999 ? C79 UNL A 161 >PHE^A 86 24.40 12.55 38.04 24.29 9.91 38.95 24.34 11.23 38.50 3 0 9.70 -999 ? C79 UNL A 161 >VAL^A 87 20.12 14.34 36.59 18.57 15.89 36.99 19.34 15.11 36.79 3 0 4.67 -999 ? C82 UNL A 161 >ASN^A 88 19.90 10.61 33.55 22.01 10.71 33.76 20.96 10.66 33.65 2 0 9.38 -999 ? C82 UNL A 161 >ALA^A 89 15.67 12.60 32.58 15.21 13.94 33.14 15.44 13.27 32.86 2 0 3.71 -999 ? C73 UNL A 161 >GLU^A 90 13.07 9.29 29.88 13.03 7.38 28.86 13.05 8.34 29.37 2 0 9.55 -999 ? C72 UNL A 161 >GLY^A 91 9.77 13.51 29.31 10.11 13.25 28.59 9.94 13.38 28.95 1 0 4.18 -999 ? C72 UNL A 161 >VAL^A 92 6.87 13.41 26.89 6.14 11.45 26.19 6.51 12.43 26.54 3 0 7.53 -999 ? C70 UNL A 161 >ILE^A 93 5.48 17.76 25.83 6.11 18.18 26.28 5.79 17.97 26.05 3 0 5.27 -999 ? C64 UNL A 161 >ASP^A 94 0.50 15.13 24.51 1.54 13.33 23.95 1.02 14.23 24.23 2 0 11.42 -999 ? C69 UNL A 161 >LEU^A 95 -0.15 20.54 22.42 1.33 22.01 23.04 0.59 21.27 22.73 3 0 9.69 -999 ? C64 UNL A 161 >THR^A 96 -4.52 18.97 23.19 -5.44 17.28 24.03 -4.98 18.13 23.61 2 0 15.30 -999 ? C69 UNL A 161 >PRO^A 97 -7.23 20.25 20.06 -6.51 21.03 22.02 -6.87 20.64 21.04 3 0 17.16 -999 ? C64 UNL A 161 >ILE.A 98 -9.58 21.99 26.12 -8.27 21.99 27.08 -8.92 21.99 26.60 3 0 17.64 -999 ? C69 UNL A 161 >ASN.A 99 -12.45 25.20 23.06 -11.49 26.66 24.30 -11.97 25.93 23.68 2 0 21.21 -999 ? C64 UNL A 161 >ASP.A 100 -12.15 27.80 19.09 -13.04 26.89 17.33 -12.60 27.34 18.21 2 0 24.76 -999 ? C64 UNL A 161 >GLU.A 101 -10.61 31.48 22.11 -11.50 33.08 23.26 -11.06 32.28 22.69 2 0 23.67 -999 ? C64 UNL A 161 >CYH^A 102 -7.51 26.96 24.78 -8.00 26.39 27.58 -7.75 26.68 26.18 2 0 17.49 -999 ? C64 UNL A 161 >THR^A 103 -4.84 24.24 24.91 -3.16 24.16 23.53 -4.00 24.20 24.22 2 0 12.95 -999 ? C64 UNL A 161 >GLN^A 104 -4.89 19.81 29.00 -5.76 17.86 29.07 -5.33 18.84 29.03 2 0 14.03 -999 ? C69 UNL A 161 >LEU^A 105 0.60 21.65 27.97 2.73 21.37 28.12 1.66 21.51 28.05 3 0 7.21 -999 ? C69 UNL A 161 >THR^A 106 0.24 17.09 29.68 -1.39 15.97 28.76 -0.58 16.53 29.22 2 0 10.34 -999 ? C69 UNL A 161 >TYR^A 107 4.38 17.42 32.07 4.15 18.36 34.67 4.26 17.89 33.37 3 0 4.85 -999 ? C69 UNL A 161 >THR^A 108 5.07 12.78 31.91 4.68 10.85 31.07 4.87 11.82 31.49 2 0 8.28 -999 ? C70 UNL A 161 >TYR^A 109 9.20 14.44 34.79 8.98 15.14 37.46 9.09 14.79 36.13 3 0 -4.20 -999 ? C71 UNL A 161s >SER^A 110 11.18 10.26 34.53 10.99 7.88 34.53 11.08 9.07 34.53 2 0 8.77 -999 ? C73 UNL A 161 >ALA^A 111 14.44 11.32 36.24 14.40 12.80 36.72 14.42 12.06 36.48 2 0 4.98 -999 ? C73 UNL A 161 >GLU^A 112 19.71 8.35 37.65 21.02 7.25 36.31 20.37 7.80 36.98 2 0 12.29 -999 ? C76 UNL A 161 >VAL^A 113 19.00 12.13 40.29 17.84 13.93 40.96 18.42 13.03 40.63 3 0 6.01 -999 ? C76 UNL A 161 >GLY^A 114 22.44 11.48 41.86 22.29 12.32 41.76 22.37 11.90 41.81 1 0 8.32 -999 ? C79 UNL A 161 >GLY~A 115 25.14 13.17 43.95 24.42 12.95 44.29 24.78 13.06 44.12 1 0 8.91 -999 ? C79 UNL A 161 >LYS~A 116 24.87 15.05 47.21 27.70 19.40 50.18 26.28 17.22 48.70 2 0 12.56 -999 ? C79 UNL A 161 >VAL~A 117 21.64 16.71 45.96 20.86 17.62 44.09 21.25 17.16 45.03 3 0 4.96 -999 ? C79 UNL A 161 >ALA~A 118 19.90 13.30 45.71 20.55 12.02 45.16 20.22 12.66 45.44 2 0 8.34 -999 ? C79 UNL A 161 >ALA~A 119 19.84 13.09 49.50 21.11 13.18 50.33 20.47 13.14 49.92 2 0 11.26 -999 ? C79 UNL A 161 >ILE~A 120 17.40 17.42 49.25 17.48 18.38 48.27 17.44 17.90 48.76 3 0 8.11 -999 ? C79 UNL A 161 >GLY~A 121 14.41 13.84 49.82 14.69 14.09 49.11 14.55 13.97 49.46 1 0 9.89 -999 ? C77 UNL A 161 >GLN~A 122 12.04 10.17 46.10 10.74 8.55 45.60 11.39 9.36 45.85 2 0 11.43 -999 ? C77 UNL A 161 >ARG~A 123 9.24 16.11 51.57 7.18 15.23 53.63 8.21 15.67 52.60 2 0 15.15 -999 ? C77 UNL A 161 >MET~A 124 11.43 17.85 48.21 14.32 19.69 50.69 12.87 18.77 49.45 2 0 9.91 -999 ? C77 UNL A 161 >LEU~A 125 13.51 15.34 44.67 15.74 15.02 44.46 14.62 15.18 44.56 3 0 4.69 -999 ? C77 UNL A 161 >GLY~A 126 9.28 16.62 44.46 9.72 17.19 43.93 9.50 16.90 44.19 1 0 6.81 -999 ? C77 UNL A 161 >GLY~A 127 8.71 20.27 45.16 9.35 20.04 44.73 9.03 20.16 44.94 1 0 7.80 -999 ? C77 UNL A 161 >VAL~A 128 11.71 21.73 43.37 13.82 22.02 43.73 12.77 21.87 43.55 3 0 5.05 -999 ? C77 UNL A 161 >ALA~A 129 10.68 19.90 40.13 10.60 18.33 39.93 10.64 19.12 40.03 2 0 4.42 -999 ? C77 UNL A 161 >LYS~A 130 7.10 21.24 40.49 1.41 21.92 43.26 4.26 21.58 41.88 2 0 13.89 -999 ? C67 UNL A 161 >LEU~A 131 9.30 25.17 42.38 10.55 27.08 42.59 9.93 26.12 42.49 3 0 9.26 -999 ? C86 UNL A 161 >LEU~A 132 12.02 23.52 37.81 14.02 24.00 38.66 13.02 23.76 38.24 3 0 3.90 -999 ? C86 UNL A 161 >ILE~A 133 7.27 21.80 35.96 7.02 20.56 35.71 7.14 21.18 35.83 3 0 4.61 -999 ? C67 UNL A 161 >SER~A 134 5.45 25.80 37.17 4.51 24.77 39.12 4.98 25.28 38.15 2 0 9.15 -999 ? C67 UNL A 161 >ASP~A 135 9.21 28.82 37.47 10.05 30.72 37.03 9.63 29.77 37.25 2 0 8.31 -999 ? C86 UNL A 161 >PHE~A 136 9.24 25.94 31.27 9.33 25.48 28.51 9.28 25.71 29.89 3 0 -4.21 -999 ? C67 UNL A 161s >PHE~A 137 4.30 24.81 32.01 4.94 22.38 30.76 4.62 23.59 31.39 3 0 4.99 -999 ? C67 UNL A 161 >LYS~A 138 4.42 30.64 33.95 5.94 35.00 38.42 5.18 32.82 36.19 2 0 14.28 -999 ? C86 UNL A 161 >LYS~A 139 6.95 32.38 31.74 12.62 32.22 34.51 9.78 32.30 33.12 2 0 8.52 -999 ? C86 UNL A 161 >ILE~A 140 5.57 29.02 28.40 6.20 28.77 27.11 5.89 28.90 27.76 3 0 7.61 -999 ? C64 UNL A 161 >GLN~A 141 -0.10 31.95 30.56 -1.17 31.58 28.71 -0.64 31.76 29.64 2 0 14.01 -999 ? C64 UNL A 161 >LYS~A 142 3.64 35.29 29.51 7.87 39.52 31.51 5.76 37.40 30.51 2 0 17.07 -999 ? C86 UNL A 161 >GLU~A 143 8.00 34.75 26.83 8.81 36.68 26.41 8.41 35.72 26.62 2 0 14.43 -999 ? C62 UNL A 161 >ILE~A 144 1.62 32.39 25.04 0.98 31.13 24.93 1.30 31.76 24.98 3 0 12.72 -999 ? C64 UNL A 161 >ALA~A 145 0.29 36.44 26.01 0.22 36.82 27.48 0.25 36.63 26.74 2 0 17.26 -999 ? C64 UNL A 161 >LYS~A 146 2.47 39.07 24.25 8.28 39.46 26.66 5.37 39.27 25.45 2 0 17.26 -999 ? C62 UNL A 161 >SER~A 147 2.13 37.42 20.84 4.38 36.48 20.60 3.25 36.95 20.72 2 0 16.05 -999 ? C61 UNL A 161 >HIS.A 156 1.14 23.17 37.09 2.92 22.05 37.04 2.03 22.61 37.06 3 0 8.99 -999 ? C67 UNL A 161 >HIS^A 157 -2.74 17.52 38.48 -2.46 15.58 39.23 -2.60 16.55 38.85 3 0 13.64 -999 ? C69 UNL A 161 >HIS^A 158 3.91 18.43 39.76 5.67 17.35 40.12 4.79 17.89 39.94 3 0 8.94 -999 ? C71 UNL A 161 >HIS^A 159 0.51 12.40 40.60 0.41 10.71 41.85 0.46 11.55 41.23 3 0 14.21 -999 ? C71 UNL A 161 >HIS.A 160 6.39 13.43 43.85 7.63 12.36 45.19 7.01 12.90 44.52 3 0 10.13 -999 ? C77 UNL A 161