REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 14-OCT-09 3K8R COMPND UNCHARACTERIZED PROTEIN; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: RHODOSPIRILLUM RUBRUM ATCC 11170; SOURCE 3 ORGANISM_TAXID: 269796; SOURCE 4 STRAIN: ATCC 11170 / NCIB 8255; SOURCE 5 GENE: RRU_A2416; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: HK100; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: SPEEDET AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) HET MSE A 93 8 HET MSE A 103 8 HET MSE B 93 8 HET MSE B 103 8 HET EDO A 124 4 HET EDO A 125 4 SITE 1 AC1 3 ARG A 30 ASP A 41 LYS B 28 SITE 1 AC2 3 LEU A 87 SER A 88 ILE A 96 >GLU.A 23 -39.20 -45.13 -30.01 -39.39 -46.36 -28.29 -39.29 -45.74 -29.15 2 0 13.04 -999 ? O2 EDO A 125 >PRO.A 24 -37.37 -41.75 -27.30 -38.43 -41.33 -29.23 -37.90 -41.54 -28.26 3 0 13.79 -999 ? O2 EDO A 125 >ARG.A 25 -36.33 -42.91 -35.14 -37.90 -40.94 -36.97 -37.12 -41.93 -36.06 2 0 17.39 -999 ? O2 EDO A 124 >ALA^A 26 -31.83 -39.03 -32.30 -30.50 -39.69 -32.00 -31.17 -39.36 -32.15 2 0 11.43 -999 ? O2 EDO A 124 >ALA^A 27 -31.77 -36.20 -34.87 -32.75 -35.04 -34.84 -32.26 -35.62 -34.85 2 0 9.68 -999 ? O2 EDO A 124 >LYS^A 28 -28.32 -34.86 -33.86 -29.06 -28.94 -36.08 -28.69 -31.90 -34.97 2 0 7.39 -999 ? O2 EDO A 124 >ALA^A 29 -25.58 -35.99 -31.45 -25.46 -37.49 -31.45 -25.52 -36.74 -31.45 2 0 9.43 -999 ? O2 EDO A 124 >ARG^A 30 -23.15 -30.49 -30.18 -25.43 -29.17 -28.55 -24.29 -29.83 -29.37 2 0 -2.97 -999 ? O2 EDO A 124s >TYR^A 31 -17.80 -35.20 -26.15 -16.47 -35.25 -23.71 -17.13 -35.22 -24.93 3 0 13.43 -999 ? O2 EDO A 124 >ASP^A 32 -20.91 -30.64 -24.77 -20.66 -28.75 -23.92 -20.78 -29.70 -24.35 2 0 7.79 -999 ? O1 EDO A 124 >ARG.A 33 -13.24 -30.66 -26.46 -11.23 -31.73 -28.50 -12.23 -31.19 -27.48 2 0 17.39 -999 ? O2 EDO A 124 >SER.A 34 -17.26 -28.12 -21.59 -18.39 -26.11 -20.84 -17.83 -27.11 -21.22 2 0 10.92 -999 ? O1 EDO A 124 >SER.A 35 -19.76 -30.33 -19.75 -21.66 -30.91 -21.11 -20.71 -30.62 -20.43 2 0 8.67 -999 ? O1 EDO A 124 >ALA.A 36 -18.11 -33.66 -20.67 -17.40 -34.10 -19.41 -17.76 -33.88 -20.04 2 0 14.13 -999 ? O1 EDO A 124 >ARG^A 37 -22.85 -35.16 -19.08 -21.11 -34.86 -16.48 -21.98 -35.01 -17.78 2 0 13.77 -999 ? O1 EDO A 124 >VAL^A 38 -22.90 -36.20 -25.23 -22.48 -38.06 -26.28 -22.69 -37.13 -25.76 3 0 10.40 -999 ? O2 EDO A 124 >ILE^A 39 -25.79 -32.37 -26.18 -26.05 -31.06 -25.60 -25.92 -31.72 -25.89 3 0 4.62 -999 ? C1 EDO A 124 >VAL^A 40 -28.60 -35.61 -28.16 -28.72 -37.78 -28.22 -28.66 -36.70 -28.19 3 0 7.77 -999 ? O2 EDO A 124 >ASP^A 41 -30.95 -32.49 -30.99 -29.58 -31.06 -30.32 -30.26 -31.78 -30.65 2 0 -2.91 -999 ? O2 EDO A 124s >LEU^A 42 -35.18 -36.23 -29.00 -34.50 -37.80 -27.68 -34.84 -37.01 -28.34 3 0 10.34 -999 ? O2 EDO A 124 >GLU.A 43 -36.51 -36.35 -35.74 -35.90 -38.00 -36.92 -36.21 -37.18 -36.33 2 0 14.35 -999 ? O2 EDO A 124 >ASN.A 44 -40.16 -35.85 -30.25 -38.99 -36.20 -28.51 -39.57 -36.03 -29.38 2 0 12.85 -999 ? O2 EDO A 124 >GLY.A 45 -38.01 -31.54 -29.98 -37.78 -32.20 -29.62 -37.90 -31.87 -29.80 1 0 10.05 -999 ? O2 EDO A 124 >CYH.A 46 -36.60 -32.80 -26.64 -38.89 -33.76 -25.53 -37.74 -33.28 -26.08 2 0 11.48 -999 ? C1 EDO A 124 >THR^A 47 -32.95 -33.12 -25.53 -31.82 -31.29 -25.77 -32.39 -32.20 -25.65 2 0 4.31 -999 ? C1 EDO A 124 >PHE^A 48 -30.93 -38.41 -23.20 -29.91 -40.39 -21.53 -30.42 -39.40 -22.36 3 0 10.34 -999 ? O2 EDO A 125 >ALA^A 49 -27.58 -35.61 -22.27 -27.19 -34.24 -21.71 -27.38 -34.92 -21.99 2 0 7.86 -999 ? C1 EDO A 124 >PHE^A 50 -25.34 -40.24 -22.63 -24.26 -40.99 -25.13 -24.80 -40.62 -23.88 3 0 8.88 -999 ? O1 EDO A 125 >PRO~A 51 -22.81 -39.07 -17.47 -22.64 -38.62 -19.64 -22.73 -38.84 -18.55 3 0 12.56 -999 ? O2 EDO A 125 >PRO~A 52 -19.24 -39.24 -23.00 -20.61 -40.50 -21.76 -19.93 -39.87 -22.38 3 0 11.69 -999 ? O1 EDO A 125 >ARG~A 53 -14.38 -40.26 -19.61 -13.64 -37.85 -21.39 -14.01 -39.06 -20.50 2 0 17.45 -999 ? O1 EDO A 125 >LEU~A 54 -21.53 -43.50 -17.11 -21.49 -42.48 -15.18 -21.51 -42.99 -16.15 3 0 11.35 -999 ? O2 EDO A 125 >ALA~A 55 -21.18 -46.19 -20.96 -21.62 -45.51 -22.25 -21.40 -45.85 -21.60 2 0 6.66 -999 ? O1 EDO A 125 >GLN.A 56 -19.66 -52.09 -22.06 -20.64 -53.94 -21.94 -20.15 -53.01 -22.00 2 0 7.55 -999 ? C1 EDO A 125 >GLY.A 57 -16.91 -49.31 -24.24 -17.01 -48.68 -23.74 -16.96 -48.99 -23.99 1 0 9.42 -999 ? O1 EDO A 125 >LEU.A 58 -17.29 -44.63 -24.09 -18.05 -44.29 -26.14 -17.67 -44.46 -25.12 3 0 9.87 -999 ? O1 EDO A 125 >GLU.A 59 -15.74 -47.56 -18.76 -16.21 -49.13 -20.10 -15.98 -48.35 -19.43 2 0 11.26 -999 ? O1 EDO A 125 >GLY.A 60 -11.24 -44.68 -21.35 -11.80 -44.53 -21.88 -11.52 -44.61 -21.62 1 0 16.17 -999 ? O1 EDO A 125 >ALA.A 61 -11.93 -42.70 -24.53 -13.20 -42.73 -25.33 -12.57 -42.71 -24.93 2 0 14.64 -999 ? O1 EDO A 125 >SER~A 62 -10.44 -39.22 -24.93 -9.30 -39.10 -27.06 -9.87 -39.16 -25.99 2 0 19.90 -999 ? O1 EDO A 125 >ASP~A 63 -12.06 -34.63 -25.15 -12.54 -34.29 -23.12 -12.30 -34.46 -24.14 2 0 17.25 -999 ? O1 EDO A 124 >ASP~A 64 -9.63 -36.32 -29.61 -8.64 -34.46 -29.79 -9.13 -35.39 -29.70 2 0 20.53 -999 ? O2 EDO A 124 >GLN~A 65 -10.34 -41.26 -29.26 -9.49 -42.98 -28.40 -9.92 -42.12 -28.83 2 0 18.24 -999 ? O1 EDO A 125 >LEU~A 66 -15.97 -38.44 -26.63 -16.10 -39.71 -24.86 -16.03 -39.07 -25.75 3 0 14.48 -999 ? O1 EDO A 125 >CYH~A 67 -16.46 -36.33 -30.73 -15.07 -34.22 -29.77 -15.77 -35.27 -30.25 2 0 14.35 -999 ? O2 EDO A 124 >ALA.A 68 -16.63 -39.03 -33.40 -15.61 -40.17 -33.58 -16.12 -39.60 -33.49 2 0 16.39 -999 ? O1 EDO A 125 >VAL.A 69 -20.19 -39.87 -32.28 -21.73 -38.92 -31.10 -20.96 -39.40 -31.69 3 0 13.01 -999 ? O1 EDO A 125 >GLU^A 70 -20.78 -40.93 -37.02 -20.07 -42.22 -38.56 -20.43 -41.57 -37.79 2 0 16.40 -999 ? O1 EDO A 125 >ILE^A 71 -27.38 -40.51 -35.55 -28.44 -39.68 -35.04 -27.91 -40.09 -35.29 3 0 12.95 -999 ? O2 EDO A 124 >LEU^A 72 -25.96 -45.98 -36.98 -24.33 -45.96 -38.50 -25.15 -45.97 -37.74 3 0 13.09 -999 ? O1 EDO A 125 >GLY.A 73 -30.36 -47.03 -37.01 -30.17 -46.21 -37.42 -30.26 -46.62 -37.21 1 0 12.76 -999 ? O1 EDO A 125 >GLY.A 75 -32.08 -43.13 -35.24 -32.38 -43.83 -34.91 -32.23 -43.48 -35.07 1 0 13.18 -999 ? O1 EDO A 125 >TYR.A 76 -34.39 -46.20 -32.52 -36.95 -45.73 -33.57 -35.67 -45.97 -33.05 3 0 12.73 -999 ? O1 EDO A 125 >GLY^A 77 -28.29 -45.93 -31.97 -28.42 -45.22 -32.28 -28.36 -45.57 -32.13 1 0 7.89 -999 ? O1 EDO A 125 >LEU^A 78 -25.02 -43.13 -29.94 -26.24 -41.39 -29.47 -25.63 -42.26 -29.71 3 0 8.41 -999 ? O1 EDO A 125 >HIS^A 79 -21.34 -46.36 -35.23 -19.90 -47.56 -36.18 -20.63 -46.96 -35.71 3 0 12.23 -999 ? O1 EDO A 125 >TRP^A 80 -17.54 -42.16 -30.37 -20.99 -42.75 -28.58 -19.27 -42.45 -29.47 3 0 10.72 -999 ? O1 EDO A 125 >GLU.A 81 -16.00 -46.15 -38.38 -17.64 -47.22 -39.14 -16.82 -46.69 -38.76 2 0 16.59 -999 ? O1 EDO A 125 >THR.A 82 -12.90 -46.31 -34.92 -11.19 -45.02 -35.26 -12.04 -45.66 -35.09 2 0 18.68 -999 ? O1 EDO A 125 >LEU.A 83 -14.15 -46.42 -30.21 -12.97 -45.12 -28.95 -13.56 -45.77 -29.58 3 0 13.93 -999 ? O1 EDO A 125 >ASP.A 84 -15.37 -51.13 -32.78 -16.55 -52.78 -33.34 -15.96 -51.95 -33.06 2 0 13.20 -999 ? O1 EDO A 125 >VAL^A 85 -18.81 -48.96 -29.91 -18.31 -48.23 -27.93 -18.56 -48.60 -28.92 3 0 8.63 -999 ? O1 EDO A 125 >ASP^A 86 -23.11 -50.07 -31.35 -22.48 -49.66 -33.33 -22.80 -49.86 -32.34 2 0 9.05 -999 ? O1 EDO A 125 >LEU^A 87 -24.54 -46.53 -26.85 -22.75 -46.35 -25.59 -23.65 -46.44 -26.22 3 0 -4.03 -999 ? O1 EDO A 125s >SER^A 88 -28.78 -47.83 -27.62 -30.92 -48.77 -27.01 -29.85 -48.30 -27.32 2 0 -5.03 -999 ? C1 EDO A 125s >LEU~A 89 -31.04 -43.51 -28.26 -31.53 -41.41 -28.05 -31.28 -42.46 -28.15 3 0 8.99 -999 ? O1 EDO A 125 >PRO~A 90 -34.27 -46.71 -27.76 -33.11 -45.80 -26.06 -33.69 -46.25 -26.91 3 0 7.68 -999 ? O2 EDO A 125 >GLY~A 91 -31.34 -48.06 -23.33 -31.38 -47.22 -23.45 -31.36 -47.64 -23.39 1 0 3.77 -999 ? O2 EDO A 125 >LEU~A 92 -28.52 -44.11 -23.20 -26.40 -44.39 -23.68 -27.46 -44.25 -23.44 3 0 5.17 -999 ? O2 EDO A 125 >MET?A 93 -32.62 -43.10 -21.62 -33.95 -40.68 -24.94 -33.29 -41.89 -23.28 2 0 10.81 -999 ? O2 EDO A 125 >ALA~A 94 -33.85 -46.06 -19.52 -34.14 -47.43 -20.08 -34.00 -46.75 -19.80 2 0 7.26 -999 ? O2 EDO A 125 >GLY.A 95 -30.71 -45.77 -17.39 -30.76 -46.33 -18.00 -30.74 -46.05 -17.69 1 0 7.33 -999 ? O2 EDO A 125 >ILE.A 96 -29.83 -49.86 -19.80 -30.44 -51.18 -19.96 -30.13 -50.52 -19.88 3 0 -4.10 -999 ? O2 EDO A 125s >PHE.A 97 -25.06 -46.06 -18.40 -26.02 -43.50 -17.83 -25.54 -44.78 -18.12 3 0 7.14 -999 ? O2 EDO A 125 >GLY.A 98 -24.21 -51.77 -20.47 -24.90 -51.86 -20.04 -24.55 -51.81 -20.25 1 0 4.74 -999 ? C2 EDO A 125 >THR~A 99 -24.60 -55.51 -20.10 -23.07 -56.46 -21.32 -23.83 -55.99 -20.71 2 0 7.67 -999 ? C2 EDO A 125 >LYS~A 100 -25.42 -56.72 -16.60 -31.34 -56.90 -14.61 -28.38 -56.81 -15.60 2 0 11.56 -999 ? C2 EDO A 125 >ALA~A 101 -22.27 -58.84 -16.86 -21.90 -59.72 -18.04 -22.09 -59.28 -17.45 2 0 12.03 -999 ? C2 EDO A 125 >TRP~A 102 -18.50 -53.08 -18.95 -20.92 -50.18 -17.77 -19.71 -51.63 -18.36 3 0 9.51 -999 ? C2 EDO A 125 >MET?A 103 -21.98 -53.69 -14.57 -25.85 -52.15 -15.50 -23.92 -52.92 -15.04 2 0 8.30 -999 ? O2 EDO A 125 >ALA~A 104 -21.28 -56.62 -12.26 -21.83 -58.03 -12.43 -21.56 -57.33 -12.34 2 0 14.55 -999 ? C2 EDO A 125 >ARG.A 106 -18.96 -50.95 -13.67 -17.68 -48.53 -15.14 -18.32 -49.74 -14.40 2 0 12.91 -999 ? O2 EDO A 125 >ALA.A 107 -16.42 -54.53 -7.60 -16.03 -56.00 -7.26 -16.23 -55.26 -7.43 2 0 20.71 -999 ? C2 EDO A 125 >ASN.B 22 -33.78 -50.89 -12.81 -33.60 -52.50 -11.46 -33.69 -51.69 -12.14 2 0 13.33 -999 ? O2 EDO A 125 >GLU.B 23 -37.28 -45.83 -14.10 -37.69 -47.33 -15.55 -37.49 -46.58 -14.83 2 0 12.57 -999 ? O2 EDO A 125 >PRO.B 24 -34.76 -42.94 -16.24 -33.94 -43.43 -14.22 -34.35 -43.19 -15.23 3 0 11.94 -999 ? O2 EDO A 125 >ARG.B 25 -36.52 -42.46 -8.39 -34.07 -42.97 -6.57 -35.29 -42.72 -7.48 2 0 18.77 -999 ? O2 EDO A 125 >ALA^B 26 -35.37 -36.70 -11.28 -36.61 -35.88 -11.60 -35.99 -36.29 -11.44 2 0 18.43 -999 ? C1 EDO A 124 >ALA^B 27 -32.94 -35.10 -8.82 -31.45 -35.26 -8.89 -32.19 -35.18 -8.85 2 0 18.83 -999 ? O1 EDO A 124 >LYS^B 28 -33.73 -31.52 -9.87 -27.90 -29.61 -8.14 -30.82 -30.56 -9.00 2 0 -17.65 -999 ? O1 EDO A 124s >ALA^B 29 -36.15 -29.79 -12.19 -37.52 -30.44 -12.12 -36.84 -30.11 -12.15 2 0 16.76 -999 ? O1 EDO A 124 >ARG^B 30 -32.75 -24.83 -13.79 -30.54 -26.25 -15.42 -31.65 -25.54 -14.60 2 0 10.56 -999 ? O1 EDO A 124 >TYR^B 31 -39.54 -22.77 -17.56 -40.07 -21.56 -20.02 -39.81 -22.16 -18.79 3 0 14.49 -999 ? O1 EDO A 124 >ASP^B 32 -33.94 -22.98 -18.86 -32.36 -21.71 -19.37 -33.15 -22.34 -19.12 2 0 9.42 -999 ? O1 EDO A 124 >ARG.B 33 -38.02 -16.52 -17.05 -40.13 -15.36 -15.15 -39.07 -15.94 -16.10 2 0 19.94 -999 ? O1 EDO A 124 >SER.B 34 -33.53 -18.42 -21.75 -31.18 -18.44 -22.38 -32.35 -18.43 -22.07 2 0 9.94 -999 ? O1 EDO A 124 >SER.B 35 -33.90 -21.70 -23.70 -33.48 -23.60 -22.25 -33.69 -22.65 -22.98 2 0 7.36 -999 ? O1 EDO A 124 >ALA.B 36 -37.66 -22.00 -23.01 -38.34 -21.47 -24.23 -38.00 -21.74 -23.62 2 0 11.83 -999 ? C1 EDO A 124 >ARG^B 37 -36.51 -26.95 -24.45 -36.69 -25.29 -27.04 -36.60 -26.12 -25.75 2 0 8.36 -999 ? C1 EDO A 124 >VAL^B 38 -37.94 -27.56 -18.58 -39.85 -28.20 -17.77 -38.90 -27.88 -18.18 3 0 13.01 -999 ? C1 EDO A 124 >ILE^B 39 -33.26 -28.18 -17.68 -32.08 -27.64 -18.26 -32.67 -27.91 -17.97 3 0 8.94 -999 ? O1 EDO A 124 >VAL^B 40 -34.56 -32.20 -15.54 -36.28 -33.47 -15.29 -35.42 -32.83 -15.41 3 0 13.65 -999 ? C1 EDO A 124 >ASP^B 41 -30.48 -32.41 -13.05 -30.04 -30.54 -13.91 -30.26 -31.47 -13.48 2 0 12.31 -999 ? O1 EDO A 124 >LEU^B 42 -31.56 -38.10 -14.56 -33.31 -38.25 -15.79 -32.44 -38.18 -15.17 3 0 14.47 -999 ? O2 EDO A 125 >GLU.B 43 -30.51 -39.33 -8.01 -32.05 -40.04 -6.75 -31.28 -39.69 -7.38 2 0 19.28 -999 ? O2 EDO A 125 >ASN.B 44 -28.13 -42.06 -13.38 -29.28 -41.52 -15.09 -28.70 -41.79 -14.24 2 0 11.30 -999 ? O2 EDO A 125 >GLY.B 45 -25.91 -37.87 -14.15 -26.60 -38.11 -14.45 -26.25 -37.99 -14.30 1 0 14.70 -999 ? O2 EDO A 125 >CYH.B 46 -28.14 -37.57 -17.20 -27.75 -39.99 -18.29 -27.94 -38.78 -17.74 2 0 10.55 -999 ? O2 EDO A 125 >THR^B 47 -30.27 -34.63 -18.25 -29.31 -32.68 -18.02 -29.79 -33.65 -18.13 2 0 9.39 -999 ? O1 EDO A 124 >PHE^B 48 -35.79 -35.63 -20.60 -37.94 -35.83 -22.37 -36.87 -35.73 -21.49 3 0 12.04 -999 ? C1 EDO A 124 >ALA^B 49 -35.14 -31.27 -21.36 -34.12 -30.27 -21.87 -34.63 -30.77 -21.62 2 0 7.26 -999 ? C1 EDO A 124 >PHE^B 50 -40.20 -31.46 -21.33 -41.48 -31.09 -18.84 -40.84 -31.27 -20.08 3 0 13.90 -999 ? C1 EDO A 124 >PRO~B 51 -40.15 -28.68 -26.59 -39.89 -28.23 -24.42 -40.02 -28.45 -25.50 3 0 11.19 -999 ? C1 EDO A 124 >PRO~B 52 -42.56 -25.03 -21.82 -42.59 -27.16 -22.47 -42.58 -26.09 -22.15 3 0 14.52 -999 ? C1 EDO A 124 >ARG~B 53 -46.71 -22.81 -24.44 -44.72 -21.34 -22.56 -45.72 -22.08 -23.50 2 0 17.71 -999 ? C1 EDO A 124 >LEU~B 54 -44.12 -30.81 -26.43 -43.06 -31.04 -28.33 -43.59 -30.93 -27.38 3 0 14.98 -999 ? C1 EDO A 124 >ALA~B 55 -46.89 -31.34 -22.78 -46.09 -31.26 -21.50 -46.49 -31.30 -22.14 2 0 18.17 -999 ? C1 EDO A 124 >GLN.B 56 -52.89 -32.90 -22.16 -54.01 -34.64 -22.72 -53.45 -33.77 -22.44 2 0 26.20 -999 ? C1 EDO A 124 >GLY.B 57 -51.53 -29.44 -19.30 -51.09 -29.07 -19.90 -51.31 -29.26 -19.60 1 0 23.79 -999 ? C1 EDO A 124 >LEU.B 58 -47.35 -27.17 -19.69 -46.30 -27.92 -17.93 -46.82 -27.54 -18.81 3 0 19.52 -999 ? C1 EDO A 124 >GLU.B 59 -51.65 -27.03 -23.81 -53.34 -28.06 -23.08 -52.49 -27.54 -23.45 2 0 24.69 -999 ? C1 EDO A 124 >GLY.B 60 -50.57 -21.34 -22.29 -50.23 -21.86 -21.81 -50.40 -21.60 -22.05 1 0 23.13 -999 ? C1 EDO A 124 >ALA.B 61 -48.78 -21.46 -18.93 -48.15 -22.68 -18.28 -48.47 -22.07 -18.60 2 0 21.66 -999 ? C1 EDO A 124 >SER~B 62 -46.80 -18.27 -18.25 -47.35 -17.46 -16.02 -47.07 -17.87 -17.13 2 0 23.65 -999 ? O1 EDO A 124 >ASP~B 63 -42.00 -17.28 -18.02 -41.30 -17.50 -20.04 -41.65 -17.39 -19.03 2 0 17.37 -999 ? O1 EDO A 124 >ASP~B 64 -44.68 -16.31 -13.41 -43.59 -14.49 -13.24 -44.14 -15.40 -13.33 2 0 23.62 -999 ? O1 EDO A 124 >GLN~B 65 -48.70 -19.66 -14.16 -50.49 -19.81 -15.35 -49.60 -19.73 -14.76 2 0 25.71 -999 ? C1 EDO A 124 >LEU~B 66 -43.15 -22.70 -16.79 -44.19 -23.46 -18.56 -43.67 -23.08 -17.68 3 0 17.96 -999 ? C1 EDO A 124 >CYH~B 67 -41.11 -22.14 -12.69 -40.26 -19.73 -13.32 -40.68 -20.93 -13.01 2 0 18.88 -999 ? O1 EDO A 124 >ALA.B 68 -43.26 -23.68 -10.03 -44.76 -23.42 -9.87 -44.01 -23.55 -9.95 2 0 23.26 -999 ? O1 EDO A 124 >VAL.B 69 -42.17 -27.20 -11.15 -40.62 -28.02 -12.49 -41.40 -27.61 -11.82 3 0 19.16 -999 ? O1 EDO A 124 >GLU^B 70 -42.61 -28.49 -6.30 -44.11 -28.60 -4.83 -43.36 -28.55 -5.57 2 0 26.28 -999 ? O1 EDO A 124 >ILE^B 71 -38.92 -33.72 -8.00 -37.68 -34.27 -8.56 -38.30 -34.00 -8.28 3 0 21.20 -999 ? O1 EDO A 124 >LEU^B 72 -44.25 -35.46 -6.58 -45.01 -34.22 -4.94 -44.63 -34.84 -5.76 3 0 26.85 -999 ? C1 EDO A 124 >GLY.B 73 -43.26 -39.74 -6.71 -42.70 -39.15 -6.19 -42.98 -39.45 -6.45 1 0 24.47 -999 ? O2 EDO A 125 >GLN.B 74 -39.96 -43.67 -5.29 -40.15 -43.70 -3.16 -40.06 -43.68 -4.22 2 0 24.11 -999 ? O2 EDO A 125 >GLY.B 75 -38.61 -38.85 -8.37 -39.07 -39.52 -8.69 -38.84 -39.19 -8.53 1 0 21.06 -999 ? O2 EDO A 125 >TYR.B 76 -40.23 -42.56 -10.93 -38.32 -44.50 -10.26 -39.27 -43.53 -10.60 3 0 17.92 -999 ? O2 EDO A 125 >GLY^B 77 -43.26 -37.30 -11.50 -42.54 -37.05 -11.23 -42.90 -37.18 -11.36 1 0 22.66 -999 ? C1 EDO A 124 >LEU^B 78 -42.62 -33.09 -13.72 -40.58 -33.23 -14.47 -41.60 -33.16 -14.09 3 0 18.42 -999 ? C1 EDO A 124 >HIS^B 79 -46.94 -31.68 -8.21 -48.72 -31.20 -7.20 -47.83 -31.44 -7.71 3 0 26.86 -999 ? C1 EDO A 124 >TRP^B 80 -45.45 -26.13 -12.93 -44.30 -29.29 -14.98 -44.87 -27.71 -13.95 3 0 20.31 -999 ? C1 EDO A 124 >GLU.B 81 -49.73 -27.02 -4.93 -50.17 -29.00 -4.35 -49.95 -28.01 -4.64 2 0 30.69 -999 ? O1 EDO A 124 >THR.B 82 -51.26 -24.31 -8.54 -50.96 -22.21 -8.11 -51.11 -23.26 -8.33 2 0 29.24 -999 ? O1 EDO A 124 >LEU.B 83 -50.68 -25.61 -13.23 -49.92 -24.11 -14.54 -50.30 -24.86 -13.89 3 0 25.07 -999 ? C1 EDO A 124 >ASP.B 84 -54.21 -28.97 -10.66 -54.93 -30.88 -10.14 -54.57 -29.92 -10.40 2 0 30.86 -999 ? C1 EDO A 124 >VAL^B 85 -50.59 -30.71 -13.58 -50.21 -29.89 -15.58 -50.40 -30.30 -14.58 3 0 24.68 -999 ? C1 EDO A 124 >ASP^B 86 -49.36 -34.92 -12.06 -49.49 -34.12 -10.11 -49.43 -34.52 -11.09 2 0 26.97 -999 ? C1 EDO A 124 >LEU^B 87 -45.62 -34.34 -16.64 -46.54 -32.89 -17.98 -46.08 -33.61 -17.31 3 0 20.22 -999 ? C1 EDO A 124 >SER^B 88 -44.76 -38.78 -15.84 -44.55 -41.13 -16.39 -44.66 -39.96 -16.12 2 0 19.82 -999 ? O2 EDO A 125 >LEU~B 89 -39.89 -38.23 -15.28 -37.88 -37.43 -15.63 -38.88 -37.83 -15.45 3 0 17.71 -999 ? C1 EDO A 124 >PRO~B 90 -40.98 -42.73 -15.66 -40.85 -41.32 -17.39 -40.92 -42.03 -16.53 3 0 16.38 -999 ? O2 EDO A 125 >GLY~B 91 -43.74 -41.04 -20.11 -43.00 -40.62 -20.02 -43.37 -40.83 -20.07 1 0 18.21 -999 ? O2 EDO A 125 >LEU~B 92 -41.76 -36.62 -20.33 -43.11 -34.97 -19.88 -42.44 -35.79 -20.10 3 0 16.78 -999 ? C1 EDO A 124 >MET?B 93 -38.81 -39.61 -21.96 -36.01 -39.35 -18.74 -37.41 -39.48 -20.35 2 0 13.65 -999 ? O2 EDO A 125 >ALA~B 94 -40.74 -42.37 -23.75 -41.76 -43.26 -23.09 -41.25 -42.81 -23.42 2 0 15.22 -999 ? O2 EDO A 125 >GLY~B 95 -42.20 -39.63 -26.00 -42.65 -39.90 -25.37 -42.42 -39.77 -25.68 1 0 17.55 -999 ? C1 EDO A 124 >ILE.B 96 -46.25 -40.79 -23.60 -47.03 -42.02 -23.47 -46.64 -41.40 -23.54 3 0 20.45 -999 ? O2 EDO A 125 >PHE.B 97 -44.93 -35.08 -25.21 -42.32 -35.38 -26.11 -43.63 -35.23 -25.66 3 0 16.35 -999 ? C1 EDO A 124 >GLY.B 98 -50.50 -36.59 -23.46 -50.16 -37.27 -23.84 -50.33 -36.93 -23.65 1 0 23.38 -999 ? C1 EDO A 124 >THR.B 99 -53.39 -38.76 -24.48 -55.06 -37.90 -23.47 -54.23 -38.33 -23.97 2 0 28.08 -999 ? C1 EDO A 124 >ALA.B 101 -56.51 -37.88 -28.60 -57.76 -37.79 -27.70 -57.13 -37.83 -28.15 2 0 30.45 -999 ? C1 EDO A 124 >TRP.B 102 -54.10 -32.30 -25.44 -50.24 -31.83 -25.86 -52.17 -32.06 -25.65 3 0 23.62 -999 ? C1 EDO A 124 >MET?B 103 -51.26 -35.87 -29.54 -48.31 -38.03 -27.58 -49.78 -36.95 -28.56 2 0 21.79 -999 ? C1 EDO A 124 >ALA.B 104 -52.83 -34.72 -32.75 -54.04 -35.60 -32.82 -53.43 -35.16 -32.78 2 0 26.82 -999 ? O2 EDO A 124