REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 08-DEC-08 3FGX COMPND RBSTP2171; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS STEAROTHERMOPHILUS; SOURCE 3 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 4 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 5 EXPRESSION_SYSTEM_STRAIN: BL21MAGIC; SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 7 EXPRESSION_SYSTEM_PLASMID: PMCSG7 AUTHOR G.MINASOV,E.V.FILIPPOVA,L.SHUVALOVA,S.MOY,A.JOACHIMIAK,W.F.ANDERSON, AUTHOR 2 MIDWEST CENTER FOR STRUCTURAL GENOMICS (MCSG) >ASN~A 9 -24.33 -24.70 6.43 -24.47 -23.71 4.55 -24.40 -24.21 5.49 2 0 1000.00 -999 ? >THR~A 10 -19.40 -24.61 6.53 -17.43 -24.15 7.29 -18.41 -24.38 6.91 2 0 1000.00 -999 ? >ASP~A 11 -21.08 -29.10 7.29 -20.71 -31.17 7.43 -20.90 -30.13 7.36 2 0 1000.00 -999 ? >GLU~A 12 -24.20 -28.82 3.48 -26.19 -28.16 3.18 -25.20 -28.49 3.33 2 0 1000.00 -999 ? >LEU~A 13 -19.27 -24.17 2.65 -20.34 -22.29 2.40 -19.81 -23.23 2.53 3 0 1000.00 -999 ? >LYS~A 14 -16.50 -27.46 1.93 -12.40 -28.00 6.75 -14.45 -27.73 4.34 2 0 1000.00 -999 ? >GLN~A 15 -19.29 -32.54 1.30 -21.08 -33.22 2.31 -20.18 -32.88 1.80 2 0 1000.00 -999 ? >LYS~A 16 -19.62 -28.57 -2.50 -23.41 -23.94 -3.87 -21.51 -26.26 -3.19 2 0 1000.00 -999 ? >TYR~A 17 -18.41 -24.02 -3.28 -20.90 -22.82 -3.73 -19.65 -23.42 -3.51 3 0 1000.00 -999 ? >GLY~A 18 -13.73 -27.95 -2.24 -14.02 -27.37 -1.78 -13.88 -27.66 -2.01 1 0 1000.00 -999 ? >ARG.A 19 -8.36 -25.03 -2.91 -5.45 -26.14 -3.21 -6.91 -25.58 -3.06 2 0 1000.00 -999 ? >VAL^A 20 -13.45 -22.50 0.91 -15.56 -22.92 0.96 -14.51 -22.71 0.94 3 0 1000.00 -999 ? >TYR^A 21 -10.22 -19.61 1.34 -8.60 -21.37 -0.09 -9.41 -20.49 0.63 3 0 1000.00 -999 ? >GLU^A 22 -14.78 -17.15 7.90 -13.40 -16.54 9.42 -14.09 -16.85 8.66 2 0 1000.00 -999 ? >ILE^A 23 -12.91 -12.84 4.85 -12.20 -12.11 3.91 -12.55 -12.47 4.38 3 0 1000.00 -999 ? >ARG^A 24 -15.10 -13.60 12.59 -13.46 -13.42 15.28 -14.28 -13.51 13.93 2 0 1000.00 -999 ? >ILE^A 25 -15.52 -7.58 7.42 -15.02 -7.12 6.09 -15.27 -7.35 6.76 3 0 1000.00 -999 ? >GLU.A 26 -15.93 -7.85 12.97 -14.24 -8.96 12.22 -15.08 -8.41 12.60 2 0 1000.00 -999 ? >GLY.A 27 -17.42 -1.99 12.03 -18.05 -2.48 12.21 -17.73 -2.24 12.12 1 0 1000.00 -999 ? >ALA.A 36 -22.26 -4.18 10.88 -22.76 -4.01 12.34 -22.51 -4.10 11.61 2 0 1000.00 -999 ? >GLU.A 37 -19.52 -9.80 12.17 -18.52 -10.62 13.84 -19.02 -10.21 13.00 2 0 1000.00 -999 ? >PHE^A 38 -20.54 -7.78 6.65 -22.16 -5.57 6.26 -21.35 -6.67 6.45 3 0 1000.00 -999 ? >VAL^A 39 -18.43 -13.18 7.63 -17.82 -14.42 9.30 -18.12 -13.80 8.46 3 0 1000.00 -999 ? >PHE^A 40 -19.09 -12.11 3.00 -21.13 -10.24 3.03 -20.11 -11.18 3.02 3 0 1000.00 -999 ? >TYR^A 41 -17.84 -18.69 4.19 -18.35 -18.90 6.89 -18.09 -18.79 5.54 3 0 1000.00 -999 ? >PHE^A 42 -14.23 -15.20 -0.54 -15.32 -12.66 -0.09 -14.78 -13.93 -0.32 3 0 1000.00 -999 ? >THR^A 43 -13.58 -19.79 -3.63 -14.45 -20.20 -5.56 -14.02 -20.00 -4.59 2 0 1000.00 -999 ? >ARG.A 44 -6.65 -21.22 -3.54 -3.60 -20.76 -3.05 -5.12 -20.99 -3.30 2 0 1000.00 -999 ? >PRO.A 45 -8.60 -15.73 -5.03 -9.09 -17.64 -6.18 -8.84 -16.69 -5.61 3 0 1000.00 -999 ? >LYS~A 46 -8.03 -18.58 -10.27 -7.94 -20.45 -15.37 -7.99 -19.51 -12.82 2 0 1000.00 -999 ? >VAL~A 47 -5.33 -17.35 -12.66 -3.69 -18.17 -13.83 -4.51 -17.76 -13.25 3 0 1000.00 -999 ? >SER~A 48 -8.17 -15.93 -14.76 -9.10 -18.04 -15.47 -8.64 -16.98 -15.12 2 0 1000.00 -999 ? >ASP~A 49 -9.77 -14.49 -10.51 -11.41 -15.85 -10.67 -10.59 -15.17 -10.59 2 0 1000.00 -999 ? >ILE~A 50 -4.71 -13.60 -10.89 -3.94 -14.14 -9.90 -4.32 -13.87 -10.40 3 0 1000.00 -999 ? >SER~A 51 -4.74 -11.62 -14.87 -6.00 -13.15 -16.24 -5.37 -12.39 -15.55 2 0 1000.00 -999 ? >ARG~A 52 -11.86 -10.15 -14.27 -14.84 -9.42 -14.49 -13.35 -9.78 -14.38 2 0 1000.00 -999 ? >PHE~A 53 -6.82 -8.02 -9.03 -6.49 -6.32 -6.71 -6.66 -7.17 -7.87 3 0 1000.00 -999 ? >THR~A 54 -4.12 -7.06 -12.90 -2.25 -7.99 -12.63 -3.18 -7.53 -12.77 2 0 1000.00 -999 ? >LYS~A 55 -5.39 -5.56 -16.11 -6.26 -10.05 -20.51 -5.82 -7.81 -18.31 2 0 1000.00 -999 ? >GLU~A 56 -10.13 -4.66 -14.90 -11.78 -5.86 -14.34 -10.95 -5.26 -14.62 2 0 1000.00 -999 ? >LEU~A 57 -4.80 -3.73 -10.60 -4.58 -4.02 -8.48 -4.69 -3.88 -9.54 3 0 1000.00 -999 ? >ASN~A 58 -3.17 -0.13 -14.23 -1.84 -1.74 -13.84 -2.50 -0.93 -14.03 2 0 1000.00 -999 ? >SER~A 59 -7.25 1.20 -15.14 -9.16 1.01 -16.62 -8.21 1.11 -15.88 2 0 1000.00 -999 ? >LYS~A 60 -10.16 0.79 -12.72 -16.12 2.18 -14.78 -13.14 1.49 -13.75 2 0 1000.00 -999 ? >PRO~A 61 -7.27 1.57 -9.53 -8.67 -0.13 -10.08 -7.97 0.72 -9.80 3 0 1000.00 -999 ? >ASP~A 62 -12.94 1.31 -8.44 -13.47 1.22 -10.55 -13.21 1.26 -9.50 2 0 1000.00 -999 ? >MET~A 63 -13.45 -2.67 -10.12 -16.24 -1.01 -10.50 -14.84 -1.84 -10.31 2 0 1000.00 -999 ? >ALA~A 64 -10.25 -4.66 -10.17 -8.84 -4.10 -9.97 -9.54 -4.38 -10.07 2 0 1000.00 -999 ? >MET~A 65 -11.27 -5.24 -6.47 -8.89 -2.45 -4.15 -10.08 -3.85 -5.31 2 0 1000.00 -999 ? >LYS~A 66 -15.06 -5.41 -6.79 -20.28 -2.93 -9.75 -17.67 -4.17 -8.27 2 0 1000.00 -999 ? >ASN~A 67 -14.57 -7.65 -11.01 -15.77 -6.17 -11.99 -15.17 -6.91 -11.50 2 0 1000.00 -999 ? >LEU~A 68 -11.02 -9.74 -7.46 -9.39 -11.01 -6.74 -10.21 -10.38 -7.10 3 0 1000.00 -999 ? >THR~A 69 -14.23 -10.39 -4.80 -14.27 -9.04 -3.13 -14.25 -9.71 -3.96 2 0 1000.00 -999 ? >PHE~A 70 -19.08 -9.06 -6.60 -20.70 -7.40 -5.03 -19.89 -8.23 -5.82 3 0 1000.00 -999 ? >SER~A 71 -16.12 -13.76 -8.76 -13.94 -13.29 -9.74 -15.03 -13.52 -9.25 2 0 1000.00 -999 ? >CYH.A 72 -15.09 -15.72 -5.60 -12.36 -15.45 -6.14 -13.72 -15.58 -5.87 2 0 1000.00 -999 ? >ILE.A 73 -18.92 -13.90 -3.12 -19.49 -13.87 -2.48 -19.21 -13.88 -2.80 3 0 1000.00 -999 ? >VAL~A 74 -19.71 -18.41 -2.93 -19.40 -19.39 -0.96 -19.56 -18.90 -1.94 3 0 1000.00 -999 ? >PRO~A 75 -22.35 -19.96 -6.01 -22.11 -18.05 -4.88 -22.23 -19.01 -5.45 3 0 1000.00 -999 ? >GLU~A 76 -25.16 -19.70 0.26 -27.27 -20.29 0.30 -26.22 -20.00 0.28 2 0 1000.00 -999 ? >GLN~A 77 -22.68 -15.11 1.97 -21.42 -15.70 3.56 -22.05 -15.40 2.76 2 0 1000.00 -999 ? >GLU~A 78 -23.47 -12.70 -5.63 -23.10 -13.22 -7.55 -23.28 -12.96 -6.59 2 0 1000.00 -999 ? >GLU~A 79 -29.05 -10.40 -2.09 -28.56 -8.51 -3.04 -28.81 -9.46 -2.57 2 0 1000.00 -999 ? >GLU~A 80 -24.69 -10.82 3.73 -24.36 -12.15 5.42 -24.53 -11.48 4.57 2 0 1000.00 -999 ? >LEU~A 81 -21.56 -10.14 -1.09 -19.41 -9.79 -1.33 -20.48 -9.97 -1.21 3 0 1000.00 -999 ? >ARG~A 82 -24.92 -7.91 -6.87 -27.83 -9.15 -6.67 -26.38 -8.53 -6.77 2 0 1000.00 -999 ? >GLN~A 83 -27.65 -5.53 1.90 -29.64 -6.14 2.52 -28.65 -5.84 2.21 2 0 1000.00 -999 ? >ALA~A 84 -23.13 -5.09 2.02 -22.39 -6.24 2.72 -22.76 -5.66 2.37 2 0 1000.00 -999 ? >ALA~A 85 -20.67 -3.69 -0.57 -20.25 -4.41 -1.85 -20.46 -4.05 -1.21 2 0 1000.00 -999 ? >GLU~A 86 -25.27 -0.26 -3.02 -24.46 0.23 -4.98 -24.87 -0.02 -4.00 2 0 1000.00 -999 ? >GLU~A 87 -26.30 -1.36 2.90 -27.31 -2.43 4.55 -26.80 -1.89 3.72 2 0 1000.00 -999 ? >PHE~A 88 -20.08 -1.17 5.01 -20.99 -0.94 7.66 -20.53 -1.06 6.33 3 0 1000.00 -999 ? >PRO.A 89 -19.23 2.88 0.12 -18.80 0.70 0.15 -19.01 1.79 0.14 3 0 1000.00 -999 ? >GLY~A 90 -14.61 0.08 0.40 -15.19 -0.51 0.39 -14.90 -0.21 0.40 1 0 1000.00 -999 ? >LEU~A 91 -16.98 -3.93 1.54 -17.85 -4.60 3.38 -17.41 -4.27 2.46 3 0 1000.00 -999 ? >THR~A 92 -14.07 -5.18 -1.54 -15.08 -4.46 -3.30 -14.58 -4.82 -2.42 2 0 1000.00 -999 ? >PHE~A 93 -9.68 -1.04 -0.44 -7.32 0.48 -0.76 -8.50 -0.28 -0.60 3 0 1000.00 -999 ? >ASN~A 94 -11.88 -5.49 3.12 -11.41 -5.15 5.12 -11.65 -5.32 4.12 2 0 1000.00 -999 ? >THR~A 95 -11.36 -8.79 0.54 -13.50 -8.64 0.39 -12.43 -8.71 0.46 2 0 1000.00 -999 ? >ALA~A 96 -9.63 -8.17 -2.78 -9.62 -6.82 -3.36 -9.63 -7.49 -3.07 2 0 1000.00 -999 ? >SER~A 97 -6.49 -8.01 -0.60 -5.45 -7.66 1.56 -5.97 -7.84 0.48 2 0 1000.00 -999 ? >ARG~A 98 -7.12 -11.47 4.47 -6.79 -10.65 7.44 -6.96 -11.06 5.95 2 0 1000.00 -999 ? >LEU~A 99 -8.98 -12.59 -2.73 -11.07 -13.16 -2.50 -10.03 -12.87 -2.62 3 0 1000.00 -999 ? >MET~A 100 -4.65 -11.94 -3.25 -4.78 -11.18 -6.34 -4.71 -11.56 -4.79 2 0 1000.00 -999 ? >GLU~A 101 -2.76 -10.49 1.67 -3.33 -9.81 3.69 -3.05 -10.15 2.68 2 0 1000.00 -999 ? >ILE~A 102 -5.66 -16.58 0.02 -5.50 -17.53 0.14 -5.58 -17.06 0.08 3 0 1000.00 -999 ? >VAL~A 103 -2.95 -16.69 -3.63 -4.25 -15.66 -5.02 -3.60 -16.18 -4.32 3 0 1000.00 -999 ? >GLY~A 104 0.54 -15.23 -3.16 0.03 -14.61 -3.12 0.28 -14.92 -3.14 1 0 1000.00 -999 ? >ALA.A 105 0.44 -11.43 -3.21 -0.64 -10.55 -3.83 -0.10 -10.99 -3.52 2 0 1000.00 -999 ? >SER.A 106 2.18 -10.67 0.10 0.33 -11.99 0.96 1.25 -11.33 0.53 2 0 1000.00 -999 ? >ALA.A 107 5.40 -9.84 2.16 5.41 -9.68 3.73 5.40 -9.76 2.95 2 0 1000.00 -999 ? >ALA.A 108 8.97 -10.68 0.94 8.92 -10.83 -0.61 8.95 -10.76 0.16 2 0 1000.00 -999 ? >THR.A 109 12.76 -9.82 1.42 13.79 -10.66 3.13 13.28 -10.24 2.27 2 0 1000.00 -999 ? >SER.A 110 15.78 -8.97 -0.72 13.91 -8.18 -2.07 14.84 -8.57 -1.39 2 0 1000.00 -999 ? >LEU.A 111 19.83 -10.26 0.36 19.15 -10.57 2.44 19.49 -10.42 1.40 3 0 1000.00 -999 ? >LYS.A 112 22.61 -8.67 -2.84 23.63 -14.27 -2.37 23.12 -11.47 -2.60 2 0 1000.00 -999 ? >ASN~B 9 -19.98 -19.96 -18.86 -20.97 -20.04 -16.98 -20.47 -20.00 -17.92 2 0 1000.00 -999 ? >THR~B 10 -19.98 -24.89 -18.94 -20.41 -26.87 -19.69 -20.20 -25.88 -19.32 2 0 1000.00 -999 ? >ASP~B 11 -15.49 -23.38 -19.91 -13.40 -23.71 -20.01 -14.44 -23.54 -19.96 2 0 1000.00 -999 ? >GLU~B 12 -16.01 -20.28 -16.40 -17.32 -18.72 -16.96 -16.67 -19.50 -16.68 2 0 1000.00 -999 ? >LEU~B 13 -20.41 -25.20 -15.21 -22.28 -24.10 -14.98 -21.35 -24.65 -15.10 3 0 1000.00 -999 ? >LYS~B 14 -17.07 -27.97 -14.54 -18.23 -32.70 -16.48 -17.65 -30.33 -15.51 2 0 1000.00 -999 ? >GLN~B 15 -12.02 -25.15 -13.86 -11.35 -23.36 -14.85 -11.68 -24.25 -14.36 2 0 1000.00 -999 ? >LYS~B 16 -15.98 -24.84 -10.07 -20.66 -21.05 -8.72 -18.32 -22.94 -9.39 2 0 1000.00 -999 ? >TYR~B 17 -20.53 -26.05 -9.30 -21.75 -23.58 -8.85 -21.14 -24.81 -9.07 3 0 1000.00 -999 ? >GLY~B 18 -16.59 -30.71 -10.33 -17.17 -30.42 -10.81 -16.88 -30.57 -10.57 1 0 1000.00 -999 ? >ARG.B 19 -19.50 -36.12 -9.69 -18.38 -39.02 -9.39 -18.94 -37.57 -9.54 2 0 1000.00 -999 ? >VAL^B 20 -22.03 -31.01 -13.51 -21.60 -28.90 -13.53 -21.82 -29.96 -13.52 3 0 1000.00 -999 ? >TYR^B 21 -24.91 -34.26 -13.96 -23.16 -35.87 -12.52 -24.04 -35.07 -13.24 3 0 1000.00 -999 ? >GLU^B 22 -27.38 -29.71 -20.52 -27.98 -31.07 -22.04 -27.68 -30.39 -21.28 2 0 1000.00 -999 ? >ILE^B 23 -31.69 -31.60 -17.47 -32.43 -32.35 -16.54 -32.06 -31.98 -17.01 3 0 1000.00 -999 ? >ARG^B 24 -30.92 -29.38 -25.20 -31.09 -31.02 -27.90 -31.01 -30.20 -26.55 2 0 1000.00 -999 ? >ILE^B 25 -36.95 -28.99 -20.06 -37.40 -29.47 -18.76 -37.18 -29.23 -19.41 3 0 1000.00 -999 ? >GLU.B 26 -36.67 -28.57 -25.61 -35.58 -30.28 -24.88 -36.12 -29.42 -25.25 2 0 1000.00 -999 ? >GLY.B 27 -42.53 -27.09 -24.67 -42.05 -26.45 -24.84 -42.29 -26.77 -24.75 1 0 1000.00 -999 ? >ALA.B 36 -40.37 -22.25 -23.52 -40.54 -21.78 -24.98 -40.45 -22.02 -24.25 2 0 1000.00 -999 ? >GLU.B 37 -34.73 -24.99 -24.80 -33.93 -26.02 -26.49 -34.33 -25.50 -25.64 2 0 1000.00 -999 ? >PHE^B 38 -36.77 -23.96 -19.28 -38.98 -22.35 -18.90 -37.88 -23.16 -19.09 3 0 1000.00 -999 ? >VAL^B 39 -31.36 -26.08 -20.25 -30.10 -26.66 -21.90 -30.73 -26.37 -21.07 3 0 1000.00 -999 ? >PHE^B 40 -32.44 -25.43 -15.63 -34.32 -23.37 -15.65 -33.38 -24.40 -15.64 3 0 1000.00 -999 ? >TYR^B 41 -25.87 -26.63 -16.79 -25.66 -26.12 -19.50 -25.76 -26.37 -18.15 3 0 1000.00 -999 ? >PHE^B 42 -29.34 -30.24 -12.10 -31.88 -29.14 -12.54 -30.61 -29.69 -12.32 3 0 1000.00 -999 ? >THR^B 43 -24.75 -30.91 -8.98 -24.34 -30.01 -7.06 -24.54 -30.46 -8.02 2 0 1000.00 -999 ? >ARG.B 44 -22.78 -37.86 -8.24 -23.27 -40.64 -9.33 -23.03 -39.25 -8.79 2 0 1000.00 -999 ? >PRO.B 45 -28.81 -35.89 -7.59 -26.91 -35.40 -6.44 -27.86 -35.64 -7.01 3 0 1000.00 -999 ? >LYS~B 46 -26.00 -36.45 -2.34 -24.17 -36.57 2.74 -25.08 -36.51 0.20 2 0 1000.00 -999 ? >VAL~B 47 -27.19 -39.17 0.04 -26.37 -40.81 1.21 -26.78 -39.99 0.63 3 0 1000.00 -999 ? >SER~B 48 -28.65 -36.34 2.14 -26.55 -35.42 2.88 -27.60 -35.88 2.51 2 0 1000.00 -999 ? >ASP~B 49 -30.08 -34.75 -2.11 -28.71 -33.10 -1.93 -29.40 -33.92 -2.02 2 0 1000.00 -999 ? >ILE~B 50 -30.95 -39.82 -1.76 -30.44 -40.59 -2.75 -30.69 -40.21 -2.26 3 0 1000.00 -999 ? >SER~B 51 -32.94 -39.81 2.21 -31.45 -38.54 3.66 -32.20 -39.18 2.93 2 0 1000.00 -999 ? >ARG~B 52 -34.44 -32.68 1.63 -35.17 -29.71 1.86 -34.80 -31.19 1.74 2 0 1000.00 -999 ? >PHE~B 53 -36.54 -37.72 -3.63 -38.24 -38.03 -5.93 -37.39 -37.87 -4.78 3 0 1000.00 -999 ? >THR~B 54 -37.50 -40.44 0.22 -36.57 -42.32 -0.04 -37.04 -41.38 0.09 2 0 1000.00 -999 ? >LYS~B 55 -39.00 -39.17 3.43 -34.52 -38.30 7.90 -36.76 -38.74 5.67 2 0 1000.00 -999 ? >GLU~B 56 -39.91 -34.43 2.22 -38.73 -32.76 1.63 -39.32 -33.60 1.93 2 0 1000.00 -999 ? >LEU~B 57 -40.83 -39.76 -2.06 -40.54 -39.95 -4.19 -40.68 -39.85 -3.12 3 0 1000.00 -999 ? >ASN~B 58 -44.43 -41.41 1.56 -42.81 -42.74 1.19 -43.62 -42.08 1.38 2 0 1000.00 -999 ? >SER~B 59 -45.79 -37.32 2.45 -45.63 -35.44 3.96 -45.71 -36.38 3.21 2 0 1000.00 -999 ? >LYS~B 60 -45.36 -34.41 0.04 -46.85 -28.56 2.03 -46.11 -31.49 1.04 2 0 1000.00 -999 ? >PRO~B 61 -46.10 -37.29 -3.17 -44.40 -35.91 -2.59 -45.25 -36.60 -2.88 3 0 1000.00 -999 ? >ASP~B 62 -45.88 -31.64 -4.22 -45.83 -31.14 -2.09 -45.85 -31.39 -3.16 2 0 1000.00 -999 ? >MET~B 63 -41.92 -31.09 -2.55 -43.51 -28.28 -2.11 -42.71 -29.68 -2.33 2 0 1000.00 -999 ? >ALA~B 64 -39.92 -34.31 -2.51 -40.49 -35.71 -2.72 -40.20 -35.01 -2.61 2 0 1000.00 -999 ? >MET~B 65 -39.32 -33.27 -6.19 -42.03 -35.75 -8.46 -40.67 -34.51 -7.32 2 0 1000.00 -999 ? >LYS~B 66 -39.16 -29.48 -5.87 -41.65 -24.26 -2.91 -40.41 -26.87 -4.39 2 0 1000.00 -999 ? >ASN~B 67 -36.92 -29.95 -1.64 -38.38 -28.78 -0.67 -37.65 -29.36 -1.16 2 0 1000.00 -999 ? >LEU~B 68 -34.85 -33.52 -5.20 -33.55 -35.15 -5.90 -34.20 -34.34 -5.55 3 0 1000.00 -999 ? >THR~B 69 -34.20 -30.30 -7.85 -35.52 -30.23 -9.52 -34.86 -30.26 -8.68 2 0 1000.00 -999 ? >PHE~B 70 -35.52 -25.44 -6.03 -37.18 -23.84 -7.62 -36.35 -24.64 -6.82 3 0 1000.00 -999 ? >SER~B 71 -30.82 -28.41 -3.86 -31.23 -30.61 -2.88 -31.02 -29.51 -3.37 2 0 1000.00 -999 ? >CYH.B 72 -28.89 -29.44 -7.02 -29.08 -32.20 -6.47 -28.98 -30.82 -6.75 2 0 1000.00 -999 ? >ILE.B 73 -30.69 -25.59 -9.49 -30.71 -25.02 -10.12 -30.70 -25.30 -9.81 3 0 1000.00 -999 ? >VAL~B 74 -26.16 -24.77 -9.66 -25.19 -25.06 -11.63 -25.68 -24.92 -10.65 3 0 1000.00 -999 ? >PRO~B 75 -24.62 -22.15 -6.57 -26.52 -22.38 -7.72 -25.57 -22.26 -7.14 3 0 1000.00 -999 ? >GLU~B 76 -24.87 -19.32 -12.85 -24.27 -17.20 -12.89 -24.57 -18.26 -12.87 2 0 1000.00 -999 ? >GLN~B 77 -29.46 -21.80 -14.59 -28.88 -23.07 -16.18 -29.17 -22.44 -15.38 2 0 1000.00 -999 ? >GLU~B 78 -31.90 -21.05 -6.98 -31.38 -21.44 -5.06 -31.64 -21.25 -6.02 2 0 1000.00 -999 ? >GLU~B 79 -34.20 -15.46 -10.54 -36.10 -15.95 -9.62 -35.15 -15.71 -10.08 2 0 1000.00 -999 ? >GLU~B 80 -33.74 -19.80 -16.34 -32.40 -20.11 -18.02 -33.07 -19.95 -17.18 2 0 1000.00 -999 ? >LEU~B 81 -34.44 -22.95 -11.52 -34.81 -25.09 -11.28 -34.62 -24.02 -11.40 3 0 1000.00 -999 ? >ARG~B 82 -36.70 -19.59 -5.76 -35.47 -16.68 -5.94 -36.09 -18.14 -5.85 2 0 1000.00 -999 ? >GLN~B 83 -39.06 -16.87 -14.52 -38.47 -14.86 -15.14 -38.76 -15.87 -14.83 2 0 1000.00 -999 ? >ALA~B 84 -39.47 -21.41 -14.64 -38.29 -22.14 -15.33 -38.88 -21.77 -14.98 2 0 1000.00 -999 ? >ALA~B 85 -40.90 -23.87 -12.07 -40.20 -24.28 -10.78 -40.55 -24.07 -11.42 2 0 1000.00 -999 ? >GLU~B 86 -44.33 -19.29 -9.61 -44.82 -20.12 -7.66 -44.57 -19.70 -8.63 2 0 1000.00 -999 ? >GLU~B 87 -43.24 -18.25 -15.53 -42.17 -17.21 -17.14 -42.70 -17.73 -16.34 2 0 1000.00 -999 ? >PHE~B 88 -43.40 -24.47 -17.66 -43.62 -23.55 -20.30 -43.51 -24.01 -18.98 3 0 1000.00 -999 ? >PRO.B 89 -47.44 -25.32 -12.78 -45.26 -25.75 -12.80 -46.35 -25.53 -12.79 3 0 1000.00 -999 ? >GLY~B 90 -44.64 -29.94 -13.07 -44.04 -29.35 -13.04 -44.34 -29.65 -13.06 1 0 1000.00 -999 ? >LEU~B 91 -40.62 -27.55 -14.20 -39.98 -26.68 -16.05 -40.30 -27.11 -15.12 3 0 1000.00 -999 ? >THR~B 92 -39.35 -30.46 -11.13 -40.07 -29.44 -9.37 -39.71 -29.95 -10.25 2 0 1000.00 -999 ? >PHE~B 93 -43.51 -34.85 -12.25 -45.01 -37.21 -11.92 -44.26 -36.03 -12.09 3 0 1000.00 -999 ? >ASN~B 94 -39.05 -32.63 -15.76 -39.44 -33.08 -17.76 -39.24 -32.85 -16.76 2 0 1000.00 -999 ? >THR~B 95 -35.74 -33.14 -13.19 -35.88 -31.01 -13.03 -35.81 -32.08 -13.11 2 0 1000.00 -999 ? >ALA~B 96 -36.36 -34.89 -9.88 -37.72 -34.89 -9.30 -37.04 -34.89 -9.59 2 0 1000.00 -999 ? >SER~B 97 -36.52 -38.01 -12.05 -36.85 -39.00 -14.23 -36.68 -38.51 -13.14 2 0 1000.00 -999 ? >ARG~B 98 -33.05 -37.38 -17.11 -33.86 -37.70 -20.09 -33.45 -37.54 -18.60 2 0 1000.00 -999 ? >LEU~B 99 -31.95 -35.51 -9.90 -31.37 -33.42 -10.11 -31.66 -34.47 -10.00 3 0 1000.00 -999 ? >MET~B 100 -32.58 -39.86 -9.40 -33.36 -39.74 -6.09 -32.97 -39.80 -7.75 2 0 1000.00 -999 ? >GLU~B 101 -34.02 -41.75 -14.32 -34.73 -41.18 -16.35 -34.38 -41.47 -15.34 2 0 1000.00 -999 ? >ILE~B 102 -27.93 -38.84 -12.65 -26.97 -39.00 -12.76 -27.45 -38.92 -12.71 3 0 1000.00 -999 ? >VAL~B 103 -27.81 -41.54 -9.01 -28.85 -40.25 -7.60 -28.33 -40.90 -8.31 3 0 1000.00 -999 ? >GLY~B 104 -29.27 -45.05 -9.49 -29.89 -44.54 -9.53 -29.58 -44.79 -9.51 1 0 1000.00 -999 ? >ALA.B 105 -33.07 -44.95 -9.44 -33.96 -43.87 -8.84 -33.51 -44.41 -9.14 2 0 1000.00 -999 ? >SER.B 106 -33.81 -46.69 -12.77 -31.85 -45.27 -13.00 -32.83 -45.98 -12.89 2 0 1000.00 -999 ? >ALA.B 107 -34.63 -49.90 -14.84 -34.81 -49.90 -16.39 -34.72 -49.90 -15.61 2 0 1000.00 -999 ? >ALA.B 108 -33.78 -53.48 -13.62 -33.64 -53.42 -12.08 -33.71 -53.45 -12.85 2 0 1000.00 -999 ? >THR.B 109 -34.65 -57.26 -14.11 -33.85 -58.32 -15.82 -34.25 -57.79 -14.96 2 0 1000.00 -999 ? >SER.B 110 -35.47 -60.29 -11.97 -36.30 -58.45 -10.63 -35.88 -59.37 -11.30 2 0 1000.00 -999 ? >LEU.B 111 -34.17 -64.34 -13.05 -33.84 -63.65 -15.12 -34.00 -64.00 -14.09 3 0 1000.00 -999 ? >LYS.B 112 -35.75 -67.15 -9.88 -30.18 -68.18 -10.26 -32.97 -67.67 -10.07 2 0 1000.00 -999 ?