REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 16-MAR-07 2P61 COMPND HYPOTHETICAL PROTEIN TM_1646; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA MSB8; SOURCE 3 ORGANISM_TAXID: 243274; SOURCE 4 STRAIN: MSB8, DSM 3109, JCM 10099; SOURCE 5 ATCC: 43589; SOURCE 6 GENE: TM_1646; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 8 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 11 EXPRESSION_SYSTEM_VECTOR: PET; SOURCE 12 EXPRESSION_SYSTEM_PLASMID: MODIFIED PET26 AUTHOR J.B.BONANNO,J.FREEMAN,K.T.BAIN,B.WU,S.OZYURT,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) >GLU~A 34 -28.69 81.00 6.89 -30.50 80.00 6.26 -29.60 80.50 6.57 2 0 1000.00 -999 ? >PHE~A 35 -22.22 81.37 2.02 -19.61 81.85 1.08 -20.92 81.61 1.55 3 0 1000.00 -999 ? >PHE~A 36 -19.67 82.15 6.12 -18.19 84.10 4.70 -18.93 83.12 5.41 3 0 1000.00 -999 ? >ASP~A 37 -23.99 76.91 8.21 -24.00 75.95 10.11 -23.99 76.43 9.16 2 0 1000.00 -999 ? >ILE~A 38 -23.50 75.22 2.99 -24.60 74.84 2.22 -24.05 75.03 2.61 3 0 1000.00 -999 ? >LEU~A 39 -18.41 77.79 3.71 -16.94 78.64 2.29 -17.67 78.22 3.00 3 0 1000.00 -999 ? >GLU~A 40 -17.55 76.19 8.92 -15.41 76.22 9.08 -16.48 76.21 9.00 2 0 1000.00 -999 ? >ASP~A 41 -21.07 71.26 5.34 -22.24 71.18 7.13 -21.66 71.22 6.24 2 0 1000.00 -999 ? >VAL~A 42 -17.80 71.54 2.28 -18.25 72.49 0.38 -18.03 72.01 1.33 3 0 1000.00 -999 ? >LYS~A 43 -14.53 72.05 4.16 -12.64 77.37 3.67 -13.58 74.71 3.91 2 0 1000.00 -999 ? >GLU~A 44 -16.21 68.40 8.91 -17.78 69.04 10.36 -16.99 68.72 9.64 2 0 1000.00 -999 ? >ASP~A 45 -17.37 66.83 2.86 -19.12 67.11 3.97 -18.24 66.97 3.42 2 0 1000.00 -999 ? >HIS~A 46 -11.68 69.38 0.36 -10.10 69.38 -1.02 -10.89 69.38 -0.33 3 0 1000.00 -999 ? >PHE~A 47 -9.48 67.61 6.56 -7.41 66.72 8.23 -8.45 67.16 7.40 3 0 1000.00 -999 ? >GLU~A 48 -14.28 63.61 6.90 -12.71 64.06 8.22 -13.50 63.84 7.56 2 0 1000.00 -999 ? >LYS~A 49 -11.91 62.74 1.46 -11.09 64.75 -3.73 -11.50 63.74 -1.13 2 0 1000.00 -999 ? >LEU~A 50 -7.85 65.24 1.98 -6.65 66.34 0.59 -7.25 65.79 1.28 3 0 1000.00 -999 ? >LEU~A 51 -8.41 62.32 6.07 -7.84 61.85 8.14 -8.12 62.09 7.11 3 0 1000.00 -999 ? >GLU~A 52 -11.53 57.54 2.50 -13.43 58.22 1.90 -12.48 57.88 2.20 2 0 1000.00 -999 ? >GLU~A 53 -8.55 60.02 -1.71 -8.75 61.92 -2.75 -8.65 60.97 -2.23 2 0 1000.00 -999 ? >ALA~A 54 -4.33 59.09 2.41 -3.99 60.18 3.40 -4.16 59.64 2.91 2 0 1000.00 -999 ? >VAL~A 55 -5.30 55.98 4.29 -6.55 55.17 5.82 -5.93 55.58 5.06 3 0 1000.00 -999 ? >GLU~A 56 -8.11 54.13 0.47 -9.68 54.97 -0.71 -8.90 54.55 -0.12 2 0 1000.00 -999 ? >GLU~A 57 -0.55 56.71 -1.68 -0.55 55.42 -3.50 -0.55 56.06 -2.59 2 0 1000.00 -999 ? >VAL~A 58 -0.75 53.92 2.96 -0.63 54.53 5.03 -0.69 54.23 4.00 3 0 1000.00 -999 ? >ILE~A 59 -3.84 50.03 2.36 -4.11 49.33 3.55 -3.97 49.68 2.95 3 0 1000.00 -999 ? >ASP~A 60 -2.93 51.05 -2.38 -5.04 50.24 -2.16 -3.98 50.65 -2.27 2 0 1000.00 -999 ? >SER~A 61 1.87 51.21 -1.21 2.03 53.22 0.25 1.95 52.21 -0.48 2 0 1000.00 -999 ? >GLY~A 62 2.35 48.88 1.92 2.12 48.79 1.02 2.24 48.84 1.47 1 0 1000.00 -999 ? >ASN~A 63 -0.61 45.92 -0.63 -1.78 44.97 1.05 -1.20 45.45 0.21 2 0 1000.00 -999 ? >GLU~A 64 3.77 48.21 -5.47 2.55 47.27 -6.92 3.16 47.74 -6.19 2 0 1000.00 -999 ? >LEU~A 65 6.47 48.16 0.21 8.33 48.53 1.41 7.40 48.34 0.81 3 0 1000.00 -999 ? >VAL~A 66 5.47 43.70 -0.11 4.08 42.83 1.43 4.77 43.27 0.66 3 0 1000.00 -999 ? >ARG~A 67 1.61 43.09 -5.29 0.94 40.75 -7.32 1.28 41.92 -6.31 2 0 1000.00 -999 ? >SER~A 68 8.69 44.16 -4.63 8.25 45.73 -6.49 8.47 44.95 -5.56 2 0 1000.00 -999 ? >PRO.A 69 11.10 43.29 -1.28 10.48 45.14 -2.31 10.79 44.22 -1.79 3 0 1000.00 -999 ? >THR~A 70 12.40 48.18 -4.05 11.14 48.64 -5.67 11.77 48.41 -4.86 2 0 1000.00 -999 ? >PRO~A 71 16.01 50.69 -3.60 13.80 50.82 -3.12 14.90 50.76 -3.36 3 0 1000.00 -999 ? >SER~A 72 11.45 53.39 -4.92 10.00 53.49 -6.97 10.73 53.44 -5.94 2 0 1000.00 -999 ? >ASN~A 73 8.01 50.12 -3.20 7.58 49.36 -5.19 7.79 49.74 -4.20 2 0 1000.00 -999 ? >LEU~A 74 11.36 51.47 0.99 11.73 51.19 3.16 11.54 51.33 2.08 3 0 1000.00 -999 ? >LYS~A 75 9.40 55.61 -0.05 14.97 56.31 -2.30 12.18 55.96 -1.18 2 0 1000.00 -999 ? >ARG~A 76 3.62 53.62 -4.41 0.79 52.53 -5.18 2.20 53.08 -4.80 2 0 1000.00 -999 ? >TYR~A 77 5.24 51.91 3.36 3.71 50.77 5.45 4.47 51.34 4.40 3 0 1000.00 -999 ? >LYS~A 78 7.29 56.38 4.07 12.60 54.68 6.50 9.94 55.53 5.29 2 0 1000.00 -999 ? >ASN~A 79 6.05 59.66 0.56 8.06 60.22 -0.03 7.06 59.94 0.27 2 0 1000.00 -999 ? >ALA~A 80 2.33 58.04 2.21 1.95 56.71 1.66 2.14 57.37 1.93 2 0 1000.00 -999 ? >ILE~A 81 3.46 56.52 6.70 3.66 55.47 7.64 3.56 56.00 7.17 3 0 1000.00 -999 ? >LYS~A 82 4.14 61.05 6.22 9.87 63.44 4.83 7.00 62.25 5.52 2 0 1000.00 -999 ? >GLU~A 83 1.12 63.54 2.08 3.16 64.15 2.02 2.14 63.84 2.05 2 0 1000.00 -999 ? >PHE~A 84 -2.49 58.59 7.71 -4.47 58.26 9.59 -3.48 58.43 8.65 3 0 1000.00 -999 ? >LEU~A 85 1.72 61.38 10.49 1.99 59.34 11.44 1.86 60.36 10.97 3 0 1000.00 -999 ? >LYS~A 86 -0.07 65.55 8.82 4.88 66.83 4.85 2.41 66.19 6.84 2 0 1000.00 -999 ? >LEU~A 87 -4.38 64.43 6.91 -4.54 64.89 4.83 -4.46 64.66 5.87 3 0 1000.00 -999 ? >ILE~A 88 -4.36 61.80 11.70 -4.81 61.13 12.11 -4.59 61.47 11.91 3 0 1000.00 -999 ? >GLU~A 89 -0.17 66.08 14.07 1.34 67.58 14.27 0.58 66.83 14.17 2 0 1000.00 -999 ? >LYS~A 90 -4.73 68.55 11.95 -3.05 70.50 6.00 -3.89 69.52 8.98 2 0 1000.00 -999 ? >LYS~A 91 -7.91 66.68 12.76 -12.65 63.04 11.12 -10.28 64.86 11.94 2 0 1000.00 -999 ? >ILE~A 92 -5.99 64.47 16.75 -5.75 63.36 17.08 -5.87 63.92 16.91 3 0 1000.00 -999 ? >TYR~A 93 -3.07 69.35 17.26 -0.60 68.42 18.28 -1.83 68.88 17.77 3 0 1000.00 -999 ? >LYS~A 94 -8.13 71.43 15.52 -10.06 75.05 11.19 -9.10 73.24 13.36 2 0 1000.00 -999 ? >LEU.A 95 -10.88 68.32 17.49 -12.35 67.43 16.08 -11.61 67.88 16.79 3 0 1000.00 -999 ? >ASN~A 102 -5.47 66.02 27.24 -3.88 67.50 27.37 -4.67 66.76 27.31 2 0 1000.00 -999 ? >SER~A 103 -6.23 61.71 25.54 -7.18 59.86 26.78 -6.70 60.78 26.16 2 0 1000.00 -999 ? >GLY~A 104 -6.44 61.96 21.75 -5.87 62.17 22.31 -6.15 62.07 22.03 1 0 1000.00 -999 ? >ARG~A 105 -3.30 67.75 22.45 -3.98 69.75 24.75 -3.64 68.75 23.60 2 0 1000.00 -999 ? >ALA~A 106 -1.50 61.55 23.88 -1.94 61.32 25.34 -1.72 61.44 24.61 2 0 1000.00 -999 ? >ARG~A 107 -5.49 56.48 22.46 -7.39 56.19 24.85 -6.44 56.34 23.66 2 0 1000.00 -999 ? >LEU~A 108 -1.68 61.77 18.37 -1.42 62.81 16.48 -1.55 62.29 17.42 3 0 1000.00 -999 ? >HIS~A 109 3.98 62.33 21.70 6.05 62.68 21.87 5.02 62.50 21.79 3 0 1000.00 -999 ? >LEU~A 110 2.42 57.06 22.63 2.80 57.57 24.75 2.61 57.31 23.69 3 0 1000.00 -999 ? >VAL~A 111 1.59 55.96 18.24 -0.22 55.09 17.61 0.69 55.52 17.92 3 0 1000.00 -999 ? >VAL~A 112 3.53 58.19 15.86 3.29 60.23 15.08 3.41 59.21 15.47 3 0 1000.00 -999 ? >GLU~A 113 7.81 58.48 20.12 8.28 58.10 22.27 8.05 58.29 21.19 2 0 1000.00 -999 ? >GLU~A 114 4.85 51.76 18.76 3.18 50.48 19.17 4.02 51.12 18.97 2 0 1000.00 -999 ? >VAL~A 115 5.26 54.03 13.74 3.87 54.97 12.40 4.56 54.50 13.07 3 0 1000.00 -999 ? >ASN~A 116 8.96 57.19 13.71 7.64 58.78 13.01 8.30 57.99 13.36 2 0 1000.00 -999 ? >GLU~A 117 10.89 53.22 17.84 12.86 52.43 18.23 11.87 52.83 18.03 2 0 1000.00 -999 ? >LYS~A 118 8.93 50.41 13.13 7.66 46.98 16.68 8.30 48.69 14.91 2 0 1000.00 -999 ? >LEU~A 119 9.20 53.73 9.66 7.64 54.17 8.26 8.42 53.95 8.96 3 0 1000.00 -999 ? >MET~A 120 13.24 52.52 11.36 14.14 55.95 13.81 13.69 54.24 12.59 2 0 1000.00 -999 ? >ASP~A 121 12.43 47.98 13.10 12.70 48.54 15.14 12.56 48.26 14.12 2 0 1000.00 -999 ? >LEU~A 122 10.64 48.60 8.15 9.61 47.87 6.45 10.12 48.24 7.30 3 0 1000.00 -999 ? >THR~A 123 14.51 50.26 6.78 14.59 52.43 6.56 14.55 51.34 6.67 2 0 1000.00 -999 ? >GLU~A 124 18.83 48.76 10.91 18.80 48.71 13.07 18.81 48.74 11.99 2 0 1000.00 -999 ? >LYS~A 125 16.56 45.42 7.72 16.08 41.05 10.42 16.32 43.24 9.07 2 0 1000.00 -999 ? >ILE~A 126 15.13 47.16 3.48 14.24 47.64 2.36 14.69 47.40 2.92 3 0 1000.00 -999 ? >MET~A 127 19.46 47.82 4.10 19.73 51.76 4.96 19.60 49.79 4.53 2 0 1000.00 -999 ? >LYS~A 128 21.25 44.91 5.84 22.42 45.61 11.54 21.83 45.26 8.69 2 0 1000.00 -999 ? >ASN.A 129 20.70 42.33 2.12 20.87 43.84 0.67 20.79 43.08 1.40 2 0 1000.00 -999 ? >GLU.A 130 19.52 41.03 7.83 19.52 41.81 9.75 19.52 41.42 8.79 2 0 1000.00 -999 ? >TRP.A 131 17.35 40.65 1.20 14.66 43.45 0.76 16.01 42.05 0.98 3 0 1000.00 -999 ? >GLN.A 132 15.50 33.80 3.83 17.04 33.10 2.49 16.27 33.45 3.16 2 0 1000.00 -999 ? >THR.A 133 14.14 37.21 8.84 15.97 37.03 9.95 15.05 37.12 9.39 2 0 1000.00 -999 ? >ILE.A 134 12.80 41.33 6.49 12.39 42.26 5.55 12.59 41.79 6.02 3 0 1000.00 -999 ? >ASN~A 135 8.72 38.95 9.30 9.21 37.01 9.94 8.97 37.98 9.62 2 0 1000.00 -999 ? >LEU~A 136 8.62 42.43 4.29 8.81 44.35 3.32 8.72 43.39 3.80 3 0 1000.00 -999 ? >ALA~A 137 4.27 41.32 4.99 3.69 40.06 4.58 3.98 40.69 4.78 2 0 1000.00 -999 ? >ALA~A 138 3.83 41.18 8.82 4.23 40.07 9.72 4.03 40.63 9.27 2 0 1000.00 -999 ? >ARG~A 139 9.65 44.38 9.40 11.23 44.12 11.95 10.44 44.25 10.68 2 0 1000.00 -999 ? >ILE~A 140 3.55 46.01 5.73 3.82 46.49 4.50 3.69 46.25 5.11 3 0 1000.00 -999 ? >GLU~A 141 -0.79 42.65 7.52 -0.72 40.61 7.23 -0.75 41.63 7.37 2 0 1000.00 -999 ? >GLU~A 142 3.33 46.17 13.71 4.75 45.16 15.03 4.04 45.67 14.37 2 0 1000.00 -999 ? >ILE~A 143 3.49 49.92 9.90 4.58 50.44 9.46 4.04 50.18 9.68 3 0 1000.00 -999 ? >ASN~A 144 -1.51 48.64 7.86 -0.40 48.76 6.03 -0.95 48.70 6.94 2 0 1000.00 -999 ? >GLY~A 145 -2.68 48.30 12.07 -2.22 49.08 11.89 -2.45 48.69 11.98 1 0 1000.00 -999 ? >LEU~A 146 0.08 51.62 14.20 1.25 50.69 15.70 0.66 51.15 14.95 3 0 1000.00 -999 ? >ILE~A 147 -1.68 53.91 9.71 -1.00 54.33 8.80 -1.34 54.12 9.26 3 0 1000.00 -999 ? >LEU~A 148 -6.37 51.18 10.64 -6.81 50.55 8.58 -6.59 50.86 9.61 3 0 1000.00 -999 ? >ASN~A 149 -5.16 52.67 16.11 -5.00 50.56 16.41 -5.08 51.62 16.26 2 0 1000.00 -999 ? >LEU~A 150 -3.65 56.94 13.61 -1.99 57.66 14.82 -2.82 57.30 14.21 3 0 1000.00 -999 ? >TYR~A 151 -8.75 56.47 9.44 -10.51 57.13 7.41 -9.63 56.80 8.43 3 0 1000.00 -999 ? >ARG~A 152 -10.34 52.41 15.86 -12.99 51.04 15.13 -11.66 51.73 15.50 2 0 1000.00 -999 ? >GLU.A 153 -7.28 59.08 18.11 -7.62 58.24 20.03 -7.45 58.66 19.07 2 0 1000.00 -999 ?