HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 23-SEP-04 1XJC COMPND MOBB PROTEIN HOMOLOG; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; SOURCE 3 ORGANISM_TAXID: 1422; SOURCE 4 GENE: RBSTP0958; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21[DE3]PMAGIC; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PMCSG7 AUTHOR J.OSIPIUK,M.ZHOU,S.MOY,F.COLLART,A.JOACHIMIAK,MIDWEST CENTER FOR AUTHOR 2 STRUCTURAL GENOMICS (MCSG) HET MSE A 1 8 HET MSE A 18 8 HET MSE A 159 8 mMETA 1 25.41 71.94 5.85 26.08 72.63 6.10 23.22 70.90 6.43 23.38 71.19 7.62 24.39 70.90 5.47 24.99 69.50 5.49 2 0 1000.00-999 ?-999 ?-999 ? mASN.A 2 22.05 70.55 5.92 22.07 70.34 4.94 20.82 69.05 7.30 20.23 68.16 6.68 20.86 70.48 6.75 19.63 70.77 5.89 2 0 1000.00-999 ?-999 ?-999 ? mVAL^A 3 21.44 68.84 8.45 21.85 69.66 8.84 20.52 67.34 10.20 20.45 68.18 11.09 21.52 67.51 9.07 22.92 67.27 9.67 3 0 1000.00-999 ?-999 ?-999 ? mTRP^A 4 19.75 66.25 10.18 19.90 65.66 9.38 18.99 64.55 11.75 19.29 63.65 10.98 18.79 65.97 11.24 17.34 66.11 10.73 3 0 1000.00-999 ?-999 ?-999 ? mGLN^A 5 18.81 64.35 13.05 18.55 65.16 13.58 17.68 62.39 14.06 16.73 63.05 14.47 18.99 63.04 13.62 19.92 63.11 14.82 2 0 1000.00-999 ?-999 ?-999 ? mVAL^A 6 17.67 61.07 13.99 18.51 60.67 13.62 17.14 59.35 15.46 18.01 58.53 15.15 16.54 60.27 14.41 15.95 59.46 13.24 3 0 1000.00-999 ?-999 ?-999 ? mVAL^A 7 16.71 59.51 16.71 16.02 60.22 16.83 16.16 57.90 18.53 15.01 58.37 18.67 17.24 58.68 17.80 18.02 59.54 18.83 3 0 1000.00-999 ?-999 ?-999 ? mGLY.A 8 16.52 56.71 19.01 17.47 56.46 18.83 16.11 54.45 19.86 17.03 54.04 19.14 15.59 55.87 19.73-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mTYR.A 9 15.52 53.70 20.78 14.79 54.16 21.29 15.33 51.39 19.97 14.60 51.82 19.07 15.93 52.33 21.02 15.53 51.93 22.44 3 0 1000.00-999 ?-999 ?-999 ? mLYS.A 10 15.65 50.10 20.08 16.26 49.91 20.85 13.63 49.08 19.07 12.96 49.19 20.09 15.16 49.08 19.15 15.66 47.69 19.57 2 0 1000.00-999 ?-999 ?-999 ? mHIS.A 11 13.10 48.99 17.85 13.79 48.95 17.12 10.91 50.18 18.16 9.73 50.10 18.47 11.65 48.96 17.61 11.03 47.69 18.22 3 0 1000.00-999 ?-999 ?-999 ? mSER.A 12 11.60 51.31 18.28 12.56 51.25 18.01 10.11 53.19 17.68 9.23 53.99 17.98 10.97 52.53 18.77 12.04 53.51 19.24 2 0 1000.00-999 ?-999 ?-999 ? mGLY~A 13 10.39 52.84 16.42 11.13 52.17 16.33 10.57 54.25 14.37 10.10 54.85 13.39 9.68 53.42 15.29-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mLYS~A 14 11.88 54.28 14.65 12.16 53.75 15.46 12.82 54.57 12.35 13.05 55.38 11.46 12.78 55.04 13.81 14.19 55.10 14.42 2 0 1000.00-999 ?-999 ?-999 ? mTHR~A 15 12.58 53.27 12.11 12.43 52.72 12.93 11.38 53.37 9.97 11.49 53.76 8.81 12.56 52.75 10.74 12.39 51.21 10.74 2 0 1000.00-999 ?-999 ?-999 ? mTHR~A 16 10.22 53.42 10.61 10.24 53.03 11.53 9.33 55.49 9.69 9.13 55.93 8.56 9.05 54.02 10.00 7.83 53.88 10.94 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 17 9.83 56.24 10.67 9.97 55.77 11.54 11.17 57.86 9.32 10.94 58.66 8.41 10.14 57.66 10.44 10.66 58.33 11.70 3 0 1000.00-999 ?-999 ?-999 ? mMETA 18 12.28 57.14 9.38 12.35 56.53 10.17 12.74 57.02 6.95 12.95 57.79 6.01 13.32 57.28 8.34 14.48 56.28 8.57 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 19 12.01 55.93 6.81 11.89 55.38 7.64 10.48 56.64 4.98 10.59 57.06 3.82 11.44 55.60 5.52 10.74 54.23 5.58 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 20 9.55 57.07 5.82 9.58 56.68 6.73 9.18 59.41 5.15 8.80 60.12 4.22 8.57 58.05 5.38 7.44 58.15 6.41 2 0 1000.00-999 ?-999 ?-999 ? mTRP~A 21 10.13 59.80 6.00 10.36 59.13 6.70 11.60 61.13 4.59 11.51 62.07 3.81 10.76 61.11 5.87 11.64 61.39 7.09 3 0 1000.00-999 ?-999 ?-999 ? mVAL~A 22 12.42 60.10 4.37 12.44 59.41 5.09 12.31 60.10 1.91 12.58 60.85 0.97 13.23 60.04 3.14 14.10 58.73 3.08 3 0 1000.00-999 ?-999 ?-999 ? mALA~A 23 11.22 59.33 1.91 11.11 58.78 2.73 9.67 60.68 0.47 9.56 61.08 -0.70 10.29 59.31 0.77 9.15 58.25 1.01 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 24 9.27 61.41 1.50 9.42 60.99 2.40 9.74 63.65 0.73 9.48 64.42 -0.20 8.67 62.73 1.29 8.13 63.30 2.62 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 25 10.96 63.58 1.28 11.05 62.92 2.02 12.31 64.11 -0.69 12.47 65.01 -1.51 12.04 64.44 0.78 13.32 64.24 1.62 2 0 1000.00-999 ?-999 ?-999 ? mVAL~A 26 12.38 62.82 -1.03 12.25 62.18 -0.27 11.53 62.93 -3.34 11.81 63.48 -4.41 12.63 62.42 -2.42 12.76 60.85 -2.56 3 0 1000.00-999 ?-999 ?-999 ? mARG~A 27 10.27 62.76 -2.93 10.18 62.30 -2.05 9.23 64.73 -4.03 8.83 65.18 -5.09 9.15 63.24 -3.74 7.80 62.99 -3.06 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 28 9.72 65.50 -3.06 9.97 65.01 -2.23 11.04 67.23 -4.16 11.32 68.38 -4.46 9.87 66.95 -3.24 10.12 67.65 -1.90 2 0 1000.00-999 ?-999 ?-999 ? mGLY.A 29 11.73 66.17 -4.59 11.40 65.28 -4.27 14.17 66.73 -4.75 15.13 67.15 -5.41 12.88 66.34 -5.46-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mTRP.A 30 14.23 66.60 -3.43 13.39 66.25 -3.01 16.56 65.92 -2.89 16.31 64.75 -3.21 15.44 66.95 -2.70 15.14 67.08 -1.20 3 0 1000.00-999 ?-999 ?-999 ? mARG.A 31 17.80 66.37 -2.71 17.85 67.35 -2.51 19.18 65.10 -1.34 19.55 65.92 -0.49 18.99 65.52 -2.80 20.18 66.32 -3.33 2 0 1000.00-999 ?-999 ?-999 ? mVAL^A 32 18.92 63.82 -1.06 18.69 63.26 -1.86 20.12 62.32 0.58 20.50 61.53 -0.30 18.99 63.30 0.31 17.67 62.57 0.68 3 0 1000.00-999 ?-999 ?-999 ? mGLY^A 33 20.64 62.37 1.81 20.27 63.08 2.40 21.22 60.82 3.54 20.51 61.49 4.29 21.67 61.43 2.22-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mTHR^A 34 21.56 59.56 3.81 22.05 59.08 3.08 22.45 58.32 5.70 23.34 57.89 4.96 21.21 58.97 5.11 20.08 57.90 5.01 2 0 1000.00-999 ?-999 ?-999 ? mVAL^A 35 22.51 58.26 7.03 21.73 58.70 7.47 22.98 56.81 8.87 22.11 57.31 9.61 23.62 57.63 7.75 24.61 58.69 8.39 3 0 1000.00-999 ?-999 ?-999 ? mLYS^A 36 23.37 55.55 8.99 24.04 55.27 8.30 24.01 53.94 10.68 24.92 53.47 9.98 22.84 54.68 10.03 21.87 53.64 9.46 2 0 1000.00-999 ?-999 ?-999 ? mHIS.A 37 23.98 53.85 12.00 23.20 54.31 12.44 24.58 51.69 12.82 23.60 51.36 13.48 25.02 53.15 12.74 25.18 53.77 14.13 3 0 1000.00-999 ?-999 ?-999 ? mHIS.A 38 25.33 50.83 12.12 26.09 51.29 11.67 23.92 48.79 12.74 23.56 47.63 12.49 25.10 49.38 12.00 26.36 48.59 12.37 3 0 1000.00-999 ?-999 ?-999 ? mGLY.A 59 41.10 41.62 3.78 40.55 40.97 3.25 42.23 43.86 3.83 43.07 44.64 4.28 41.90 42.56 4.55-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mALA.A 60 41.59 44.09 2.69 40.97 43.37 2.40 41.29 46.48 2.82 40.34 46.30 3.58 41.82 45.33 1.96 41.08 45.31 0.63 2 0 1000.00-999 ?-999 ?-999 ? mVAL.A 61 41.91 47.65 2.71 42.68 47.65 2.08 40.22 49.42 2.79 39.32 49.92 3.47 41.46 48.82 3.46 42.56 49.91 3.54 3 0 1000.00-999 ?-999 ?-999 ? mALA^A 62 40.18 49.36 1.46 40.96 48.90 1.04 38.69 49.13 -0.55 39.57 48.67 -1.30 39.06 49.92 0.70 39.39 51.36 0.29 2 0 1000.00-999 ?-999 ?-999 ? mTHR^A 63 37.39 48.96 -0.77 36.78 49.32 -0.05 35.80 49.16 -2.55 35.07 49.85 -1.82 36.91 48.29 -1.97 36.36 46.88 -1.67 2 0 1000.00-999 ?-999 ?-999 ? mALA^A 64 35.69 49.15 -3.87 36.35 48.57 -4.35 34.23 49.20 -5.79 35.06 48.68 -6.56 34.67 49.93 -4.54 35.21 51.31 -4.92 2 0 1000.00-999 ?-999 ?-999 ? mVAL^A 65 32.92 49.14 -5.98 32.38 49.55 -5.25 31.47 49.60 -7.76 30.63 50.17 -7.05 32.34 48.51 -7.16 31.46 47.31 -6.80 3 0 1000.00-999 ?-999 ?-999 ? mGLU^A 66 31.67 49.89 -9.04 32.36 49.34 -9.50 30.20 50.51 -10.96 30.74 49.72 -11.74 30.91 50.96 -9.69 31.84 52.13 -10.01 2 0 1000.00-999 ?-999 ?-999 ? mGLY^A 67 29.00 51.05 -11.16 28.69 51.67 -10.45 26.94 51.52 -12.42 26.25 51.69 -11.41 28.24 50.74 -12.35-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mASP.A 68 26.63 52.03 -13.61 27.31 51.87 -14.32 25.14 53.98 -12.94 23.99 54.27 -12.60 25.38 52.75 -13.83 24.19 51.79 -13.65 2 0 1000.00-999 ?-999 ?-999 ? mGLY.A 69 26.18 54.71 -12.56 27.07 54.40 -12.90 25.98 55.55 -10.22 26.02 56.44 -9.36 25.98 55.87 -11.71-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mLEU^A 70 25.96 54.26 -9.90 25.92 53.64 -10.68 27.36 53.35 -8.06 27.90 52.40 -8.61 25.98 53.82 -8.51 24.99 52.68 -8.29 3 0 1000.00-999 ?-999 ?-999 ? mLEU^A 71 27.94 54.03 -7.07 27.41 54.81 -6.73 29.07 53.03 -5.16 28.54 53.66 -4.25 29.25 53.65 -6.54 30.19 54.85 -6.45 3 0 1000.00-999 ?-999 ?-999 ? mGLN^A 72 29.51 51.79 -5.03 29.89 51.40 -5.86 30.82 51.03 -3.15 31.77 50.56 -3.79 29.42 51.08 -3.76 28.92 49.67 -4.00 2 0 1000.00-999 ?-999 ?-999 ? mLEU^A 73 30.94 51.51 -1.91 30.07 51.83 -1.52 32.19 50.89 0.16 31.18 50.96 0.90 32.21 51.57 -1.20 32.61 53.03 -0.99 3 0 1000.00-999 ?-999 ?-999 ? mHIS^A 74 33.31 50.25 0.50 34.00 50.25 -0.22 34.86 50.14 2.25 35.90 49.82 1.65 33.50 49.61 1.80 33.51 48.08 1.65 3 0 1000.00-999 ?-999 ?-999 ? mLEU^A 75 34.86 50.98 3.28 33.96 51.14 3.69 36.33 51.26 5.22 35.43 51.38 6.05 36.08 51.60 3.76 35.98 53.13 3.59 3 0 1000.00-999 ?-999 ?-999 ? mARG.A 76 37.56 50.85 5.53 38.20 50.82 4.77 38.77 51.53 7.57 39.65 52.13 6.95 37.90 50.48 6.90 38.61 49.11 6.92 2 0 1000.00-999 ?-999 ?-999 ? mARG.A 77 38.51 51.74 8.86 37.77 51.17 9.22 39.11 52.22 11.10 38.15 51.52 11.43 39.25 52.71 9.66 38.59 54.08 9.55 2 0 1000.00-999 ?-999 ?-999 ? mPRO.A 78 40.07 52.55 11.98 40.83 53.11 11.64 38.53 52.52 13.88 37.78 51.72 14.45 39.91 52.07 13.36 41.08 52.74 14.10 3 0 1000.00-999 ?-999 ?-999 ? mLEU.A 79 38.19 53.78 13.64 38.89 54.31 13.15 36.31 55.37 13.12 37.00 56.29 12.71 36.90 54.32 14.06 37.01 54.95 15.46 3 0 1000.00-999 ?-999 ?-999 ? mTRP.A 80 35.02 55.24 12.80 34.58 54.43 13.18 33.46 57.15 12.79 32.55 56.69 13.47 34.35 56.23 11.95 33.46 55.55 10.90 3 0 1000.00-999 ?-999 ?-999 ? mARG~A 81 33.73 58.45 12.76 34.52 58.71 12.21 31.85 59.93 12.50 32.10 59.95 11.29 32.88 59.38 13.49 33.72 60.53 14.05 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 82 30.70 60.37 12.99 30.60 60.31 13.98 30.28 61.99 11.21 30.02 62.03 10.02 29.67 60.90 12.09 28.47 61.47 12.86 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 83 31.09 62.87 11.79 31.23 62.76 12.78 32.55 63.38 9.84 32.64 64.01 8.79 31.70 63.92 10.98 32.51 64.90 11.83 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 84 33.18 62.21 10.02 33.07 61.78 10.91 33.01 61.35 7.74 33.33 61.61 6.58 33.95 61.65 8.90 34.64 60.36 9.29 2 0 1000.00-999 ?-999 ?-999 ? mVAL~A 85 31.84 60.80 8.06 31.69 60.65 9.03 30.30 61.73 6.38 30.24 61.83 5.16 30.87 60.47 7.02 29.72 59.59 7.58 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 86 29.90 62.71 7.18 30.01 62.52 8.16 30.35 64.69 5.75 29.95 65.46 4.87 29.35 63.95 6.64 28.87 64.88 7.76 3 0 1000.00-999 ?-999 ?-999 ? mALA~A 87 31.65 64.48 5.99 31.84 63.85 6.74 32.65 64.53 3.77 32.89 65.22 2.79 32.67 65.14 5.18 34.06 64.96 5.81 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 88 32.35 63.24 3.69 32.19 62.78 4.56 30.99 62.98 1.64 30.91 62.83 0.43 32.26 62.57 2.39 32.26 61.04 2.56 3 0 1000.00-999 ?-999 ?-999 ? mTYR~A 89 30.00 63.50 2.37 30.21 63.57 3.35 28.76 65.36 1.29 28.02 65.75 0.39 28.72 63.93 1.77 27.59 63.79 2.80 3 0 1000.00-999 ?-999 ?-999 ? mALA~A 90 29.64 66.15 1.90 30.17 65.68 2.61 29.84 67.88 0.08 29.14 68.77 -0.39 29.80 67.56 1.58 31.05 68.10 2.27 2 0 1000.00-999 ?-999 ?-999 ? mPRO~A 91 30.66 67.14 -0.69 31.17 66.43 -0.19 29.53 67.03 -2.96 29.45 67.38 -4.14 30.77 67.38 -2.13 31.97 66.50 -2.54 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 92 28.56 66.34 -2.36 28.72 66.14 -1.39 26.17 66.90 -3.12 25.08 66.51 -3.56 27.36 65.94 -3.10 26.90 64.57 -2.62 3 0 1000.00-999 ?-999 ?-999 ? mARG~A 93 26.35 68.14 -2.67 27.27 68.32 -2.33 23.92 68.61 -2.18 22.90 68.78 -2.83 25.26 69.14 -2.71 25.02 69.61 -4.14 2 0 1000.00-999 ?-999 ?-999 ? mLEU.A 94 23.94 67.98 -1.01 24.84 67.92 -0.58 21.86 68.53 0.23 22.39 69.48 0.81 22.71 67.44 -0.43 23.06 66.35 0.58 3 0 1000.00-999 ?-999 ?-999 ? mASP.A 95 20.54 68.38 0.11 20.26 67.58 -0.42 19.24 68.89 2.13 18.83 69.70 2.96 19.60 69.32 0.72 18.30 69.39 -0.10 2 0 1000.00-999 ?-999 ?-999 ? mLEU^A 96 19.38 67.59 2.40 19.76 67.05 1.65 19.77 65.74 3.95 19.91 64.90 3.06 19.01 67.03 3.69 17.50 66.70 3.69 3 0 1000.00-999 ?-999 ?-999 ? mVAL^A 97 20.25 65.60 5.18 20.09 66.39 5.77 20.24 63.91 6.87 20.17 64.64 7.86 20.94 64.39 5.60 22.45 64.64 5.94 3 0 1000.00-999 ?-999 ?-999 ? mLEU^A 98 19.70 62.70 6.81 19.79 62.23 5.93 19.96 61.13 8.59 20.40 60.17 7.93 19.02 62.13 7.96 17.72 61.45 7.55 3 0 1000.00-999 ?-999 ?-999 ? mVAL^A 99 20.25 61.35 9.86 19.77 62.14 10.25 20.43 59.72 11.69 19.77 60.31 12.56 21.16 60.51 10.62 22.23 61.40 11.30 3 0 1000.00-999 ?-999 ?-999 ? mGLU^A 100 20.56 58.40 11.64 21.11 58.06 10.87 20.99 57.15 13.67 21.95 56.43 13.37 19.94 57.54 12.63 19.37 56.29 11.95 2 0 1000.00-999 ?-999 ?-999 ? mGLY.A 101 20.83 57.63 14.90 20.03 58.21 15.04 22.75 58.47 16.25 22.41 59.63 16.02 21.79 57.32 15.95-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mTYR.A 102 23.94 58.14 16.76 24.07 57.16 16.89 24.34 60.17 18.06 24.58 61.38 17.95 24.96 59.15 17.10 25.45 59.86 15.84 3 0 1000.00-999 ?-999 ?-999 ? mLYS.A 103 23.55 59.66 19.01 23.51 58.66 19.01 23.61 61.57 20.70 23.02 62.54 21.18 22.82 60.50 19.97 22.08 59.62 20.99 2 0 1000.00-999 ?-999 ?-999 ? mGLN.A 104 24.93 61.42 20.79 25.30 60.59 20.37 25.96 63.65 20.55 26.31 64.73 21.03 25.73 62.44 21.47 27.09 61.87 21.92 2 0 1000.00-999 ?-999 ?-999 ? mGLU.A 105 25.76 63.49 19.25 25.47 62.57 18.96 24.88 65.65 18.60 23.82 65.31 19.13 25.97 64.62 18.34 25.96 64.16 16.87 2 0 1000.00-999 ?-999 ?-999 ? mARG.A 106 25.12 66.90 18.21 25.97 67.03 17.71 23.28 68.55 17.41 22.82 69.69 17.53 24.16 67.96 18.52 24.92 69.07 19.25 2 0 1000.00-999 ?-999 ?-999 ? mHIS.A 107 23.02 67.78 16.36 23.46 66.88 16.40 20.71 68.19 15.73 20.38 67.46 16.66 22.17 68.23 15.26 22.36 67.29 14.05 3 0 1000.00-999 ?-999 ?-999 ? mPRO.A 108 19.82 68.98 15.11 20.15 69.56 14.37 17.94 67.48 15.46 18.22 66.82 14.45 18.43 68.92 15.59 17.69 69.89 14.66 3 0 1000.00-999 ?-999 ?-999 ? mLYS^A 109 17.24 66.99 16.47 17.05 67.63 17.21 15.37 65.31 16.81 14.70 66.06 17.56 16.80 65.60 16.43 17.72 64.75 17.30 2 0 1000.00-999 ?-999 ?-999 ? mVAL^A 110 14.88 64.20 16.27 15.50 63.73 15.64 13.80 62.50 17.47 14.59 61.63 17.12 13.55 63.73 16.59 12.77 63.31 15.33 3 0 1000.00-999 ?-999 ?-999 ? mVAL^A 111 13.15 62.45 18.62 12.54 63.22 18.80 12.12 60.41 19.47 10.98 60.87 19.61 13.34 61.33 19.53 13.54 61.85 20.99 3 0 1000.00-999 ?-999 ?-999 ? mLEU^A 112 12.37 59.12 19.25 13.34 58.91 19.11 11.35 57.34 20.51 12.42 56.87 20.94 11.31 58.13 19.20 11.49 57.19 18.00 3 0 1000.00-999 ?-999 ?-999 ? mVAL^A 113 10.19 57.22 21.15 9.40 57.62 20.69 8.97 55.54 22.49 7.85 55.84 22.06 10.12 56.53 22.43 9.98 57.54 23.61 3 0 1000.00-999 ?-999 ?-999 ? mARG.A 114 9.24 54.36 23.04 10.19 54.25 23.34 7.47 53.52 24.50 6.32 53.09 24.65 8.21 53.33 23.19 8.85 51.94 23.20 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 115 8.11 54.21 25.44 8.99 54.59 25.15 8.08 55.56 27.53 9.01 56.24 27.09 7.54 54.36 26.77 7.89 53.11 27.57 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 116 7.50 55.79 28.70 6.76 55.17 28.94 9.37 56.56 29.99 10.20 57.46 30.11 7.94 56.88 29.56 7.01 56.99 30.78 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 117 9.66 55.28 30.17 8.89 54.66 30.03 12.05 55.19 29.49 13.16 55.63 29.83 11.00 54.83 30.56 11.01 53.32 30.81 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 118 11.72 54.97 28.22 10.81 54.56 28.08 12.89 56.84 27.19 14.02 57.30 27.03 12.64 55.33 27.14 12.03 55.05 25.75 2 0 1000.00-999 ?-999 ?-999 ? mTRP~A 119 11.82 57.60 27.37 10.96 57.09 27.48 12.74 59.58 28.55 13.45 60.58 28.41 11.90 59.06 27.40 10.49 59.67 27.48 3 0 1000.00-999 ?-999 ?-999 ? mALA~A 120 12.65 58.92 29.70 12.02 58.14 29.68 14.92 59.26 30.58 15.68 60.11 31.03 13.42 59.32 30.87 13.08 58.43 32.06 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 121 15.35 58.27 29.81 14.65 57.64 29.47 17.22 58.93 28.26 18.42 59.06 28.02 16.78 58.18 29.51 17.20 56.72 29.39 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 122 16.26 59.42 27.47 15.33 59.26 27.80 16.26 61.64 26.26 16.69 62.37 25.39 16.57 60.14 26.23 15.82 59.50 25.05 3 0 1000.00-999 ?-999 ?-999 ? mGLN~A 123 15.50 62.08 27.27 15.24 61.38 27.93 16.26 64.44 27.62 16.12 65.64 27.43 15.10 63.49 27.38 14.08 63.66 28.50 2 0 1000.00-999 ?-999 ?-999 ? mHIS.A 124 17.42 63.93 28.02 17.44 62.94 28.12 19.46 65.08 27.10 20.48 65.77 27.24 18.53 64.83 28.28 19.30 64.34 29.51 3 0 1000.00-999 ?-999 ?-999 ? mLEU.A 125 19.09 64.57 25.93 18.23 64.05 25.94 19.79 66.23 24.28 18.88 66.96 24.68 19.90 64.78 24.73 19.47 63.84 23.61 3 0 1000.00-999 ?-999 ?-999 ? mALA.A 126 20.73 66.62 23.42 21.38 65.91 23.16 19.97 68.25 21.66 19.83 67.39 20.78 20.78 67.98 22.92 22.24 68.39 22.67 2 0 1000.00-999 ?-999 ?-999 ? mASN.A 127 19.42 69.46 21.59 19.53 70.02 22.41 17.48 69.06 19.99 17.19 68.93 18.80 18.71 69.90 20.40 19.73 69.92 19.24 2 0 1000.00-999 ?-999 ?-999 ? mILE^A 128 16.76 68.50 20.95 17.11 68.64 21.88 14.49 68.67 20.07 14.17 69.66 20.70 15.56 67.72 20.63 14.97 67.02 21.89 3 0 1000.00-999 ?-999 ?-999 ? mARG^A 129 13.96 68.37 18.89 14.31 67.54 18.46 11.52 68.64 18.38 10.52 69.37 18.34 12.93 69.23 18.30 13.25 69.53 16.83 2 0 1000.00-999 ?-999 ?-999 ? mALA^A 130 11.42 67.32 18.48 12.30 66.84 18.51 10.29 65.26 19.04 11.40 64.71 19.00 10.12 66.66 18.54 9.46 66.63 17.15 2 0 1000.00-999 ?-999 ?-999 ? mVAL^A 131 9.19 64.70 19.52 8.39 65.30 19.48 7.98 62.64 19.33 6.91 63.22 19.12 9.12 63.35 20.04 8.78 63.33 21.56 3 0 1000.00-999 ?-999 ?-999 ? mILE^A 132 8.21 61.39 18.92 9.15 61.07 19.08 7.14 59.36 19.20 8.16 58.70 19.41 7.18 60.58 18.28 7.56 60.22 16.83 3 0 1000.00-999 ?-999 ?-999 ? mALA^A 133 5.96 59.07 19.75 5.19 59.63 19.44 4.76 56.98 20.54 3.81 57.20 19.79 5.86 57.99 20.73 5.71 58.62 22.12 2 0 1000.00-999 ?-999 ?-999 ? mTRP.A 134 4.89 55.86 21.27 5.72 55.85 21.83 2.72 55.14 22.13 1.61 54.67 21.92 3.91 54.78 21.23 4.49 53.49 21.81 3 0 1000.00-999 ?-999 ?-999 ? mGLU.A 135 3.00 55.94 23.16 3.95 56.22 23.20 2.27 57.75 24.63 3.35 58.28 24.39 1.98 56.34 24.13 1.98 55.39 25.33 2 0 1000.00-999 ?-999 ?-999 ? mPRO.A 136 1.31 58.38 25.33 0.47 57.85 25.45 2.55 59.74 26.96 2.75 58.72 27.62 1.49 59.74 25.85 0.10 60.11 26.36 3 0 1000.00-999 ?-999 ?-999 ? mLEU.A 137 3.21 60.88 27.17 2.93 61.64 26.59 3.85 61.79 29.41 3.03 62.69 29.31 4.26 60.96 28.18 5.53 61.56 27.56 3 0 1000.00-999 ?-999 ?-999 ? mGLU.A 138 4.44 61.47 30.56 5.09 60.71 30.49 4.95 63.46 31.95 5.91 63.69 31.22 4.13 62.19 31.79 4.41 61.31 33.01 2 0 1000.00-999 ?-999 ?-999 ? mGLY.A 139 4.55 64.27 32.93 3.75 63.95 33.44 5.18 66.55 32.13 4.51 66.36 31.12 5.26 65.51 33.22-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mPRO.A 140 5.87 67.69 32.32 6.38 67.74 33.18 6.71 68.33 30.12 7.60 67.50 30.26 5.86 68.75 31.31 6.46 69.94 32.04 3 0 1000.00-999 ?-999 ?-999 ? mLEU.A 141 6.43 68.89 28.95 5.67 69.54 28.97 7.41 69.84 26.95 6.45 70.51 26.57 7.20 68.56 27.75 6.46 67.51 26.91 3 0 1000.00-999 ?-999 ?-999 ? mALA.A 142 8.67 70.16 26.69 9.34 69.51 27.06 9.04 71.17 24.44 9.42 72.07 23.69 9.03 71.37 25.94 10.39 71.88 26.40 2 0 1000.00-999 ?-999 ?-999 ? mHIS.A 143 8.61 70.00 23.98 8.31 69.35 24.68 7.30 69.07 22.10 6.65 68.38 22.87 8.60 69.71 22.55 9.75 68.78 22.19 3 0 1000.00-999 ?-999 ?-999 ? mPRO.A 144 6.91 69.30 20.84 7.49 69.89 20.28 5.83 67.16 20.42 6.93 66.64 20.19 5.66 68.68 20.39 5.47 69.23 18.97 3 0 1000.00-999 ?-999 ?-999 ? mVAL^A 145 4.75 66.46 20.74 3.94 67.01 20.93 3.69 64.52 19.82 2.55 65.02 19.84 4.76 65.00 20.79 4.42 64.46 22.21 3 0 1000.00-999 ?-999 ?-999 ? mPHE^A 146 4.05 63.56 18.97 5.01 63.27 19.07 3.05 61.48 18.21 3.96 60.85 18.78 3.12 62.99 17.99 3.61 63.20 16.54 3 0 1000.00-999 ?-999 ?-999 ? mSER^A 147 1.98 60.88 17.74 1.30 61.50 17.34 2.59 58.93 16.57 2.58 59.56 15.50 1.84 59.44 17.80 0.36 59.04 17.67 2 0 1000.00-999 ?-999 ?-999 ? mLEU.A 148 3.26 57.79 16.72 3.21 57.41 17.65 3.03 56.87 14.44 3.43 56.84 13.26 3.98 57.16 15.61 4.62 55.85 16.11 3 0 1000.00-999 ?-999 ?-999 ? mALA.A 149 1.75 56.68 14.74 1.53 56.75 15.72 0.34 57.67 12.94 -0.22 57.60 11.85 0.76 56.41 13.70 -0.49 55.76 14.32 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 150 0.65 58.83 13.49 1.20 58.76 14.33 1.18 60.75 11.92 1.44 61.96 12.02 0.21 60.09 12.89 -0.16 61.02 14.04 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 151 1.72 59.98 10.97 1.43 59.03 10.98 2.04 61.59 9.09 2.74 62.45 8.57 2.68 60.54 10.01 3.35 59.44 9.16 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 152 0.73 61.51 8.88 0.27 60.74 9.34 0.25 63.88 8.64 0.06 64.90 7.98 0.06 62.50 8.04 -1.44 62.21 7.91 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 153 0.62 63.91 9.91 0.71 63.01 10.36 2.34 65.42 10.84 2.84 66.51 10.56 0.86 65.16 10.57 0.11 65.23 11.89 2 0 1000.00-999 ?-999 ?-999 ? mTYR~A 154 3.08 64.43 11.34 2.63 63.55 11.48 5.43 64.87 10.43 6.41 65.60 10.52 4.48 64.73 11.63 5.07 63.79 12.71 3 0 1000.00-999 ?-999 ?-999 ? mILE~A 155 5.13 64.23 9.31 4.29 63.68 9.35 5.90 65.77 7.56 6.92 66.43 7.37 5.99 64.35 8.13 5.61 63.29 7.06 3 0 1000.00-999 ?-999 ?-999 ? mPRO~A 156 4.68 66.28 7.30 3.89 65.69 7.48 5.23 68.63 7.81 5.89 69.61 7.45 4.62 67.65 6.78 3.11 67.88 6.57 3 0 1000.00-999 ?-999 ?-999 ? mTRP~A 157 5.04 68.35 9.09 4.50 67.53 9.27 7.15 69.24 10.03 7.80 70.31 10.06 5.61 69.22 10.12 5.18 68.75 11.51 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 158 7.72 68.05 9.93 7.09 67.27 9.92 9.71 68.57 8.57 10.70 69.31 8.62 9.18 67.93 9.85 9.62 66.46 9.93 3 0 1000.00-999 ?-999 ?-999 ? mMETA 159 9.06 68.32 7.44 8.27 67.71 7.53 9.52 70.43 6.30 10.45 71.11 5.84 9.51 68.90 6.18 8.58 68.45 5.04 2 0 1000.00-999 ?-999 ?-999 ? mASN~A 160 8.51 70.98 6.96 7.82 70.33 7.30 9.61 72.88 8.03 10.21 73.92 7.77 8.44 72.42 7.14 7.11 72.85 7.77 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 161 9.92 72.09 9.06 9.36 71.28 9.16 12.34 72.49 9.18 13.17 73.38 9.40 11.03 72.45 9.96 11.15 71.46 11.13 2 0 1000.00-999 ?-999 ?-999 ? mVAL~A 162 12.53 71.52 8.28 11.80 70.84 8.22 13.76 72.72 6.53 14.78 73.40 6.41 13.74 71.50 7.47 13.82 70.22 6.59 3 0 1000.00-999 ?-999 ?-999 ? mARG~A 163 12.65 72.99 5.86 11.89 72.36 6.05 12.82 75.47 5.57 13.55 76.30 5.02 12.57 74.11 4.93 11.22 74.14 4.22 2 0 1000.00-999 ?-999 ?-999 ? mTHR~A 164 12.23 75.70 6.73 11.65 74.95 7.06 13.82 76.92 8.06 14.09 77.57 9.07 12.42 76.96 7.43 11.32 77.17 8.49 2 0 1000.00-999 ?-999 ?-999 ? mARG.A 165 14.68 76.12 7.43 14.25 75.68 6.64 16.54 76.57 9.06 16.84 75.85 10.04 16.08 75.88 7.80 17.00 76.30 6.64 2 0 1000.00-999 ?-999 ?-999 ?