HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 07-FEB-05 1WY6 COMPND HYPOTHETICAL PROTEIN ST1625; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS TOKODAII; SOURCE 3 ORGANISM_TAXID: 111955; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: ROSETTA-GAMITM (DE3); SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET11A AUTHOR K.YONEDA,H.SAKURABA,H.TSUGE,N.KATUNUMA,S.KURAMITSU, AUTHOR 2 T.KAWABATA,T.OHSHIMA SSBOND 1 CYS A 48 CYS A 75 1555 1555 2.03 SSBOND 2 CYS A 56 CYS A 84 1555 1555 2.03 SSBOND 3 CYS A 153 CYS A 161 1555 1555 2.03 mGLU~A 7 5.75 51.82 -50.03 5.05 52.51 -50.21 7.07 50.67 -48.27 7.12 51.67 -47.56 6.79 50.79 -49.77 8.08 51.13 -50.52 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 8 7.26 49.44 -47.82 7.19 48.74 -48.53 8.73 49.89 -45.85 8.65 50.45 -44.76 7.53 49.13 -46.42 7.79 47.62 -46.24 3 0 1000.00-999 ?-999 ?-999 ? mILE~A 9 9.84 49.90 -46.59 9.77 49.42 -47.46 10.88 52.07 -45.98 11.48 52.69 -45.11 11.04 50.56 -46.10 12.26 50.26 -46.99 3 0 1000.00-999 ?-999 ?-999 ? mARG~A 10 10.06 52.66 -46.85 9.65 52.04 -47.53 9.04 54.38 -45.52 9.39 55.28 -44.76 9.82 54.09 -46.79 9.02 54.56 -48.01 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 11 7.99 53.61 -45.29 7.81 52.92 -46.00 8.03 53.59 -42.84 7.83 54.29 -41.85 7.18 53.77 -44.09 6.03 52.76 -44.10 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 12 8.99 52.67 -42.89 9.05 52.17 -43.76 10.81 53.61 -41.53 11.07 53.99 -40.39 9.88 52.42 -41.75 10.70 51.14 -41.96 3 0 1000.00-999 ?-999 ?-999 ? mMET~A 13 11.31 54.20 -42.61 11.03 53.79 -43.48 11.37 56.51 -41.93 11.90 57.38 -41.23 12.18 55.36 -42.50 12.76 55.76 -43.86 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 14 10.08 56.52 -42.24 9.78 55.76 -42.82 9.03 57.38 -40.24 9.06 58.35 -39.48 9.19 57.56 -41.74 7.83 57.46 -42.42 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 15 8.87 56.13 -39.82 8.86 55.45 -40.55 10.03 56.15 -37.70 10.02 56.73 -36.62 8.72 55.81 -38.41 8.39 54.32 -38.24 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 16 11.15 55.80 -38.33 11.01 55.36 -39.21 12.66 57.53 -37.39 13.03 57.85 -36.27 12.47 56.06 -37.75 13.57 55.62 -38.71 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 17 12.40 58.43 -38.34 12.10 58.04 -39.21 11.73 60.33 -36.88 12.24 61.08 -36.05 12.55 59.85 -38.09 12.18 60.65 -39.33 2 0 1000.00-999 ?-999 ?-999 ? mPHE~A 18 10.47 59.92 -36.80 10.17 59.34 -37.55 10.34 59.90 -34.37 10.54 60.72 -33.47 9.63 60.30 -35.66 8.28 59.56 -35.70 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 19 10.71 58.63 -34.28 10.49 58.08 -35.09 12.65 58.85 -32.74 12.82 59.25 -31.59 11.38 58.09 -33.10 11.70 56.60 -33.30 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 20 13.55 59.04 -33.71 13.30 58.65 -34.60 14.42 61.18 -32.90 15.16 61.74 -32.10 14.78 59.79 -33.44 15.61 59.96 -34.72 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 21 13.29 61.72 -33.34 12.77 61.15 -33.97 12.03 63.09 -31.63 11.61 64.17 -31.20 12.85 63.05 -32.91 12.04 63.72 -34.02 2 0 1000.00-999 ?-999 ?-999 ? mGLY.A 22 11.78 61.94 -31.02 12.15 61.12 -31.47 9.52 61.74 -29.96 8.79 61.74 -28.97 11.02 61.92 -29.79-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mTYR~A 23 9.06 61.64 -31.20 9.77 61.72 -31.90 7.43 59.92 -31.38 7.18 59.26 -32.38 7.64 61.43 -31.48 7.32 61.89 -32.90 3 0 1000.00-999 ?-999 ?-999 ? mILE~A 24 7.55 59.39 -30.16 7.73 60.05 -29.44 6.09 57.29 -30.38 6.11 56.29 -31.09 7.42 57.95 -29.93 7.65 57.61 -28.43 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 25 4.95 57.86 -29.99 5.06 58.68 -29.43 3.47 57.23 -31.86 3.00 56.23 -32.41 3.66 57.28 -30.35 2.50 58.10 -29.76 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 26 3.84 58.31 -32.53 4.20 59.05 -31.96 4.54 57.30 -34.65 4.01 56.51 -35.45 3.72 58.40 -33.97 4.19 59.78 -34.46 2 0 1000.00-999 ?-999 ?-999 ? mGLY~A 27 5.83 57.24 -34.34 6.14 57.92 -33.68 6.27 54.81 -34.60 6.37 53.92 -35.43 6.69 56.23 -34.94-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mVAL~A 28 5.80 54.58 -33.37 5.76 55.40 -32.79 4.11 52.79 -33.69 3.98 51.62 -34.06 5.37 53.24 -32.96 5.12 53.19 -31.43 3 0 1000.00-999 ?-999 ?-999 ? mLYS~A 29 3.20 53.73 -33.91 3.45 54.63 -33.56 2.31 52.92 -36.00 1.79 51.90 -36.44 1.96 53.44 -34.61 1.12 54.72 -34.71 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 30 3.21 53.63 -36.68 3.53 54.44 -36.20 4.30 51.83 -37.96 3.99 50.97 -38.78 3.67 53.23 -38.01 4.74 54.21 -38.55 3 0 1000.00-999 ?-999 ?-999 ? mVAL~A 31 5.18 51.62 -36.99 5.34 52.40 -36.39 4.85 49.17 -36.65 5.02 48.10 -37.22 5.85 50.32 -36.85 6.84 50.33 -35.66 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 32 3.82 49.40 -35.84 3.80 50.31 -35.43 2.00 48.08 -36.85 1.42 47.01 -36.97 2.82 48.37 -35.60 1.91 48.76 -34.44 3 0 1000.00-999 ?-999 ?-999 ? mGLU~A 33 1.93 49.05 -37.76 2.42 49.89 -37.52 1.98 47.83 -39.81 1.42 46.84 -40.26 1.21 48.86 -39.00 1.12 50.17 -39.80 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 34 3.28 48.08 -39.99 3.58 48.93 -39.56 4.13 45.79 -40.15 4.08 44.79 -40.88 4.16 47.20 -40.74 5.62 47.70 -40.69 3 0 1000.00-999 ?-999 ?-999 ? mTHR~A 35 4.15 45.73 -38.83 4.19 46.62 -38.38 2.89 43.63 -38.44 2.91 42.40 -38.35 4.12 44.47 -38.10 4.14 44.71 -36.57 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 36 1.81 44.30 -38.85 1.93 45.29 -38.89 0.54 43.13 -40.64 -0.04 42.09 -40.95 0.57 43.61 -39.19 -0.63 44.54 -38.97 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 37 1.18 43.89 -41.52 1.64 44.69 -41.13 2.32 42.68 -43.46 2.17 42.02 -44.48 1.19 43.57 -42.94 1.15 44.87 -43.76 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 38 3.46 42.67 -42.76 3.46 43.25 -41.95 5.04 40.86 -42.14 4.42 40.75 -41.08 4.59 41.86 -43.21 5.76 42.76 -43.60 2 0 1000.00-999 ?-999 ?-999 ? mTHR~A 39 6.12 40.13 -42.43 6.53 40.33 -43.32 7.96 39.55 -40.85 8.70 40.37 -41.39 6.64 39.14 -41.49 6.85 37.78 -42.18 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 40 8.23 38.97 -39.68 7.53 38.33 -39.38 10.70 39.30 -39.80 11.39 40.32 -39.84 9.45 39.23 -38.92 9.65 38.14 -37.87 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 41 10.98 38.19 -40.48 10.33 37.45 -40.32 12.06 39.03 -42.55 12.39 38.66 -43.68 12.14 38.07 -41.36 12.24 36.63 -41.88 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 42 11.63 40.25 -42.28 11.42 40.41 -41.32 11.62 42.68 -42.74 12.12 43.58 -43.42 11.48 41.27 -43.32 10.10 41.12 -43.99 2 0 1000.00-999 ?-999 ?-999 ? mTYR~A 43 11.19 42.88 -41.50 10.81 42.07 -41.06 12.15 44.16 -39.62 12.38 45.19 -38.99 11.29 44.19 -40.87 9.89 44.71 -40.51 3 0 1000.00-999 ?-999 ?-999 ? mASN~A 44 12.61 42.97 -39.25 12.36 42.23 -39.87 14.67 43.68 -38.00 15.04 44.18 -36.94 13.42 42.80 -38.05 13.84 41.34 -37.91 2 0 1000.00-999 ?-999 ?-999 ? mTRP~A 45 15.31 43.85 -39.15 14.88 43.37 -39.92 16.32 46.09 -38.81 17.27 46.76 -38.41 16.52 44.65 -39.29 16.94 44.72 -40.76 3 0 1000.00-999 ?-999 ?-999 ? mPHE~A 46 15.07 46.57 -38.88 14.40 45.92 -39.21 15.20 48.34 -37.09 15.76 49.41 -36.90 14.76 47.94 -38.49 13.27 48.21 -38.62 3 0 1000.00-999 ?-999 ?-999 ? mILE~A 47 14.94 47.48 -36.11 14.49 46.64 -36.40 16.79 47.97 -34.54 17.22 48.85 -33.79 15.29 47.79 -34.73 14.74 46.70 -33.76 3 0 1000.00-999 ?-999 ?-999 ? mCSS~A 48 17.59 47.15 -35.22 17.10 46.48 -35.78 19.48 48.58 -35.69 20.35 49.26 -35.14 19.05 47.23 -35.13 19.72 46.13 -35.96 2 0 1000.00-999 ?-999 ?-999 ? mASN~A 49 18.87 48.94 -36.81 18.20 48.28 -37.14 18.84 51.37 -36.61 19.65 52.28 -36.45 19.17 50.18 -37.51 18.37 50.21 -38.83 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 50 17.65 51.37 -36.00 17.08 50.57 -36.19 18.25 52.62 -33.95 18.75 53.72 -33.70 17.27 52.47 -35.11 15.86 52.25 -34.54 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 51 18.51 51.52 -33.25 18.05 50.70 -33.60 20.80 52.08 -32.35 21.46 52.57 -31.43 19.40 51.52 -32.09 19.50 50.10 -31.51 3 0 1000.00-999 ?-999 ?-999 ? mGLU~A 52 21.24 52.03 -33.60 20.60 51.62 -34.25 22.68 54.05 -33.75 23.76 54.56 -33.43 22.55 52.54 -33.97 22.84 52.20 -35.44 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 53 21.58 54.78 -33.92 20.75 54.26 -34.13 20.60 56.89 -32.89 20.72 58.09 -32.61 21.64 56.22 -33.78 21.60 56.87 -35.17 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 54 19.60 56.16 -32.42 19.60 55.19 -32.68 19.17 57.37 -30.30 19.97 56.74 -29.60 18.59 56.80 -31.59 17.42 55.84 -31.23 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 55 18.77 58.60 -30.00 18.14 59.00 -30.67 18.89 58.45 -27.56 17.80 57.88 -27.44 19.20 59.30 -28.80 18.48 60.65 -28.70 2 0 1000.00-999 ?-999 ?-999 ? mCSS~A 56 19.84 58.38 -26.64 20.67 58.89 -26.85 18.44 58.07 -24.60 17.92 57.34 -23.75 19.64 57.60 -25.42 20.92 57.64 -24.56 2 0 1000.00-999 ?-999 ?-999 ? mARG~A 57 17.99 59.30 -24.85 18.51 59.79 -25.55 15.56 59.09 -24.52 14.60 59.10 -23.76 16.83 59.84 -24.15 16.60 61.31 -24.52 2 0 1000.00-999 ?-999 ?-999 ? mTYR~A 58 15.55 58.45 -25.69 16.41 58.50 -26.20 14.47 56.23 -26.35 13.47 55.52 -26.30 14.35 57.74 -26.18 13.92 58.31 -27.54 3 0 1000.00-999 ?-999 ?-999 ? mMET~A 59 15.69 55.75 -26.58 16.41 56.44 -26.58 15.07 53.38 -25.99 14.38 52.52 -26.54 15.93 54.33 -26.82 17.40 53.99 -26.61 2 0 1000.00-999 ?-999 ?-999 ? mPHE~A 60 15.10 53.52 -24.67 15.66 54.28 -24.34 12.82 52.76 -23.92 12.11 51.77 -23.78 14.34 52.62 -23.82 14.83 52.77 -22.38 3 0 1000.00-999 ?-999 ?-999 ? mGLN~A 61 12.32 53.97 -24.18 13.01 54.69 -24.24 10.43 53.40 -25.58 9.36 52.80 -25.61 10.88 54.17 -24.34 10.56 55.66 -24.56 2 0 1000.00-999 ?-999 ?-999 ? mVAL~A 62 11.26 53.45 -26.62 12.09 54.00 -26.47 10.98 51.24 -27.62 10.03 50.56 -27.99 10.97 52.75 -27.86 12.00 53.06 -28.95 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 63 12.04 50.74 -26.99 12.73 51.42 -26.74 11.02 48.77 -25.86 10.56 47.66 -26.08 12.17 49.32 -26.71 13.51 49.02 -26.03 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 64 10.58 49.56 -24.88 11.07 50.43 -24.80 8.20 48.95 -24.82 7.37 48.11 -24.49 9.48 49.16 -24.00 9.20 50.26 -22.97 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 65 8.04 49.71 -25.89 8.79 50.34 -26.08 6.90 48.58 -27.82 5.96 47.82 -28.02 6.83 49.60 -26.69 6.46 50.96 -27.27 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 66 8.02 48.54 -28.52 8.75 49.16 -28.21 9.27 46.62 -29.65 9.41 45.84 -30.59 8.13 47.64 -29.66 8.21 48.46 -30.95 3 0 1000.00-999 ?-999 ?-999 ? mGLY~A 67 10.07 46.60 -28.60 9.85 47.27 -27.88 10.74 44.22 -28.79 11.40 43.48 -29.52 11.17 45.66 -28.54-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mSER~A 68 9.63 43.83 -28.18 9.18 44.55 -27.65 8.78 41.98 -29.70 8.67 40.78 -29.92 9.10 42.47 -28.29 7.86 42.32 -27.40 2 0 1000.00-999 ?-999 ?-999 ? mTYR~A 69 8.62 42.90 -30.65 8.73 43.85 -30.34 9.54 42.12 -32.85 9.41 41.67 -33.99 8.31 42.51 -32.03 7.59 43.64 -32.78 3 0 1000.00-999 ?-999 ?-999 ? mPHE~A 70 10.72 42.30 -32.27 10.69 42.65 -31.33 12.82 40.96 -32.28 12.62 40.65 -31.10 11.96 41.99 -32.98 12.80 43.27 -33.14 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 71 13.77 40.40 -33.02 13.77 40.70 -33.98 16.00 40.27 -32.30 16.77 40.43 -33.25 14.73 39.45 -32.47 15.00 38.30 -33.44 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 72 16.21 40.82 -31.10 15.50 40.62 -30.43 18.69 40.87 -30.99 19.72 41.46 -31.31 17.38 41.64 -30.83 17.30 42.22 -29.42 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 73 18.64 39.56 -30.77 17.73 39.21 -30.53 20.39 38.74 -32.30 21.52 38.33 -32.52 19.82 38.72 -30.88 19.51 37.28 -30.45 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 74 19.59 39.20 -33.26 18.68 39.49 -32.96 20.86 40.55 -34.88 21.56 40.67 -35.88 20.06 39.27 -34.63 18.88 39.16 -35.59 2 0 1000.00-999 ?-999 ?-999 ? mCSS~A 75 20.76 41.49 -33.93 20.16 41.24 -33.17 22.93 42.57 -33.62 23.23 41.89 -32.64 21.48 42.75 -34.03 20.82 43.81 -33.13 2 0 1000.00-999 ?-999 ?-999 ? mGLN.A 76 23.84 43.19 -34.38 23.44 43.72 -35.13 25.80 44.35 -33.40 26.96 44.39 -32.98 25.27 43.11 -34.12 26.03 42.94 -35.44 2 0 1000.00-999 ?-999 ?-999 ? mASN.A 77 24.95 45.36 -33.28 24.04 45.17 -33.66 24.68 46.82 -31.25 24.41 47.96 -30.85 25.31 46.63 -32.63 24.90 47.81 -33.53 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 78 24.45 45.73 -30.52 24.73 44.86 -30.95 24.70 46.57 -28.18 24.26 46.82 -27.06 23.85 45.83 -29.21 23.42 44.46 -28.68 3 0 1000.00-999 ?-999 ?-999 ? mLYS~A 79 25.92 46.94 -28.57 26.19 46.66 -29.49 26.06 49.08 -27.50 26.25 49.77 -26.50 26.75 47.71 -27.66 28.15 47.91 -28.23 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 80 25.26 49.45 -28.50 25.21 48.78 -29.25 23.53 50.76 -27.32 23.27 51.82 -26.74 24.52 50.72 -28.48 23.74 50.89 -29.80 2 0 1000.00-999 ?-999 ?-999 ? mVAL~A 81 22.96 49.61 -26.99 23.25 48.83 -27.53 22.69 49.69 -24.55 22.21 50.38 -23.66 22.00 49.55 -25.90 21.18 48.22 -25.94 3 0 1000.00-999 ?-999 ?-999 ? mVAL~A 82 23.84 49.03 -24.40 24.11 48.49 -25.19 25.10 50.55 -22.97 25.10 51.07 -21.85 24.60 49.11 -23.16 25.82 48.18 -23.20 3 0 1000.00-999 ?-999 ?-999 ? mGLU~A 83 25.52 51.17 -24.07 25.47 50.61 -24.90 24.96 53.49 -23.49 25.28 54.41 -22.74 26.00 52.55 -24.06 26.36 53.02 -25.47 2 0 1000.00-999 ?-999 ?-999 ? mCSS~A 84 23.69 53.29 -23.86 23.55 52.54 -24.51 22.42 53.83 -21.85 21.98 54.68 -21.09 22.63 54.14 -23.33 21.34 53.94 -24.12 2 0 1000.00-999 ?-999 ?-999 ? mGLY~A 85 22.73 52.61 -21.45 23.04 51.98 -22.17 23.64 53.08 -19.29 23.34 53.67 -18.25 22.60 52.27 -20.05-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mVAL~A 86 24.86 53.13 -19.82 24.96 52.61 -20.67 25.71 55.40 -19.24 25.91 56.09 -18.24 25.94 53.89 -19.19 27.31 53.56 -19.84 3 0 1000.00-999 ?-999 ?-999 ? mILE~A 87 25.30 55.92 -20.39 25.18 55.26 -21.13 23.93 57.77 -19.59 24.02 58.78 -18.90 25.06 57.35 -20.52 24.68 57.74 -21.97 3 0 1000.00-999 ?-999 ?-999 ? mASN~A 88 22.87 56.97 -19.56 22.93 56.18 -20.18 22.04 56.74 -17.28 21.20 56.81 -16.40 21.74 57.23 -18.70 20.49 56.51 -19.25 2 0 1000.00-999 ?-999 ?-999 ? mASN.A 89 23.26 56.23 -17.08 23.85 56.26 -17.89 22.55 54.88 -15.20 22.26 54.96 -14.01 23.68 55.70 -15.79 24.05 56.82 -14.82 2 0 1000.00-999 ?-999 ?-999 ? mTHR.A 90 21.89 54.11 -16.05 22.22 54.14 -16.99 20.85 51.88 -16.15 21.16 51.66 -17.32 20.77 53.30 -15.61 19.42 53.93 -16.05 2 0 1000.00-999 ?-999 ?-999 ? mLEU.A 91 20.57 50.92 -15.28 20.36 51.25 -14.36 19.10 49.13 -15.75 18.28 49.56 -14.94 20.57 49.52 -15.64 21.26 48.71 -14.55 3 0 1000.00-999 ?-999 ?-999 ? mASN~A 92 18.76 48.33 -16.76 19.52 48.08 -17.36 17.39 46.58 -17.74 18.44 46.12 -18.17 17.38 47.89 -16.96 16.58 48.94 -17.72 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 93 16.21 45.98 -17.93 15.43 46.48 -17.56 16.69 44.74 -20.05 17.22 43.73 -20.51 16.12 44.71 -18.63 14.66 44.23 -18.67 2 0 1000.00-999 ?-999 ?-999 ? mHIS~A 94 16.56 45.87 -20.73 16.09 46.61 -20.24 18.59 45.92 -22.04 19.20 45.18 -22.81 17.08 46.01 -22.08 16.65 47.35 -22.71 3 0 1000.00-999 ?-999 ?-999 ? mVAL~A 95 19.20 46.68 -21.13 18.59 47.24 -20.57 21.16 45.27 -20.66 22.12 44.80 -21.26 20.65 46.66 -20.99 21.14 47.62 -19.88 3 0 1000.00-999 ?-999 ?-999 ? mASN~A 96 20.53 44.60 -19.69 19.76 45.09 -19.28 20.85 42.27 -20.45 21.79 41.53 -20.72 20.96 43.26 -19.30 20.17 42.76 -18.09 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 97 19.70 42.25 -21.12 19.01 42.89 -20.80 20.58 41.58 -23.32 21.11 40.64 -23.90 19.52 41.33 -22.25 18.13 41.48 -22.86 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 98 20.90 42.85 -23.57 20.38 43.51 -23.02 23.28 42.68 -24.13 24.06 42.21 -24.96 21.92 43.24 -24.56 22.00 44.74 -24.68 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 99 23.55 42.75 -22.83 22.84 43.19 -22.28 24.86 40.72 -22.50 25.86 40.20 -22.99 24.80 42.23 -22.29 24.90 42.53 -20.79 3 0 1000.00-999 ?-999 ?-999 ? mASP~A 100 23.78 40.01 -22.14 23.03 40.56 -21.76 23.93 38.17 -23.74 24.66 37.22 -24.03 23.74 38.57 -22.29 22.41 38.00 -21.76 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 101 23.29 38.91 -24.65 22.73 39.64 -24.28 24.87 38.90 -26.55 25.41 38.15 -27.36 23.44 38.62 -26.08 22.43 39.43 -26.92 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 102 25.48 39.97 -26.04 24.93 40.51 -25.41 27.78 39.14 -26.00 28.66 38.74 -26.75 26.85 40.28 -26.43 27.32 41.59 -25.80 3 0 1000.00-999 ?-999 ?-999 ? mVAL~A 103 27.57 38.61 -24.80 26.83 39.02 -24.28 28.22 36.28 -25.21 29.19 35.63 -25.61 28.39 37.50 -24.31 28.00 37.08 -22.87 3 0 1000.00-999 ?-999 ?-999 ? mILE~A 104 26.96 35.98 -25.52 26.29 36.61 -25.14 27.07 34.96 -27.78 27.26 33.96 -28.48 26.59 34.83 -26.35 25.05 34.66 -26.33 3 0 1000.00-999 ?-999 ?-999 ? mGLN~A 105 27.27 36.19 -28.23 27.05 36.91 -27.57 29.28 36.39 -29.54 29.94 36.40 -30.58 27.75 36.45 -29.58 27.29 37.82 -30.06 2 0 1000.00-999 ?-999 ?-999 ? mGLY.A 106 29.82 36.33 -28.33 29.16 36.32 -27.57 31.92 37.60 -28.50 33.08 37.62 -28.91 31.26 36.28 -28.15-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mLYS~A 107 31.18 38.69 -28.35 30.25 38.53 -28.01 32.46 40.60 -27.47 32.06 41.61 -26.88 31.71 40.01 -28.66 30.59 40.96 -29.10 2 0 1000.00-999 ?-999 ?-999 ? mARG~A 108 33.56 39.93 -27.13 33.73 39.14 -27.72 34.97 41.70 -26.24 35.16 42.46 -25.29 34.43 40.30 -26.03 35.58 39.30 -25.94 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 109 35.23 42.03 -27.50 35.03 41.30 -28.16 34.83 44.46 -27.44 35.28 45.44 -26.86 35.76 43.33 -27.88 35.98 43.38 -29.40 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 110 33.53 44.32 -27.73 33.31 43.47 -28.20 32.45 45.46 -25.83 32.45 46.57 -25.29 32.55 45.33 -27.35 31.18 44.98 -27.95 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 111 32.39 44.33 -25.13 32.39 43.50 -25.69 33.55 45.02 -23.04 33.42 45.72 -22.03 32.33 44.33 -23.67 32.21 42.90 -23.14 3 0 1000.00-999 ?-999 ?-999 ? mGLU~A 112 34.73 44.82 -23.62 34.70 44.22 -24.42 35.94 46.95 -23.32 36.39 47.72 -22.46 35.95 45.44 -23.10 37.20 44.85 -23.75 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 113 35.44 47.38 -24.48 35.16 46.65 -25.10 34.46 49.47 -23.71 34.82 50.51 -23.15 35.33 48.80 -24.78 34.73 48.98 -26.17 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 114 33.31 48.88 -23.41 33.12 48.05 -23.94 33.18 49.46 -21.04 33.11 50.43 -20.29 32.42 49.42 -22.38 31.17 48.54 -22.19 3 0 1000.00-999 ?-999 ?-999 ? mGLY~A 115 33.91 48.38 -20.76 33.89 47.66 -21.45 35.65 49.44 -19.33 35.74 50.01 -18.25 34.67 48.30 -19.53-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mARG~A 116 36.41 49.76 -20.38 36.24 49.22 -21.20 36.70 52.19 -20.15 37.11 53.03 -19.35 37.40 50.84 -20.31 38.26 50.86 -21.57 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 117 35.65 52.37 -20.94 35.46 51.59 -21.54 34.30 53.96 -19.57 34.31 55.13 -19.18 34.86 53.59 -20.95 33.73 53.43 -21.95 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 118 33.81 52.97 -18.83 33.86 52.06 -19.24 34.34 53.53 -16.46 34.05 54.07 -15.39 33.25 53.26 -17.51 32.32 52.13 -17.02 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 119 35.58 53.18 -16.78 35.67 52.76 -17.68 37.46 54.67 -16.24 37.47 55.65 -15.48 36.69 53.41 -15.87 37.63 52.21 -15.87 3 0 1000.00-999 ?-999 ?-999 ? mASN.A 122 35.15 57.73 -14.23 35.74 58.36 -14.74 33.15 57.57 -12.83 33.35 58.28 -11.84 34.30 56.81 -13.49 35.12 56.06 -12.43 2 0 1000.00-999 ?-999 ?-999 ? mGLU.A 123 31.95 57.43 -13.39 31.93 56.82 -14.18 29.58 57.19 -12.73 28.59 57.51 -12.07 30.78 58.12 -12.87 30.41 59.29 -13.80 2 0 1000.00-999 ?-999 ?-999 ? mVAL.A 124 29.68 56.02 -13.36 30.54 55.89 -13.85 28.40 54.48 -11.92 29.32 54.47 -11.10 28.61 55.03 -13.32 28.91 53.85 -14.27 3 0 1000.00-999 ?-999 ?-999 ? mSER~A 125 27.18 54.03 -11.64 26.53 54.10 -12.40 27.49 52.11 -10.15 28.00 51.52 -11.10 26.84 53.47 -10.34 25.32 53.33 -10.21 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 126 27.46 51.60 -8.93 27.01 52.18 -8.25 27.37 49.18 -9.39 28.02 48.24 -9.85 28.05 50.31 -8.62 27.97 50.05 -7.11 2 0 1000.00-999 ?-999 ?-999 ? mSER~A 127 26.05 49.26 -9.52 25.64 50.08 -9.11 25.80 48.02 -11.65 26.01 46.89 -12.09 25.29 48.23 -10.23 23.80 48.59 -10.25 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 128 25.99 49.12 -12.36 25.77 49.97 -11.89 27.89 48.44 -13.76 28.17 47.56 -14.58 26.48 49.06 -13.73 26.44 50.47 -14.37 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 129 28.77 48.88 -12.86 28.43 49.60 -12.25 30.02 46.81 -12.58 30.77 46.03 -13.17 30.12 48.32 -12.79 30.91 48.93 -11.64 3 0 1000.00-999 ?-999 ?-999 ? mVAL~A 130 29.09 46.40 -11.72 28.55 47.13 -11.31 28.38 44.21 -12.65 28.85 43.10 -12.93 28.91 44.98 -11.44 27.94 44.77 -10.25 3 0 1000.00-999 ?-999 ?-999 ? mALA~A 131 27.42 44.79 -13.35 27.13 45.68 -13.01 27.92 43.88 -15.58 28.07 42.75 -16.02 26.83 44.15 -14.53 25.73 45.04 -15.12 2 0 1000.00-999 ?-999 ?-999 ? mILE~A 132 28.67 44.91 -15.95 28.45 45.77 -15.50 30.87 43.83 -16.48 31.42 43.05 -17.26 29.74 44.76 -16.95 30.36 46.13 -17.35 3 0 1000.00-999 ?-999 ?-999 ? mALA~A 133 31.23 43.92 -15.20 30.71 44.61 -14.67 31.95 41.61 -14.81 32.78 40.82 -15.27 32.28 43.09 -14.64 32.47 43.40 -13.15 2 0 1000.00-999 ?-999 ?-999 ? mASN~A 134 30.74 41.25 -14.42 30.18 41.99 -14.06 30.12 39.41 -15.96 30.33 38.23 -16.27 30.29 39.87 -14.51 29.00 39.72 -13.70 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 135 29.75 40.32 -16.86 29.59 41.24 -16.50 31.04 39.71 -18.81 31.29 38.76 -19.55 29.62 39.95 -18.27 28.94 41.06 -19.05 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 136 31.96 40.58 -18.41 31.64 41.31 -17.81 33.94 39.12 -18.40 34.56 38.41 -19.19 33.34 40.45 -18.86 34.19 41.61 -18.32 3 0 1000.00-999 ?-999 ?-999 ? mARG~A 137 33.74 38.78 -17.14 33.20 39.43 -16.60 33.74 36.38 -17.45 34.42 35.36 -17.62 34.27 37.54 -16.61 33.89 37.40 -15.14 2 0 1000.00-999 ?-999 ?-999 ? mARG~A 138 32.53 36.53 -18.00 32.09 37.41 -17.78 32.61 35.35 -20.19 32.42 34.34 -20.86 31.92 35.50 -18.83 30.43 35.78 -19.05 2 0 1000.00-999 ?-999 ?-999 ? mVAL~A 139 33.38 36.35 -20.61 33.42 37.14 -19.99 35.59 36.03 -21.69 36.37 36.10 -22.65 34.09 36.27 -21.89 33.89 37.54 -22.79 3 0 1000.00-999 ?-999 ?-999 ? mGLY.A 140 35.99 35.75 -20.45 35.26 35.75 -19.77 38.26 36.64 -19.75 39.49 36.50 -19.67 37.38 35.47 -20.16-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mASP~A 141 37.65 37.79 -19.48 36.65 37.76 -19.57 38.36 39.21 -17.58 37.71 40.14 -17.10 38.39 38.98 -19.09 37.83 40.21 -19.79 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 142 39.07 38.36 -16.83 39.55 37.66 -17.36 39.81 39.75 -14.88 39.37 40.34 -13.89 39.13 38.47 -15.38 39.85 37.26 -14.77 2 0 1000.00-999 ?-999 ?-999 ? mARG~A 143 40.86 40.18 -15.57 41.11 39.61 -16.35 40.69 42.62 -15.11 40.68 43.32 -14.10 41.59 41.39 -15.18 42.73 41.68 -16.16 2 0 1000.00-999 ?-999 ?-999 ? mASP~A 144 39.95 42.89 -16.18 40.06 42.26 -16.94 37.87 43.78 -15.30 37.37 44.68 -14.62 39.07 44.05 -16.18 38.62 44.39 -17.60 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 145 37.40 42.54 -15.30 37.89 41.90 -15.90 36.56 42.56 -13.02 35.76 43.22 -12.36 36.26 42.18 -14.48 35.99 40.69 -14.59 2 0 1000.00-999 ?-999 ?-999 ? mTHR~A 146 37.74 42.14 -12.55 38.28 41.63 -13.21 38.34 43.91 -10.93 37.87 44.43 -9.92 38.18 42.41 -11.18 39.54 41.72 -10.89 2 0 1000.00-999 ?-999 ?-999 ? mTHR~A 147 39.00 44.59 -11.85 39.33 44.04 -12.61 37.89 46.73 -11.44 37.84 47.65 -10.62 39.21 46.02 -11.72 39.84 46.59 -13.00 2 0 1000.00-999 ?-999 ?-999 ? mLEU~A 148 36.84 46.31 -12.13 37.04 45.55 -12.76 34.88 46.56 -10.64 34.34 47.43 -9.96 35.51 46.89 -11.98 34.59 46.44 -13.13 3 0 1000.00-999 ?-999 ?-999 ? mLEU~A 149 34.93 45.28 -10.24 35.37 44.66 -10.89 35.10 45.59 -7.83 34.51 45.87 -6.79 34.37 44.88 -8.96 34.47 43.36 -8.77 3 0 1000.00-999 ?-999 ?-999 ? mILE~A 150 36.38 45.87 -8.03 36.75 45.56 -8.90 36.60 47.99 -6.91 36.40 48.51 -5.81 37.16 46.58 -7.02 38.67 46.62 -7.39 3 0 1000.00-999 ?-999 ?-999 ? mGLU~A 151 36.34 48.62 -8.06 36.56 48.09 -8.88 34.38 49.98 -7.48 34.01 50.92 -6.78 35.78 49.96 -8.09 35.73 50.50 -9.52 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 152 33.59 48.94 -7.75 34.01 48.25 -8.34 32.29 48.71 -5.68 31.45 49.25 -4.96 32.24 48.85 -7.20 31.51 47.64 -7.80 2 0 1000.00-999 ?-999 ?-999 ? mCSS~A 153 33.28 47.97 -5.20 33.88 47.57 -5.89 33.79 49.15 -3.17 33.26 49.54 -2.12 33.47 47.78 -3.76 34.61 46.77 -3.52 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 154 34.65 49.89 -3.86 35.01 49.45 -4.68 33.81 52.14 -3.35 33.70 52.97 -2.45 35.03 51.23 -3.42 36.06 51.82 -4.39 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 155 32.90 51.99 -4.31 33.12 51.28 -4.99 30.68 52.34 -3.30 29.59 52.90 -3.20 31.68 52.79 -4.35 31.02 52.72 -5.73 2 0 1000.00-999 ?-999 ?-999 ? mGLY.A 156 31.05 51.31 -2.53 31.94 50.92 -2.74 29.32 49.60 -1.78 28.42 49.28 -1.01 30.17 50.82 -1.48-999.99-999.99-999.99 1 0 1000.00-999 ?-999 ?-999 ? mGLU~A 157 29.59 48.91 -2.89 30.35 49.27 -3.43 29.26 46.51 -2.43 30.32 45.95 -2.68 28.80 47.73 -3.24 28.91 47.44 -4.74 2 0 1000.00-999 ?-999 ?-999 ? mLYS~A 158 28.43 46.12 -1.47 27.60 46.67 -1.41 29.13 43.68 -1.24 30.24 43.19 -1.01 28.70 44.99 -0.58 27.48 44.69 0.28 2 0 1000.00-999 ?-999 ?-999 ? mGLU~A 159 28.22 43.09 -2.02 27.35 43.59 -2.10 29.76 41.90 -3.52 30.48 40.92 -3.65 28.49 41.82 -2.67 27.30 41.40 -3.54 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 160 30.03 43.08 -4.08 29.36 43.80 -3.89 32.46 43.16 -4.02 33.47 42.57 -4.42 31.22 43.28 -4.91 31.17 44.65 -5.57 2 0 1000.00-999 ?-999 ?-999 ? mCSS~A 161 32.38 43.74 -2.82 31.52 44.21 -2.64 33.68 42.21 -1.47 34.81 41.73 -1.39 33.48 43.67 -1.87 33.18 44.51 -0.62 2 0 1000.00-999 ?-999 ?-999 ? mASN~A 162 32.59 41.49 -1.20 31.73 41.99 -1.29 33.33 39.26 -1.95 34.07 38.31 -1.69 32.72 40.09 -0.82 31.38 39.50 -0.42 2 0 1000.00-999 ?-999 ?-999 ? mALA~A 163 33.03 39.62 -3.19 32.42 40.40 -3.26 35.08 39.21 -4.49 35.88 38.34 -4.79 33.58 38.89 -4.33 32.83 39.26 -5.61 2 0 1000.00-999 ?-999 ?-999 ? mVAL~A 164 35.44 40.47 -4.29 34.69 41.10 -4.07 37.66 40.13 -3.33 38.79 39.71 -3.58 36.84 40.87 -4.39 37.00 42.39 -4.19 3 0 1000.00-999 ?-999 ?-999 ? mASN~A 165 37.08 39.94 -2.15 36.15 40.31 -2.07 38.04 37.79 -1.36 38.98 37.21 -0.81 37.79 39.26 -1.08 37.05 39.41 0.24 2 0 1000.00-999 ?-999 ?-999 ? mTHR~A 166 37.23 37.18 -2.22 36.52 37.77 -2.61 38.46 35.52 -3.60 38.79 34.37 -3.91 37.39 35.77 -2.54 36.08 35.15 -3.03 2 0 1000.00-999 ?-999 ?-999 ? mLEU.A 167 39.00 36.60 -4.16 38.66 37.47 -3.82 41.34 37.06 -4.81 41.45 37.56 -3.67 40.01 36.45 -5.21 39.50 37.06 -6.53 3 0 1000.00-999 ?-999 ?-999 ?