HEADER UNKNOWN FUNCTION 13-DEC-99 1DM5 COMPND ANNEXIN XII E105K MUTANT HOMOHEXAMER; COMPND 3 CHAIN: A, B, C, D, E, F; COMPND 4 ENGINEERED: YES; COMPND 5 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HYDRA VULGARIS; SOURCE 3 ORGANISM_TAXID: 6087; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 7 EXPRESSION_SYSTEM_VECTOR: PSE420 AUTHOR J.P.CARTAILLER,H.T.HAIGLER,H.LUECKE HET CA A1121 1 HET CA B1122 1 HET CA C1123 1 HET CA D1124 1 HET CA E1125 1 HET CA F1126 1 HET CA A1131 1 HET CA B1132 1 HET CA C1133 1 HET CA D1134 1 HET CA E1135 1 SITE 1 AC1 5 MET A 98 GLY A 102 THR A 103 GLU A 142 SITE 1 AC2 4 MET B 98 GLY B 100 GLY B 102 GLU B 142 SITE 1 AC3 6 MET C 98 LYS C 99 GLY C 100 GLY C 102 SITE 1 AC4 4 MET D 98 LYS D 99 GLY D 100 GLY D 102 SITE 1 AC5 4 MET E 98 LYS E 99 GLY E 100 HOH E1213 SITE 1 AC6 5 MET F 98 GLY F 100 LEU F 101 GLY F 102 SITE 1 AC7 7 GLY A 181 GLN A 184 ILE A 185 GLY A 186 SITE 1 AC8 5 GLY B 181 GLN B 184 ILE B 185 GLY B 186 SITE 1 AC9 5 GLY C 181 GLN C 184 ILE C 185 GLY C 186 SITE 1 BC1 6 GLY D 181 GLN D 184 ILE D 185 GLY D 186 SITE 1 BC2 5 GLY E 181 GLN E 184 ILE E 185 GLY E 186 mVAL.A 2 116.21 57.20 121.71 116.69 56.65 122.40 114.01 57.88 120.87 113.48 56.79 121.04 115.52 58.00 120.71 115.88 57.57 119.28 3 0 35.08-999 ?-999 ?-999 ? CA CA E1125 mVAL.A 3 113.29 59.01 120.79 113.81 59.86 120.71 111.23 59.22 119.49 111.54 60.22 118.84 111.83 58.90 120.85 111.19 59.74 121.95 3 0 31.42-999 ?-999 ?-999 ? CA CA E1125 mGLN.A 4 110.37 58.34 118.98 110.13 57.55 119.53 108.58 57.85 117.35 108.28 56.88 118.03 109.85 58.63 117.64 110.91 58.28 116.59 2 0 28.95-999 ?-999 ?-999 ? CA CA E1125 mGLY.A 5 107.87 58.31 116.33 108.27 59.12 115.89 106.90 56.62 114.85 108.05 56.21 114.66 106.63 57.71 115.87-999.99-999.99-999.99 1 0 25.83-999 ?-999 ?-999 ? CA CA E1125 mTHR.A 6 105.84 56.15 114.21 104.97 56.58 114.43 105.61 55.53 111.86 106.01 55.00 110.83 106.01 55.06 113.25 105.16 53.85 113.66 2 0 25.94-999 ?-999 ?-999 ? CA CA E1125 mVAL.A 7 104.79 56.59 111.84 104.51 56.95 112.73 105.45 58.15 110.13 105.87 58.97 110.95 104.39 57.14 110.55 103.01 57.83 110.58 3 0 23.92-999 ?-999 ?-999 ? CA CA E1125 mLYS.A 8 105.91 58.03 108.89 105.54 57.30 108.32 106.51 59.67 107.19 105.78 59.09 106.39 106.93 59.01 108.49 108.32 58.39 108.39 2 0 26.23-999 ?-999 ?-999 ? CA CA E1125 mPRO.A 9 106.96 60.90 107.03 107.52 61.25 107.78 106.98 60.86 104.58 108.02 60.21 104.58 106.62 61.67 105.82 107.50 62.90 105.94 3 0 26.21-999 ?-999 ?-999 ? CA CA E1125 mHIS.A 10 106.12 60.90 103.57 105.29 61.42 103.77 107.27 61.07 101.42 107.06 62.27 101.24 106.35 60.23 102.30 105.04 59.95 101.57 3 0 27.38-999 ?-999 ?-999 ? CA CA E1125 mALA.A 11 108.28 60.42 100.86 108.31 59.44 101.07 108.68 61.32 98.62 107.74 60.63 98.22 109.26 61.10 100.01 110.56 60.33 99.99 2 0 30.85-999 ?-999 ?-999 ? CA CA E1125 mSER.A 12 109.20 62.32 97.90 109.99 62.75 98.34 107.16 62.95 96.69 106.36 62.54 95.85 108.67 62.72 96.61 109.00 61.72 95.52 2 0 31.88-999 ?-999 ?-999 ? CA CA E1125 mPHE.A 13 106.76 63.65 97.75 107.51 63.92 98.36 104.79 64.94 96.98 105.29 66.03 96.72 105.38 63.99 98.02 105.29 64.67 99.40 3 0 28.32-999 ?-999 ?-999 ? CA CA E1125 mASN~A 14 103.69 64.51 96.38 103.44 63.57 96.62 101.43 65.27 95.87 100.75 64.31 95.52 102.91 65.33 95.46 103.13 64.83 94.04 2 0 27.92-999 ?-999 ?-999 ? CA CA E1125 mSER~A 15 100.98 66.25 96.64 101.67 66.95 96.83 98.56 66.30 96.09 97.49 65.70 96.26 99.63 66.34 97.17 99.46 67.63 98.00 2 0 24.40-999 ?-999 ?-999 ? CA CA E1125 mARG~A 16 98.82 66.97 94.97 99.70 67.45 94.95 97.67 65.54 93.32 96.57 65.17 92.89 97.86 66.95 93.88 98.29 67.89 92.74 2 0 25.43-999 ?-999 ?-999 ? CA CA B1132 mGLU~A 17 98.75 64.75 93.32 99.58 65.16 93.70 97.88 62.50 93.75 97.01 61.71 93.42 98.64 63.40 92.78 100.03 62.80 92.52 2 0 25.35-999 ?-999 ?-999 ? CA CA B1132 mASP~A 18 98.25 62.64 95.02 98.96 63.32 95.17 96.15 62.11 96.19 95.36 61.21 96.49 97.64 61.85 96.08 98.39 62.15 97.38 2 0 23.78-999 ?-999 ?-999 ? CA CA E1125 mALA~A 19 95.75 63.36 95.96 96.48 64.01 95.76 93.64 63.10 94.79 92.50 62.64 94.86 94.33 63.69 96.00 94.13 65.20 96.05 2 0 21.64-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 20 94.33 63.05 93.65 95.25 63.45 93.67 93.53 60.91 92.71 92.55 60.33 92.24 93.71 62.42 92.49 94.53 62.69 91.23 2 0 21.89-999 ?-999 ?-999 ? CA CA B1132 mTHR~A 21 94.47 60.29 93.40 95.20 60.88 93.75 93.19 58.51 94.47 92.37 57.68 94.12 94.40 58.84 93.60 95.65 58.25 94.28 2 0 23.98-999 ?-999 ?-999 ? CA CA B1132 mLEU~A 22 93.12 59.24 95.58 93.91 59.84 95.73 90.65 59.35 95.76 89.71 58.60 96.02 91.98 59.17 96.49 92.16 60.24 97.58 3 0 20.55-999 ?-999 ?-999 ? CA CA E1125 mARG~A 23 90.57 60.28 94.81 91.40 60.83 94.70 89.06 59.19 93.20 87.93 58.71 93.12 89.37 60.45 94.01 89.53 61.62 93.04 2 0 21.21-999 ?-999 ?-999 ? CA CA B1132 mLYS~A 24 90.11 58.68 92.55 90.99 59.12 92.74 89.42 56.34 92.38 88.58 55.59 91.90 89.92 57.57 91.63 91.20 57.25 90.87 2 0 20.47-999 ?-999 ?-999 ? CA CA B1132 mALA~A 25 89.92 56.21 93.60 90.58 56.91 93.85 88.05 55.17 94.86 87.47 54.16 95.28 89.52 55.11 94.47 90.40 55.11 95.72 2 0 22.46-999 ?-999 ?-999 ? CA CA E1135 mMET~A 26 87.42 56.35 94.76 87.96 57.10 94.38 85.07 56.61 94.04 83.89 56.30 94.15 86.03 56.44 95.21 85.84 57.59 96.19 2 0 20.08-999 ?-999 ?-999 ? CA CA E1135 mLYS~A 27 85.57 57.14 92.93 86.55 57.33 92.99 84.32 56.14 91.03 85.08 55.19 90.81 84.79 57.41 91.73 85.60 58.28 90.76 2 0 18.04-999 ?-999 ?-999 ? CA CA E1135 mGLY.A 28 83.04 56.13 90.66 82.55 56.98 90.86 81.84 54.01 91.03 81.95 54.21 92.24 82.41 54.99 90.02-999.99-999.99-999.99 1 0 14.55-999 ?-999 ?-999 ? CA CA E1135 mILE.A 29 81.20 52.93 90.57 81.09 52.86 89.58 81.89 51.14 92.08 82.74 50.68 91.33 80.72 51.96 91.55 79.61 51.07 90.97 3 0 12.80-999 ?-999 ?-999 ? CA CA E1135 mGLY.A 30 81.93 51.00 93.40 81.15 51.37 93.89 83.96 51.34 94.75 84.12 52.46 94.27 83.06 50.34 94.05-999.99-999.99-999.99 1 0 15.90-999 ?-999 ?-999 ? CA CA E1135 mTHR.A 31 84.54 50.94 95.87 84.26 50.01 96.13 86.76 50.88 96.88 86.70 49.75 97.35 85.49 51.69 96.66 84.90 52.08 98.04 2 0 19.40-999 ?-999 ?-999 ? CA CA E1135 mASP~A 32 87.88 51.47 96.52 87.73 52.39 96.16 89.85 51.21 97.94 90.77 52.02 98.06 89.21 50.86 96.61 90.03 51.37 95.43 2 0 22.53-999 ?-999 ?-999 ? CA CA E1135 mGLU~A 33 89.33 50.63 99.02 88.61 49.97 98.83 91.31 50.78 100.53 91.92 51.36 101.43 89.80 50.95 100.36 89.06 50.08 101.39 2 0 20.35-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 34 91.90 49.93 99.70 91.30 49.53 99.01 94.18 50.80 99.35 95.23 51.11 99.91 93.33 49.63 99.82 93.68 48.36 99.05 2 0 23.12-999 ?-999 ?-999 ? CA CA E1125 mSER~A 35 93.76 51.49 98.28 92.92 51.15 97.84 94.35 53.80 98.86 95.30 54.47 99.27 94.54 52.66 97.86 94.12 53.08 96.45 2 0 23.31-999 ?-999 ?-999 ? CA CA E1125 mILE~A 36 93.11 53.96 99.30 92.43 53.36 98.87 93.60 54.66 101.59 94.22 55.55 102.17 92.79 54.94 100.34 91.28 54.92 100.66 3 0 19.56-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 37 93.64 53.39 102.01 93.09 52.75 101.48 95.92 53.32 102.93 96.68 53.80 103.79 94.45 53.03 103.17 94.24 51.53 103.50 2 0 19.85-999 ?-999 ?-999 ? CA CA E1125 mHIS~A 38 96.38 53.02 101.72 95.70 52.67 101.08 98.16 54.69 101.48 99.07 55.06 102.22 97.79 53.21 101.40 98.11 52.63 100.02 3 0 22.94-999 ?-999 ?-999 ? CA CA E1125 mILE~A 39 97.45 55.56 100.76 96.74 55.16 100.18 97.69 57.49 102.30 98.61 58.11 102.82 97.75 56.99 100.86 96.77 57.83 100.02 3 0 21.68-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 40 96.60 57.19 103.00 95.94 56.60 102.54 97.50 57.28 105.31 97.94 58.06 106.15 96.42 57.71 104.34 95.05 57.30 104.88 3 0 18.52-999 ?-999 ?-999 ? CA CA E1125 mALA~A 41 97.91 56.01 105.25 97.56 55.45 104.50 100.28 55.82 105.93 101.17 55.77 106.79 98.83 55.53 106.28 98.63 54.04 106.51 2 0 20.50-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 42 100.57 56.10 104.65 99.82 56.16 104.01 102.37 57.74 104.24 103.52 58.07 103.91 101.99 56.27 104.34 102.39 55.53 103.06 2 0 23.63-999 ?-999 ?-999 ? CA CA E1125 mARG~A 43 101.41 58.63 104.47 100.52 58.23 104.67 101.58 60.62 105.86 100.73 60.13 106.62 101.69 60.07 104.43 100.69 60.79 103.52 2 0 22.34-999 ?-999 ?-999 ? CA CA E1125 mSER~A 44 102.42 61.58 106.20 103.06 61.84 105.47 101.12 63.02 107.70 100.41 63.26 106.73 102.40 62.20 107.53 103.59 63.14 107.71 2 0 21.64-999 ?-999 ?-999 ? CA CA E1125 mASN~A 45 100.80 63.43 108.93 101.45 63.20 109.65 99.61 65.49 108.34 98.68 65.91 107.66 99.55 64.18 109.11 99.30 64.40 110.60 2 0 18.39-999 ?-999 ?-999 ? CA CA E1125 mALA~A 46 100.77 66.13 108.41 101.47 65.69 108.98 100.69 67.24 106.21 100.07 68.11 105.61 100.97 67.39 107.70 102.39 67.90 107.94 2 0 20.40-999 ?-999 ?-999 ? CA CA E1125 mGLN~A 47 101.15 66.13 105.64 101.64 65.52 106.27 99.46 65.62 103.94 98.94 66.16 102.96 100.95 65.83 104.23 101.77 64.60 103.83 2 0 21.45-999 ?-999 ?-999 ? CA CA E1125 mARG~A 48 98.79 64.88 104.81 99.36 64.47 105.52 96.62 66.05 104.66 95.62 66.18 103.95 97.34 64.70 104.71 96.81 63.89 105.89 2 0 17.98-999 ?-999 ?-999 ? CA CA E1125 mGLN~A 49 97.13 67.05 105.37 97.97 66.83 105.87 96.51 69.01 104.01 95.53 69.61 103.55 96.46 68.36 105.38 97.06 69.28 106.43 2 0 17.39-999 ?-999 ?-999 ? CA CA E1125 mGLN~A 50 97.63 68.89 103.31 98.38 68.42 103.79 96.90 68.61 100.96 96.27 69.14 100.04 97.75 69.39 101.94 99.23 69.36 101.55 2 0 20.50-999 ?-999 ?-999 ? CA CA E1125 mILE~A 51 96.86 67.28 101.10 97.45 66.90 101.82 94.51 66.88 100.47 93.71 66.94 99.54 95.97 66.49 100.24 96.21 64.99 100.50 3 0 19.67-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 52 94.08 67.14 101.70 94.75 67.00 102.43 92.51 68.91 101.13 91.53 69.08 100.41 92.71 67.61 101.92 92.43 67.90 103.39 2 0 16.40-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 53 93.51 69.79 101.23 94.27 69.50 101.81 93.30 70.88 99.03 92.33 71.39 98.44 93.45 71.07 100.52 94.66 71.94 100.84 2 0 18.88-999 ?-999 ?-999 ? CA CA E1125 mASP~A 54 94.20 70.10 98.42 94.91 69.71 99.01 92.82 69.16 96.59 92.28 69.43 95.51 94.10 69.88 96.98 95.33 69.14 96.45 2 0 21.50-999 ?-999 ?-999 ? CA CA E1125 mTYR~A 55 92.29 68.28 97.44 92.78 68.16 98.30 89.90 68.52 96.98 89.10 68.52 96.04 91.07 67.55 97.07 90.78 66.43 98.07 3 0 19.29-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 56 89.73 69.37 97.99 90.39 69.31 98.74 88.78 71.29 96.74 87.82 71.58 96.05 88.61 70.32 97.91 88.48 71.16 99.20 2 0 18.21-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 57 90.01 71.77 96.51 90.71 71.43 97.13 89.94 72.10 94.07 89.27 72.71 93.23 90.26 72.72 95.42 91.70 73.25 95.45 2 0 21.83-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 58 90.41 70.88 93.82 91.00 70.54 94.55 88.62 69.86 92.42 88.10 70.00 91.32 90.11 70.12 92.63 90.78 68.73 92.70 3 0 20.07-999 ?-999 ?-999 ? CA CA B1132 mPHE~A 59 87.94 69.37 93.45 88.39 69.42 94.34 85.48 69.50 93.92 84.31 69.16 93.65 86.63 68.79 93.22 86.65 67.30 93.64 3 0 18.85-999 ?-999 ?-999 ? CA CA B1132 mGLY~A 60 85.72 70.47 94.80 86.68 70.60 95.04 83.82 70.51 96.41 82.70 70.92 96.75 84.62 71.25 95.35-999.99-999.99-999.99 1 0 19.79-999 ?-999 ?-999 ? CA CA E1125 mLYS.A 61 84.40 69.45 96.95 85.26 69.23 96.50 85.04 68.35 99.00 86.14 68.13 98.49 83.88 68.68 98.07 83.23 67.37 97.63 2 0 16.32-999 ?-999 ?-999 ? CA CA E1125 mHIS~A 62 84.85 68.37 100.30 83.93 68.63 100.59 86.17 66.52 101.28 85.22 65.75 101.18 85.95 68.04 101.21 85.67 68.57 102.61 3 0 13.65-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 63 87.41 66.12 101.48 88.06 66.88 101.56 87.07 64.03 102.73 86.55 62.92 102.53 87.80 64.72 101.59 89.31 64.65 101.80 3 0 13.47-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 64 87.03 64.61 103.93 87.52 65.48 103.99 84.88 63.66 104.64 84.32 62.63 105.01 86.32 63.98 105.03 86.24 64.86 106.28 2 0 9.72-999 ?-999 ?-999 ? CA CA E1125 mASP~A 65 84.26 64.60 103.92 84.79 65.41 103.66 82.74 63.20 102.58 81.72 62.50 102.59 82.86 64.36 103.57 82.20 65.63 103.06 2 0 10.08-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 66 83.74 63.00 101.73 84.49 63.66 101.78 83.82 60.56 101.60 83.12 59.58 101.36 83.69 61.86 100.80 84.80 61.94 99.76 2 0 13.14-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 67 84.70 60.61 102.60 85.18 61.48 102.69 83.71 59.18 104.34 83.32 58.02 104.50 84.92 59.47 103.47 86.19 59.65 104.28 3 0 11.60-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 68 83.06 60.21 104.87 83.45 61.11 104.66 80.79 59.23 104.92 79.94 58.55 105.49 81.87 59.98 105.69 81.30 61.30 106.21 2 0 8.93-999 ?-999 ?-999 ? CA CA E1125 mSER~A 69 80.80 59.36 103.60 81.54 59.93 103.24 80.22 57.32 102.30 79.43 56.37 102.38 79.80 58.72 102.77 79.54 59.60 101.54 2 0 12.25-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 70 81.44 57.22 101.79 81.99 58.05 101.89 82.49 55.00 102.13 82.62 53.83 101.76 81.93 56.02 101.15 83.02 56.38 100.13 2 0 14.85-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 71 82.85 55.41 103.35 82.70 56.38 103.52 82.48 54.32 105.53 81.58 55.13 105.76 83.40 54.48 104.33 84.78 54.94 104.79 3 0 13.48-999 ?-999 ?-999 ? CA CA E1125 mSER~A 72 82.68 53.28 106.35 83.45 52.68 106.13 82.38 52.33 108.63 83.50 51.85 108.59 81.77 53.11 107.48 80.47 52.47 107.01 2 0 12.60-999 ?-999 ?-999 ? CA CA E1125 mGLY~A 73 81.61 52.23 109.71 80.70 52.65 109.63 83.41 52.12 111.39 83.70 53.31 111.21 82.08 51.56 110.91-999.99-999.99-999.99 1 0 12.86-999 ?-999 ?-999 ? CA CA E1125 mASN~A 74 84.19 51.24 112.01 83.81 50.31 112.06 86.50 51.97 111.50 87.47 52.66 111.83 85.49 51.59 112.57 86.00 50.47 113.47 2 0 13.14-999 ?-999 ?-999 ? CA CA E1125 mTYR~A 75 86.31 51.59 110.25 85.50 51.02 110.10 87.07 53.49 108.92 88.03 54.26 108.79 87.26 52.01 109.20 87.06 51.20 107.92 3 0 14.04-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 76 85.80 53.88 108.76 85.12 53.15 108.83 86.10 56.10 109.65 86.79 57.10 109.45 85.49 55.28 108.52 83.97 55.50 108.50 2 0 10.88-999 ?-999 ?-999 ? CA CA E1125 mALA~A 77 85.88 55.59 110.86 85.40 54.71 110.88 87.84 56.45 112.07 88.40 57.51 112.38 86.33 56.32 112.04 85.77 55.63 113.28 2 0 9.20-999 ?-999 ?-999 ? CA CA E1125 mALA~A 78 88.55 55.37 111.73 88.05 54.55 111.44 90.56 56.35 110.69 91.54 57.10 110.80 90.02 55.50 111.82 90.65 54.13 111.87 2 0 12.10-999 ?-999 ?-999 ? CA CA E1125 mALA~A 79 89.90 56.28 109.53 89.11 55.67 109.51 90.21 58.57 108.68 91.08 59.40 108.42 90.37 57.08 108.39 89.60 56.65 107.15 2 0 12.32-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 80 89.07 58.92 109.25 88.46 58.15 109.41 89.67 60.77 110.71 90.07 61.92 110.81 88.74 60.31 109.59 87.29 60.36 110.04 3 0 8.95-999 ?-999 ?-999 ? CA CA E1125 mALA~A 81 90.00 59.82 111.58 89.59 58.92 111.39 92.23 60.61 112.19 92.80 61.55 112.74 90.89 60.09 112.70 91.08 58.80 113.49 2 0 10.06-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 82 92.69 60.01 111.09 92.10 59.31 110.70 93.95 61.74 109.84 95.01 62.37 109.75 93.98 60.38 110.52 94.48 59.31 109.55 3 0 13.19-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 83 92.78 62.18 109.36 91.99 61.60 109.55 92.74 64.66 109.50 93.17 65.74 109.10 92.73 63.43 108.60 91.53 63.48 107.67 3 0 12.11-999 ?-999 ?-999 ? CA CA E1125 mARG~A 84 92.27 64.49 110.72 91.93 63.57 110.91 93.67 66.03 112.01 94.54 65.19 112.24 92.25 65.58 111.69 91.60 65.06 112.98 2 0 10.80-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 85 93.91 67.32 112.15 93.20 67.94 111.81 95.15 67.23 114.23 94.06 67.03 114.77 95.17 67.75 112.79 95.35 69.26 112.80 2 0 13.95-999 ?-999 ?-999 ? CA CA E1125 mPRO~A 86 96.31 67.04 114.84 97.10 67.39 114.33 95.65 67.11 117.26 95.06 66.46 118.13 96.39 66.39 116.15 97.89 66.41 116.46 3 0 15.07-999 ?-999 ?-999 ? CA CA E1125 mASP~A 87 95.72 68.43 117.32 96.26 68.88 116.61 93.51 68.96 118.25 92.83 68.72 119.24 95.02 69.13 118.40 95.37 70.62 118.45 2 0 15.01-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 88 93.05 69.10 117.02 93.78 69.33 116.37 91.15 67.54 116.93 90.02 67.38 117.39 91.68 68.93 116.60 91.55 69.16 115.09 2 0 11.46-999 ?-999 ?-999 ? CA CA E1125 mPHE~A 89 91.97 66.53 116.64 92.84 66.79 116.24 91.31 64.93 118.40 90.29 64.37 118.81 91.56 65.14 116.92 92.66 64.19 116.43 3 0 10.44-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 90 92.20 65.42 119.25 92.99 65.87 118.83 90.86 66.19 121.16 90.07 65.79 122.03 92.00 65.29 120.69 93.27 65.61 121.47 3 0 12.55-999 ?-999 ?-999 ? CA CA E1125 mALA~A 91 90.74 67.40 120.63 91.43 67.67 119.96 88.30 67.53 120.73 87.39 67.46 121.56 89.61 68.23 121.07 89.71 69.62 120.47 2 0 11.62-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 92 88.20 66.95 119.54 89.01 67.05 118.96 86.78 64.98 119.99 85.64 64.59 120.25 86.99 66.23 119.14 87.05 65.86 117.67 2 0 7.95-999 ?-999 ?-999 ? CA CA E1125 mGLN~A 93 87.86 64.32 120.39 88.72 64.70 120.07 87.18 63.49 122.60 86.35 62.79 123.18 87.75 63.13 121.24 89.13 62.46 121.38 2 0 9.79-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 94 87.63 64.61 123.16 88.34 65.09 122.64 85.60 65.37 124.28 84.81 64.86 125.07 87.09 65.08 124.43 87.83 66.33 124.91 3 0 11.13-999 ?-999 ?-999 ? CA CA A1121 mHIS~A 95 85.27 66.11 123.23 86.05 66.45 122.71 83.06 65.11 122.86 82.10 64.94 123.61 83.87 66.39 122.88 83.79 67.12 121.54 3 0 9.81-999 ?-999 ?-999 ? CA CA E1125 mALA~A 96 83.45 64.15 122.01 84.25 64.38 121.46 82.64 62.17 123.28 81.66 61.47 123.55 82.73 62.88 121.93 83.39 61.98 120.91 2 0 8.50-999 ?-999 ?-999 ? CA CA E1125 mALA~A 97 83.65 62.33 124.13 84.37 62.94 123.82 82.67 62.26 126.40 82.20 61.60 127.33 83.66 61.64 125.41 85.07 61.64 126.00 2 0 7.70-999 ?-999 ?-999 ? CA CA A1121 mMET~A 98 82.37 63.53 126.18 82.78 63.91 125.36 80.06 64.39 126.59 79.13 64.40 127.40 81.51 64.31 127.07 82.04 65.75 127.14 2 0 -4.98-999 ?-999 ?-999 ? CA CA A1121smLYS~A 99 79.89 64.55 125.29 80.73 64.43 124.76 77.84 63.67 124.14 76.67 63.82 123.79 78.61 64.85 124.70 78.78 65.96 123.66 2 0 5.62-999 ?-999 ?-999 ? CA CA A1121 mGLY~A 100 78.41 62.46 124.15 79.37 62.42 124.42 76.64 60.91 124.87 76.41 61.69 125.80 77.62 61.29 123.77-999.99-999.99-999.99 1 0 6.46-999 ?-999 ?-999 ? CA CA A1121 mLEU.A 101 76.07 59.71 124.81 76.28 59.23 123.96 76.11 58.80 127.07 76.92 57.87 127.06 75.23 59.15 125.87 74.52 57.92 125.34 3 0 6.20-999 ?-999 ?-999 ? CA CA A1121 mGLY.A 102 76.00 59.59 128.14 75.31 60.31 128.08 78.29 59.83 129.11 78.63 60.44 128.10 76.86 59.36 129.29-999.99-999.99-999.99 1 0 -3.93-999 ?-999 ?-999 ? CA CA A1121smTHR.A 103 79.14 59.56 130.09 78.74 58.96 130.79 81.55 58.97 130.04 81.49 57.96 130.74 80.49 60.06 130.18 80.69 60.76 131.55 2 0 -4.22-999 ?-999 ?-999 ? CA CA A1121smASP~A 104 82.51 59.19 129.15 82.35 60.02 128.60 84.89 58.96 129.68 85.74 59.63 129.10 83.69 58.35 128.96 84.02 58.14 127.49 2 0 7.80-999 ?-999 ?-999 ? CA CA A1121 mLYS~A 105 84.91 58.78 130.99 84.16 58.19 131.31 87.27 58.78 131.68 88.25 59.52 131.79 85.88 59.36 131.90 85.38 59.19 133.34 2 0 9.29-999 ?-999 ?-999 ? CA CA A1121 mASN~A 106 87.38 57.50 131.32 86.53 56.97 131.31 89.29 57.77 129.80 90.49 58.05 129.77 88.69 56.96 130.95 88.61 55.49 130.54 2 0 12.72-999 ?-999 ?-999 ? CA CA A1121 mALA~A 107 88.44 58.13 128.84 87.52 57.74 128.93 89.30 60.38 128.32 90.33 60.89 127.90 88.83 59.03 127.76 87.69 59.23 126.78 2 0 12.14-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 108 88.58 60.95 129.29 87.77 60.44 129.59 90.37 62.18 130.50 91.17 63.11 130.49 89.00 62.24 129.84 87.96 62.74 130.84 3 0 11.41-999 ?-999 ?-999 ? CA CA A1121 mILE~A 109 90.65 61.06 131.17 89.95 60.35 131.12 93.09 60.77 130.97 94.11 61.44 131.11 91.90 60.94 131.91 91.81 59.76 132.91 3 0 14.58-999 ?-999 ?-999 ? CA CA A1121 mASP~A 110 92.92 59.88 130.00 92.04 59.41 130.02 94.39 60.93 128.37 95.59 61.15 128.23 93.94 59.61 129.00 93.40 58.71 127.89 2 0 16.72-999 ?-999 ?-999 ? CA CA A1121 mILE~A 111 93.42 61.76 127.99 92.50 61.46 128.22 94.16 64.12 128.25 95.11 64.87 128.00 93.74 63.01 127.30 92.59 63.49 126.40 3 0 16.33-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 112 93.45 64.25 129.37 92.79 63.52 129.55 94.74 65.21 131.30 95.27 66.18 131.85 93.67 65.40 130.24 92.33 65.75 130.92 3 0 16.20-999 ?-999 ?-999 ? CA CA A1121 mCYH~A 113 95.00 63.94 131.65 94.56 63.24 131.09 97.29 63.32 132.38 98.12 62.95 133.22 95.87 63.68 132.78 95.23 62.58 133.64 2 0 18.47-999 ?-999 ?-999 ? CA CA A1121 mTHR.A 114 97.63 63.45 131.11 96.93 63.89 130.54 99.66 64.00 129.79 100.78 63.73 129.34 98.91 62.96 130.62 98.64 61.72 129.74 2 0 21.29-999 ?-999 ?-999 ? CA CA A1121 mGLN.A 115 99.08 65.18 129.59 98.24 65.32 130.10 100.56 67.18 129.37 100.53 67.28 130.60 99.65 66.17 128.69 98.49 66.92 128.01 2 0 22.27-999 ?-999 ?-999 ? CA CA A1121 mSER~A 116 101.34 67.92 128.59 101.30 67.65 127.63 101.37 70.31 129.10 100.28 70.33 128.52 102.18 69.02 129.06 103.38 69.24 128.13 2 0 25.26-999 ?-999 ?-999 ? CA CA A1121 mASN~A 117 101.90 71.36 129.73 102.77 71.18 130.18 100.88 73.06 128.30 99.72 73.34 127.99 101.23 72.65 129.73 102.09 73.74 130.38 2 0 25.45-999 ?-999 ?-999 ? CA CA A1121 mALA~A 118 101.89 73.02 127.43 102.76 72.70 127.81 100.77 72.50 125.29 100.06 72.96 124.39 101.71 73.43 126.04 103.04 73.53 125.31 2 0 25.32-999 ?-999 ?-999 ? CA CA E1125 mGLN~A 119 100.75 71.21 125.60 101.36 70.90 126.33 98.38 70.62 125.22 97.48 70.61 124.38 99.83 70.35 124.84 100.15 68.87 125.04 2 0 22.21-999 ?-999 ?-999 ? CA CA E1125 mILE~A 120 98.14 70.85 126.51 98.94 70.78 127.10 96.32 72.50 126.42 95.15 72.71 126.10 96.79 71.17 127.00 96.77 71.26 128.53 3 0 20.99-999 ?-999 ?-999 ? CA CA A1121 mHIS~A 121 97.25 73.44 126.28 98.19 73.21 126.55 96.40 74.60 124.30 95.39 75.18 123.89 96.82 74.74 125.76 97.91 75.79 125.94 3 0 22.11-999 ?-999 ?-999 ? CA CA E1125 mALA~A 122 97.17 73.83 123.52 97.95 73.38 123.96 95.46 73.02 121.98 94.62 73.32 121.13 96.79 73.72 122.11 97.88 73.04 121.30 2 0 19.80-999 ?-999 ?-999 ? CA CA E1125 mILE~A 123 95.22 72.08 122.90 95.94 71.94 123.58 92.81 72.23 123.27 91.71 72.16 122.71 93.97 71.33 122.86 94.04 70.12 123.81 3 0 16.97-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 124 93.02 73.06 124.29 93.91 72.97 124.74 91.64 74.95 123.54 90.48 75.29 123.30 91.98 74.00 124.69 92.45 74.81 125.90 2 0 18.05-999 ?-999 ?-999 ? CA CA E1125 mALA~A 125 92.65 75.42 122.82 93.55 75.08 123.10 91.75 75.67 120.53 90.82 76.18 119.89 92.42 76.35 121.71 93.74 76.98 121.31 2 0 18.16-999 ?-999 ?-999 ? CA CA E1125 mALA~A 126 92.18 74.44 120.22 92.97 74.12 120.74 90.04 73.42 119.52 89.14 73.48 118.68 91.50 73.68 119.18 92.26 72.37 118.95 2 0 14.77-999 ?-999 ?-999 ? CA CA E1125 mPHE~A 127 89.74 73.12 120.79 90.52 73.08 121.41 87.46 74.08 120.93 86.33 73.95 120.44 88.36 72.87 121.19 88.32 72.50 122.68 3 0 13.35-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 128 87.91 75.26 121.35 88.82 75.23 121.77 86.89 76.77 119.72 85.76 76.97 119.28 87.12 76.48 121.20 87.82 77.65 121.89 2 0 15.48-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 129 87.97 76.74 118.94 88.83 76.58 119.43 86.89 75.95 116.87 86.16 76.30 115.94 87.87 76.94 117.50 89.25 76.80 116.87 3 0 14.73-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 130 86.87 74.72 117.37 87.50 74.56 118.13 84.54 73.90 117.26 83.58 73.61 116.55 85.98 73.70 116.82 86.40 72.31 117.30 3 0 10.96-999 ?-999 ?-999 ? CA CA E1125 mTYR~A 131 84.35 74.26 118.54 85.14 74.53 119.08 82.46 75.53 119.56 81.33 75.61 120.05 82.96 74.21 119.00 82.83 73.09 120.04 3 0 11.50-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 132 83.31 76.54 119.60 84.21 76.32 119.22 82.88 77.85 121.65 82.94 78.94 122.24 82.96 77.85 120.13 81.65 78.33 119.51 2 0 15.25-999 ?-999 ?-999 ? CA CA E1125 mGLU.A 133 82.72 76.71 122.29 82.73 75.92 121.68 83.89 76.49 124.42 84.89 76.23 123.77 82.54 76.59 123.72 81.69 75.36 124.04 2 0 15.61-999 ?-999 ?-999 ? CA CA A1121 mASP~A 134 83.89 76.75 125.71 82.99 77.01 126.07 85.21 75.24 127.06 84.23 74.69 127.57 85.09 76.67 126.53 84.99 77.65 127.70 2 0 15.82-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 135 86.40 74.67 126.92 87.11 75.26 126.51 86.32 73.09 128.81 85.60 72.15 129.16 86.62 73.29 127.33 88.06 72.86 127.03 3 0 13.81-999 ?-999 ?-999 ? CA CA A1121 mGLU~A 136 86.90 73.94 129.66 87.45 74.65 129.22 85.25 73.88 131.48 84.77 73.16 132.36 86.73 73.82 131.11 87.49 74.92 131.86 2 0 14.08-999 ?-999 ?-999 ? CA CA A1121 mLYS~A 137 84.52 74.75 130.77 84.99 75.25 130.06 82.33 73.62 130.74 81.43 73.19 131.48 83.10 74.88 131.11 82.43 76.10 130.51 2 0 12.99-999 ?-999 ?-999 ? CA CA A1121 mGLU~A 138 82.65 72.98 129.62 83.38 73.40 129.07 82.29 70.61 130.23 81.44 69.81 130.59 81.93 71.75 129.28 82.22 71.37 127.83 2 0 9.64-999 ?-999 ?-999 ? CA CA A1121 mILE~A 139 83.55 70.56 130.63 84.13 71.28 130.25 83.28 69.59 132.87 82.84 68.57 133.39 84.03 69.53 131.55 85.55 69.67 131.80 3 0 9.18-999 ?-999 ?-999 ? CA CA A1121 mILE~A 140 83.12 70.81 133.39 83.49 71.54 132.83 80.99 70.61 134.65 80.37 70.27 135.66 82.45 71.02 134.68 82.63 72.50 135.08 3 0 10.37-999 ?-999 ?-999 ? CA CA A1121 mSER~A 141 80.41 70.61 133.45 81.00 70.91 132.69 78.86 68.71 133.11 77.75 68.20 133.21 79.02 70.21 133.27 78.38 70.95 132.10 2 0 7.93-999 ?-999 ?-999 ? CA CA A1121 mGLU~A 142 79.95 67.97 132.83 80.81 68.48 132.79 80.53 65.76 133.72 80.53 64.53 133.75 79.83 66.54 132.61 80.38 66.09 131.26 2 0 -4.83-999 ?-999 ?-999 ? CA CA A1121smTHR~A 143 81.16 66.47 134.65 81.14 67.46 134.52 81.51 66.50 137.06 81.03 67.64 137.03 81.81 65.78 135.75 83.34 65.75 135.53 2 0 7.62-999 ?-999 ?-999 ? CA CA A1121 mSER~A 144 81.83 65.85 138.18 82.19 64.92 138.07 82.62 66.05 140.52 83.41 65.13 140.33 81.64 66.53 139.46 80.20 66.36 139.95 2 0 10.85-999 ?-999 ?-999 ? CA CA A1121 mGLY~A 145 82.54 66.69 141.68 81.90 67.46 141.65 84.78 66.46 142.70 85.31 67.39 142.08 83.28 66.35 142.87-999.99-999.99-999.99 1 0 14.45-999 ?-999 ?-999 ? CA CA A1121 mASN~A 146 85.48 65.49 143.29 84.94 64.77 143.71 87.48 65.34 141.87 88.49 65.94 141.51 86.93 65.54 143.28 87.50 64.50 144.25 2 0 15.17-999 ?-999 ?-999 ? CA CA A1131 mPHE~A 147 86.82 64.52 141.07 86.01 64.09 141.49 87.16 65.53 138.86 88.07 65.87 138.12 87.25 64.27 139.71 86.36 63.20 139.07 3 0 13.74-999 ?-999 ?-999 ? CA CA A1121 mGLN~A 148 86.02 66.23 138.95 85.30 65.84 139.52 87.06 68.43 138.62 87.68 69.04 137.77 85.92 67.50 138.23 84.58 68.18 138.54 2 0 12.49-999 ?-999 ?-999 ? CA CA A1121 mARG~A 149 87.32 68.56 139.92 86.78 67.99 140.53 89.73 69.12 139.80 90.52 70.00 139.44 88.35 69.50 140.34 88.37 69.63 141.86 2 0 16.22-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 150 90.03 67.83 139.71 89.31 67.22 140.03 91.46 67.72 137.71 92.54 68.14 137.28 91.32 67.37 139.19 91.47 65.85 139.37 3 0 17.04-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 151 90.38 67.54 136.95 89.59 67.15 137.43 90.45 69.40 135.38 91.11 69.91 134.47 90.39 67.89 135.54 89.19 67.31 134.79 3 0 14.71-999 ?-999 ?-999 ? CA CA A1121 mVAL~A 152 89.85 70.16 136.30 89.32 69.67 137.00 91.44 72.02 136.47 92.02 72.83 135.75 90.00 71.62 136.20 89.02 72.33 137.14 3 0 16.24-999 ?-999 ?-999 ? CA CA A1121 mSER~A 153 92.07 71.39 137.46 91.50 70.76 137.98 94.34 71.40 136.50 95.18 72.23 136.18 93.48 71.63 137.74 93.98 70.72 138.86 2 0 19.59-999 ?-999 ?-999 ? CA CA A1121 mMET~A 154 94.12 70.26 135.87 93.45 69.68 136.35 94.50 70.86 133.50 95.32 71.00 132.58 94.74 69.84 134.62 94.14 68.51 134.16 2 0 18.96-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 155 93.34 71.51 133.51 92.75 71.32 134.30 93.71 73.74 132.54 93.68 74.56 131.61 92.99 72.41 132.42 91.47 72.64 132.40 3 0 18.11-999 ?-999 ?-999 ? CA CA A1121 mGLN~A 156 94.36 73.97 133.69 94.33 73.25 134.38 96.35 75.30 133.07 96.83 76.39 132.71 95.04 75.26 133.84 95.25 75.60 135.32 2 0 21.56-999 ?-999 ?-999 ? CA CA A1121 mGLY.A 157 96.95 74.15 132.80 96.43 73.33 133.02 99.21 74.98 133.13 100.04 75.77 132.69 98.30 74.18 132.22-999.99-999.99-999.99 1 0 23.54-999 ?-999 ?-999 ? CA CA A1121 mGLY.A 158 99.01 74.79 134.43 98.30 74.11 134.63 100.84 74.66 136.10 101.36 75.02 137.16 99.74 75.48 135.47-999.99-999.99-999.99 1 0 24.77-999 ?-999 ?-999 ? CA CA F1126 mARG.A 159 101.20 73.53 135.49 100.75 73.30 134.63 103.57 73.50 136.17 103.93 74.13 135.18 102.25 72.74 136.15 102.44 71.39 135.46 2 0 25.55-999 ?-999 ?-999 ? CA CA A1131 mLYS.A 160 104.32 73.42 137.28 103.92 72.90 138.03 106.68 73.19 136.63 107.38 72.39 137.24 105.63 74.07 137.30 106.06 74.42 138.73 2 0 26.91-999 ?-999 ?-999 ? CA CA A1131 mGLU.A 161 106.74 73.32 135.30 106.17 74.05 134.92 109.07 72.79 134.67 109.95 72.04 134.23 107.60 72.45 134.51 107.18 72.45 133.03 2 0 28.93-999 ?-999 ?-999 ? CA CA A1131 mASP.A 162 109.35 73.89 135.36 108.57 74.40 135.72 111.23 73.99 136.95 112.36 74.33 137.31 110.75 74.28 135.53 110.98 75.73 135.14 2 0 30.86-999 ?-999 ?-999 ? CA CA A1131 mGLU.A 163 110.37 73.39 137.76 109.47 73.19 137.37 111.84 71.96 139.06 111.63 70.91 138.45 110.78 73.06 139.13 109.58 72.59 139.94 2 0 28.06-999 ?-999 ?-999 ? CA CA A1131 mPRO.A 164 113.03 72.23 139.57 113.13 73.13 139.99 113.94 70.17 140.60 113.41 70.43 141.68 114.08 71.20 139.49 115.36 72.03 139.65 3 0 29.21-999 ?-999 ?-999 ? CA CA A1131 mVAL.A 165 114.44 68.97 140.31 114.74 68.87 139.36 115.22 68.42 142.54 116.31 68.98 142.46 114.53 67.90 141.29 115.29 66.69 140.73 3 0 27.28-999 ?-999 ?-999 ? CA CA A1131 mASN~A 166 114.55 68.28 143.68 113.65 67.87 143.53 114.54 67.61 146.00 113.33 67.48 146.23 115.02 68.67 145.00 114.48 70.04 145.40 2 0 26.31-999 ?-999 ?-999 ? CA CA A1131 mALA~A 167 115.48 66.86 146.54 116.41 67.11 146.26 114.48 66.27 148.72 113.50 65.71 149.21 115.16 65.77 147.46 116.44 65.00 147.80 2 0 24.56-999 ?-999 ?-999 ? CA CA A1131 mALA~A 168 115.02 67.33 149.30 115.82 67.70 148.84 112.99 68.26 150.34 112.11 67.98 151.17 114.45 67.87 150.53 115.27 69.08 150.98 2 0 23.87-999 ?-999 ?-999 ? CA CA A1131 mHIS~A 169 112.71 68.97 149.24 113.47 69.16 148.63 110.44 68.24 148.67 109.26 68.23 149.00 111.33 69.43 149.03 111.25 70.51 147.96 3 0 22.24-999 ?-999 ?-999 ? CA CA A1131 mALA~A 170 111.04 67.28 147.99 112.00 67.46 147.75 109.91 65.28 148.87 108.84 64.68 148.88 110.32 66.06 147.62 111.17 65.19 146.71 2 0 20.36-999 ?-999 ?-999 ? CA CA A1131 mALA~A 171 110.75 65.26 149.89 111.59 65.79 149.74 109.32 65.18 151.86 108.47 64.57 152.50 110.46 64.52 151.11 111.71 64.49 152.00 2 0 18.91-999 ?-999 ?-999 ? CA CA A1131 mGLU~A 172 109.33 66.51 151.78 110.10 66.91 151.27 106.94 66.97 151.72 105.94 66.79 152.41 108.27 67.29 152.41 108.56 68.78 152.33 2 0 17.87-999 ?-999 ?-999 ? CA CA A1131 mASP~A 173 106.97 66.92 150.39 107.87 67.06 149.96 105.25 65.24 149.96 104.07 65.03 150.24 105.74 66.65 149.65 105.86 66.87 148.15 2 0 16.14-999 ?-999 ?-999 ? CA CA A1131 mALA~A 174 106.21 64.31 149.97 107.12 64.64 149.70 105.31 62.87 151.73 104.39 62.08 151.96 105.94 62.93 150.35 107.20 62.09 150.30 2 0 14.50-999 ?-999 ?-999 ? CA CA A1131 mALA~A 175 105.78 63.69 152.66 106.49 64.32 152.35 103.83 64.20 154.10 102.97 63.67 154.80 105.25 63.65 154.03 106.18 64.39 154.98 2 0 13.35-999 ?-999 ?-999 ? CA CA A1131 mALA~A 176 103.56 65.28 153.37 104.31 65.63 152.81 101.19 64.93 152.84 100.06 64.79 153.30 102.22 65.87 153.45 102.20 67.23 152.77 2 0 11.99-999 ?-999 ?-999 ? CA CA A1131 mILE~A 177 101.58 64.26 151.77 102.52 64.46 151.48 100.44 62.11 152.00 99.31 61.62 152.12 100.70 63.30 151.10 101.36 62.85 149.79 3 0 9.98-999 ?-999 ?-999 ? CA CA A1131 mTYR~A 178 101.47 61.61 152.68 102.36 62.03 152.48 100.28 60.92 154.72 99.29 60.22 154.94 101.28 60.52 153.64 102.62 60.16 154.29 3 0 8.65-999 ?-999 ?-999 ? CA CA A1131 mGLN~A 179 100.54 62.06 155.35 101.38 62.51 155.06 98.24 62.83 155.84 97.28 62.88 156.61 99.65 62.59 156.38 100.20 63.89 156.96 2 0 7.95-999 ?-999 ?-999 ? CA CA A1131 mALA~A 180 98.16 63.03 154.53 99.05 62.94 154.07 96.04 62.12 153.70 94.83 62.25 153.57 96.94 63.34 153.82 97.25 63.87 152.42 2 0 6.48-999 ?-999 ?-999 ? CA CA A1131 mGLY~A 181 96.68 60.95 153.65 97.68 61.01 153.77 96.29 58.69 154.51 95.59 58.62 155.51 95.97 59.71 153.43-999.99-999.99-999.99 1 0 -3.65-999 ?-999 ?-999 ? CA CA A1131smGLU.A 182 97.36 57.92 154.33 97.87 58.11 153.49 97.81 57.44 156.73 97.40 56.79 157.69 97.73 56.90 155.30 99.07 56.28 154.93 2 0 4.89-999 ?-999 ?-999 ? CA CA A1131 mGLY.A 183 98.36 58.64 156.89 98.58 59.13 156.05 97.37 59.40 159.07 97.50 59.65 160.27 98.59 59.18 158.21-999.99-999.99-999.99 1 0 6.39-999 ?-999 ?-999 ? CA CA A1131 mGLN.A 184 96.18 59.32 158.49 96.19 59.01 157.54 93.79 58.80 158.82 93.88 58.03 157.86 94.96 59.69 159.21 94.63 61.16 158.93 2 0 -4.70-999 ?-999 ?-999 ? CA CA A1131smILE.A 185 92.70 58.89 159.57 92.77 59.59 160.28 90.77 58.49 158.09 90.50 57.70 157.18 91.53 58.06 159.35 90.57 58.15 160.55 3 0 -4.48-999 ?-999 ?-999 ? CA CA A1131smGLY.A 186 90.45 59.78 158.07 90.69 60.26 158.92 90.84 60.84 155.92 92.00 60.40 155.96 89.81 60.44 156.96-999.99-999.99-999.99 1 0 -4.27-999 ?-999 ?-999 ? CA CA A1131smTHR.A 187 90.45 61.70 154.98 89.52 62.04 155.07 91.50 63.56 153.74 90.59 64.27 154.16 91.40 62.06 153.92 90.93 61.38 152.62 2 0 -4.26-999 ?-999 ?-999 ? CA CA A1131smASP~A 188 92.61 64.04 153.21 93.34 63.37 153.19 93.07 65.28 151.20 94.20 65.47 150.78 92.77 65.40 152.70 93.89 66.18 153.38 2 0 7.48-999 ?-999 ?-999 ? CA CA A1131 mGLU~A 189 92.06 64.88 150.45 91.21 64.76 150.97 92.79 65.81 148.30 93.46 65.67 147.27 92.15 64.63 149.03 90.79 64.36 148.39 2 0 8.82-999 ?-999 ?-999 ? CA CA A1131 mSER~A 190 92.58 67.03 148.82 92.09 67.06 149.68 94.59 68.21 148.07 95.20 68.78 147.16 93.07 68.19 148.09 92.50 69.49 148.65 2 0 12.13-999 ?-999 ?-999 ? CA CA A1131 mARG~A 191 95.21 67.55 149.06 94.62 67.09 149.73 97.23 66.68 147.99 98.26 67.00 147.40 96.67 67.57 149.09 97.23 67.16 150.44 2 0 11.62-999 ?-999 ?-999 ? CA CA A1131 mPHE~A 192 96.51 65.60 147.71 95.71 65.46 148.30 96.75 65.48 145.28 97.61 65.40 144.40 96.88 64.72 146.60 96.00 63.48 146.56 3 0 11.33-999 ?-999 ?-999 ? CA CA A1131 mASN~A 193 95.64 66.21 145.19 95.02 66.16 145.97 96.55 68.00 143.78 97.11 68.17 142.70 95.42 67.00 143.97 94.07 67.74 144.06 2 0 14.34-999 ?-999 ?-999 ? CA CA A1131 mALA~A 194 96.87 68.71 144.85 96.44 68.41 145.70 99.16 69.38 144.25 99.69 69.81 143.23 97.80 69.83 144.75 97.90 70.52 146.10 2 0 16.21-999 ?-999 ?-999 ? CA CA A1131 mVAL~A 195 99.76 68.43 144.98 99.24 68.08 145.76 101.10 67.39 143.22 101.93 67.73 142.37 101.11 68.00 144.60 101.71 67.03 145.63 3 0 16.42-999 ?-999 ?-999 ? CA CA A1131 mLEU~A 196 100.13 66.49 142.95 99.43 66.36 143.65 99.90 66.71 140.49 100.22 66.35 139.36 100.18 65.80 141.67 99.29 64.57 141.62 3 0 16.97-999 ?-999 ?-999 ? CA CA A1131 mALA~A 197 99.32 67.90 140.71 99.16 68.13 141.66 100.04 69.81 139.23 100.11 70.21 138.06 98.99 68.76 139.57 97.65 69.46 139.85 2 0 19.66-999 ?-999 ?-999 ? CA CA A1131 mTHR~A 198 100.80 70.29 140.20 100.71 69.79 141.06 103.17 71.11 140.04 103.95 71.91 139.50 101.68 71.43 140.04 101.46 72.49 141.15 2 0 21.78-999 ?-999 ?-999 ? CA CA A1131 mARG~A 199 103.58 70.02 140.69 102.86 69.49 141.13 105.48 69.25 139.33 104.75 68.66 138.54 105.00 69.66 140.72 105.26 68.50 141.70 2 0 21.89-999 ?-999 ?-999 ? CA CA A1131 mSER~A 200 106.75 69.51 139.01 107.30 70.03 139.68 107.35 67.50 137.74 107.47 66.89 138.80 107.22 69.02 137.71 108.55 69.67 137.34 2 0 24.88-999 ?-999 ?-999 ? CA CA A1131 mTYR~A 201 107.33 66.89 136.57 107.21 67.51 135.79 108.75 64.94 137.05 108.70 64.00 137.85 107.45 65.44 136.43 107.36 65.04 134.96 3 0 24.66-999 ?-999 ?-999 ? CA CA A1131 mPRO~A 202 109.90 65.54 136.76 109.85 66.27 136.08 110.98 65.21 138.94 111.29 64.26 139.67 111.12 65.09 137.44 112.21 66.01 136.90 3 0 26.18-999 ?-999 ?-999 ? CA CA A1131 mGLN~A 203 110.46 66.32 139.47 110.21 67.04 138.82 109.30 65.36 141.43 109.40 64.87 142.55 110.30 66.39 140.92 109.90 67.78 141.40 2 0 23.76-999 ?-999 ?-999 ? CA CA A1131 mLEU~A 204 108.28 65.07 140.62 108.26 65.55 139.75 107.92 62.72 141.16 107.71 61.97 142.11 107.27 64.09 141.07 106.11 64.05 140.08 3 0 20.82-999 ?-999 ?-999 ? CA CA A1131 mHIS~A 205 108.75 62.41 140.17 108.81 63.08 139.43 110.28 61.01 141.54 110.28 59.94 142.16 109.49 61.15 140.24 110.42 61.06 139.03 3 0 22.37-999 ?-999 ?-999 ? CA CA A1131 mGLN~A 206 110.91 62.08 142.00 110.81 62.87 141.39 110.76 62.01 144.46 111.11 61.46 145.51 111.67 62.12 143.24 112.46 63.43 143.31 2 0 22.42-999 ?-999 ?-999 ? CA CA A1131 mILE~A 207 109.57 62.59 144.33 109.41 63.06 143.47 108.11 61.09 145.61 107.93 60.59 146.73 108.61 62.51 145.43 107.43 63.49 145.18 3 0 18.81-999 ?-999 ?-999 ? CA CA A1131 mPHE~A 208 107.90 60.37 144.51 108.07 60.84 143.64 108.58 58.14 145.26 108.33 57.38 146.19 107.47 58.97 144.64 107.01 58.41 143.30 3 0 17.85-999 ?-999 ?-999 ? CA CA A1131 mHIS~A 209 109.82 58.35 144.82 109.89 59.01 144.06 110.97 57.91 146.93 111.20 57.00 147.72 110.95 57.66 145.43 112.29 58.10 144.83 3 0 20.38-999 ?-999 ?-999 ? CA CA A1131 mGLU~A 210 110.70 59.15 147.31 110.49 59.78 146.57 109.58 58.87 149.51 109.72 58.55 150.70 110.72 59.50 148.73 110.68 61.03 148.84 2 0 18.83-999 ?-999 ?-999 ? CA CA A1131 mTYR~A 211 108.43 58.71 148.87 108.44 58.95 147.90 107.52 56.76 150.06 107.26 56.42 151.21 107.26 58.20 149.58 106.04 58.22 148.66 3 0 15.26-999 ?-999 ?-999 ? CA CA A1131 mSER~A 212 108.03 55.95 149.14 108.21 56.40 148.27 109.31 54.31 150.50 109.39 53.20 151.04 108.29 54.54 149.39 108.72 53.85 148.09 2 0 16.72-999 ?-999 ?-999 ? CA CA A1131 mLYS~A 213 110.05 55.36 150.85 109.89 56.16 150.27 110.29 55.57 153.30 110.72 54.96 154.27 110.98 55.37 151.96 111.98 56.51 151.80 2 0 18.45-999 ?-999 ?-999 ? CA CA A1131 mILE~A 214 109.33 56.49 153.38 109.07 56.92 152.52 107.50 55.96 154.94 106.92 56.04 156.02 108.75 56.80 154.68 108.35 58.28 154.82 3 0 15.78-999 ?-999 ?-999 ? CA CA A1131 mSER~A 215 107.10 55.18 153.95 107.67 55.22 153.12 106.22 52.91 153.71 107.19 52.62 153.01 105.92 54.35 154.10 104.79 54.93 153.23 2 0 13.50-999 ?-999 ?-999 ? CA CA A1131 mASN.A 216 105.35 52.01 154.15 104.65 52.35 154.77 104.69 50.40 152.45 104.83 49.38 151.77 105.47 50.62 153.73 105.06 49.67 154.85 2 0 14.69-999 ?-999 ?-999 ? CA CA A1131 mLYS.A 217 103.90 51.42 152.07 103.84 52.18 152.71 103.89 52.24 149.75 104.54 53.22 150.11 103.21 51.35 150.79 101.76 51.83 150.94 2 0 13.07-999 ?-999 ?-999 ? CA CA A1131 mTHR~A 218 103.72 51.90 148.48 103.28 51.00 148.35 103.03 53.80 147.14 101.89 53.59 147.55 104.13 52.76 147.38 104.37 51.97 146.09 2 0 14.63-999 ?-999 ?-999 ? CA CA A1131 mILE~A 219 103.38 54.90 146.49 104.32 54.95 146.17 101.19 55.38 145.49 100.04 55.78 145.65 102.36 55.94 146.29 102.90 57.20 145.60 3 0 13.06-999 ?-999 ?-999 ? CA CA A1131 mLEU~A 220 101.50 54.42 144.62 102.48 54.19 144.59 99.44 53.08 144.69 98.23 53.24 144.56 100.47 53.79 143.80 101.16 52.78 142.88 3 0 14.29-999 ?-999 ?-999 ? CA CA A1131 mGLN~A 221 99.97 52.27 145.61 100.97 52.26 145.60 98.42 52.36 147.51 97.31 52.03 147.93 99.19 51.48 146.53 100.10 50.54 147.33 2 0 12.60-999 ?-999 ?-999 ? CA CA A1131 mALA~A 222 99.04 53.46 147.94 99.96 53.62 147.58 97.07 54.91 148.20 95.97 54.87 148.74 98.32 54.33 148.88 99.23 55.44 149.37 2 0 9.11-999 ?-999 ?-999 ? CA CA A1131 mILE~A 223 97.26 55.43 146.99 98.21 55.40 146.68 95.10 54.91 145.97 93.91 55.16 146.23 96.16 55.98 146.21 96.69 56.56 144.88 3 0 9.75-999 ?-999 ?-999 ? CA CA A1131 mGLU~A 224 95.52 53.73 145.54 96.50 53.68 145.36 93.77 52.40 146.63 92.58 52.10 146.59 94.61 52.60 145.37 95.38 51.31 145.11 2 0 11.44-999 ?-999 ?-999 ? CA CA A1131 mASN~A 225 94.44 52.60 147.76 95.36 52.97 147.63 92.98 53.44 149.58 91.99 53.14 150.24 93.88 52.33 149.07 95.00 52.06 150.08 2 0 8.58-999 ?-999 ?-999 ? CA CA A1131 mGLU~A 226 93.37 54.68 149.30 94.17 54.71 148.71 91.46 56.26 149.03 90.57 56.89 149.59 92.72 55.88 149.79 93.69 57.07 149.74 2 0 -5.89-999 ?-999 ?-999 ? CA CA A1131smPHE~A 227 91.40 55.96 147.74 92.12 55.34 147.43 89.67 55.41 146.08 90.18 54.29 145.98 90.36 56.50 146.88 90.99 57.46 145.85 3 0 8.88-999 ?-999 ?-999 ? CA CA A1131 mSER~A 228 88.59 55.82 145.44 88.30 56.76 145.61 87.44 55.62 143.29 87.41 56.85 143.29 87.91 54.89 144.54 86.75 54.20 145.26 2 0 12.28-999 ?-999 ?-999 ? CA CA A1131 mGLY~A 229 87.12 54.84 142.27 87.35 53.88 142.42 87.33 56.20 140.19 88.51 55.94 139.97 86.49 55.30 141.05-999.99-999.99-999.99 1 0 15.84-999 ?-999 ?-999 ? CA CA A1131 mASP~A 230 86.72 57.25 139.66 85.77 57.32 139.95 88.51 58.95 139.32 89.59 59.04 138.73 87.33 58.19 138.74 86.24 59.19 138.29 2 0 13.99-999 ?-999 ?-999 ? CA CA A1121 mILE~A 231 88.35 59.61 140.46 87.44 59.53 140.87 90.63 59.45 141.38 91.79 59.88 141.39 89.45 60.37 141.04 89.00 61.07 142.34 3 0 14.69-999 ?-999 ?-999 ? CA CA A1131 mLYS~A 232 90.33 58.19 141.71 89.36 57.95 141.73 92.19 57.01 140.71 93.42 57.08 140.64 91.44 57.28 142.00 90.93 55.98 142.62 2 0 13.28-999 ?-999 ?-999 ? CA CA A1131 mASN~A 233 91.45 56.73 139.64 90.46 56.73 139.79 92.87 57.66 137.83 93.88 57.53 137.13 92.11 56.46 138.37 91.05 56.00 137.35 2 0 16.91-999 ?-999 ?-999 ? CA CA A1131 mGLY~A 234 92.39 58.87 138.10 91.58 58.88 138.68 94.39 60.27 138.26 95.41 60.51 137.61 93.05 60.05 137.59-999.99-999.99-999.99 1 0 17.49-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 235 94.38 60.21 139.59 93.49 60.04 140.02 96.61 59.28 139.95 97.81 59.53 139.86 95.64 60.40 140.32 95.41 60.43 141.82 3 0 15.19-999 ?-999 ?-999 ? CA CA A1131 mLEU~A 236 96.08 58.07 139.73 95.09 58.03 139.87 97.53 57.20 137.97 98.70 56.92 137.71 96.89 56.93 139.33 96.04 55.66 139.21 3 0 16.33-999 ?-999 ?-999 ? CA CA A1131 mALA~A 237 96.71 57.70 137.05 95.77 57.85 137.37 98.35 58.97 135.75 99.36 58.83 135.05 97.19 57.98 135.71 96.05 58.54 134.86 2 0 19.87-999 ?-999 ?-999 ? CA CA A1131 mILE~A 238 98.23 60.00 136.59 97.40 60.04 137.15 100.61 60.28 137.10 101.66 60.43 136.48 99.34 60.96 136.60 99.03 62.21 137.42 3 0 19.76-999 ?-999 ?-999 ? CA CA A1131 mVAL~A 239 100.52 59.51 138.18 99.62 59.44 138.59 102.31 57.93 137.57 103.52 57.89 137.32 101.73 58.83 138.65 101.46 57.99 139.92 3 0 18.64-999 ?-999 ?-999 ? CA CA A1131 mLYS~A 240 101.45 57.19 136.87 100.49 57.28 137.12 102.52 57.08 134.64 103.48 56.62 134.02 101.94 56.31 135.82 100.85 55.37 135.32 2 0 21.37-999 ?-999 ?-999 ? CA CA A1131 mSER~A 241 101.93 58.21 134.29 101.12 58.45 134.83 103.85 59.55 133.55 104.68 59.83 132.68 102.47 59.01 133.19 101.57 60.22 132.90 2 0 23.90-999 ?-999 ?-999 ? CA CA A1131 mVAL~A 242 104.06 59.78 134.84 103.30 59.58 135.46 106.42 59.17 135.13 107.36 59.27 134.34 105.38 60.29 135.24 105.38 60.85 136.67 3 0 23.49-999 ?-999 ?-999 ? CA CA A1131 mGLU~A 243 106.21 58.10 135.89 105.36 58.13 136.42 107.43 56.46 134.52 108.61 56.40 134.13 107.15 56.99 135.92 106.64 55.87 136.83 2 0 23.88-999 ?-999 ?-999 ? CA CA A1131 mASN~A 244 106.40 56.14 133.74 105.50 56.26 134.15 105.43 55.86 131.46 104.57 54.98 131.35 106.63 55.66 132.38 107.02 54.18 132.38 2 0 26.64-999 ?-999 ?-999 ? CA CA A1131 mARG~A 245 105.39 56.99 130.76 106.16 57.61 130.93 104.13 56.13 128.84 103.01 55.75 128.48 104.31 57.28 129.82 104.58 58.57 129.04 2 0 27.32-999 ?-999 ?-999 ? CA CA A1121 mPHE~A 246 105.25 55.56 128.42 106.09 55.97 128.79 104.41 53.29 128.06 103.56 52.72 127.37 105.23 54.44 127.49 106.66 54.00 127.18 3 0 28.98-999 ?-999 ?-999 ? CA CA E1125 mALA~A 247 104.62 52.96 129.33 105.30 53.52 129.81 102.39 52.20 130.03 101.54 51.36 129.76 103.87 51.85 129.93 104.47 51.46 131.27 2 0 28.19-999 ?-999 ?-999 ? CA CA A1131 mTYR~A 248 102.09 53.46 130.35 102.88 54.06 130.49 99.92 53.68 129.19 98.85 53.07 129.18 100.71 53.91 130.47 100.63 55.39 130.89 3 0 24.87-999 ?-999 ?-999 ? CA CA A1121 mPHE~A 249 100.40 54.18 128.05 101.26 54.69 128.11 99.59 52.45 126.50 98.56 51.94 126.06 99.62 53.94 126.84 100.18 54.77 125.69 3 0 24.05-999 ?-999 ?-999 ? CA CA A1121 mALA~A 250 100.70 51.75 126.74 101.45 52.29 127.12 99.66 49.55 127.14 98.84 48.90 126.49 100.79 50.32 126.47 102.15 49.79 126.93 2 0 26.71-999 ?-999 ?-999 ? CA CA A1121 mGLU~A 251 99.59 49.72 128.45 100.37 50.22 128.82 97.14 49.61 128.71 96.22 48.79 128.64 98.50 49.22 129.28 98.65 49.82 130.68 2 0 25.10-999 ?-999 ?-999 ? CA CA A1121 mARG~A 252 96.98 50.88 128.34 97.77 51.49 128.45 95.41 50.46 126.54 94.34 49.85 126.42 95.67 51.27 127.81 95.58 52.76 127.50 2 0 21.71-999 ?-999 ?-999 ? CA CA A1121 mLEU~A 253 96.39 50.40 125.66 97.20 50.93 125.90 95.82 48.17 124.75 94.81 47.72 124.21 96.27 49.60 124.44 97.60 49.56 123.68 3 0 23.26-999 ?-999 ?-999 ? CA CA E1125 mHIS~A 254 96.56 47.51 125.63 97.32 48.03 125.99 94.81 46.00 126.48 93.99 45.29 125.91 96.25 46.13 126.01 97.20 45.68 127.12 3 0 25.54-999 ?-999 ?-999 ? CA CA A1121 mHIS~A 255 94.50 46.78 127.52 95.25 47.35 127.86 92.09 47.00 127.04 91.07 46.31 127.09 93.17 46.78 128.10 93.04 47.86 129.18 3 0 22.65-999 ?-999 ?-999 ? CA CA A1121 mALA~A 256 92.34 47.95 126.15 93.22 48.40 126.29 91.11 47.13 124.18 90.01 47.07 123.64 91.43 48.32 125.07 92.04 49.41 124.20 2 0 20.84-999 ?-999 ?-999 ? CA CA A1121 mMET~A 257 92.11 46.28 124.00 92.94 46.55 124.49 91.76 43.85 124.07 91.61 42.74 123.55 92.04 45.08 123.20 93.35 44.87 122.43 2 0 23.71-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 258 91.71 44.04 125.38 91.87 44.98 125.68 90.18 42.19 125.89 89.42 42.64 125.01 91.44 42.93 126.28 91.33 43.40 127.74 2 0 24.76-999 ?-999 ?-999 ? CA CA A1121 mGLY.A 259 89.96 41.04 126.54 90.69 40.81 127.18 88.15 40.24 125.00 88.77 40.62 124.01 88.80 40.20 126.36-999.99-999.99-999.99 1 0 25.78-999 ?-999 ?-999 ? CA CA A1121 mLEU.A 260 86.88 39.85 124.94 86.50 39.62 125.84 85.35 41.04 123.42 84.13 41.11 123.58 86.11 39.75 123.70 85.14 38.56 123.76 3 0 25.66-999 ?-999 ?-999 ? CA CA A1121 mGLY.A 261 86.11 42.05 123.00 87.09 41.82 122.97 86.65 44.44 122.69 87.21 44.69 123.76 85.60 43.34 122.62-999.99-999.99-999.99 1 0 22.57-999 ?-999 ?-999 ? CA CA A1121 mTHR.A 262 86.91 45.09 121.56 86.38 44.80 120.77 87.28 47.52 121.79 86.47 47.99 120.99 87.90 46.16 121.54 88.61 46.24 120.17 2 0 20.61-999 ?-999 ?-999 ? CA CA E1125 mSER~A 263 87.68 48.21 122.87 88.23 47.73 123.56 88.02 50.29 121.74 89.18 50.66 121.87 87.27 49.62 122.89 87.57 50.33 124.20 2 0 18.06-999 ?-999 ?-999 ? CA CA A1121 mASP~A 264 87.38 50.26 120.58 86.43 49.96 120.64 88.38 52.12 119.30 89.36 52.54 118.68 88.03 50.65 119.33 87.11 50.25 118.16 2 0 15.96-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 265 87.56 52.95 119.96 86.77 52.55 120.42 89.16 54.61 120.78 90.03 55.39 120.40 87.92 54.37 119.93 86.76 55.26 120.32 2 0 13.20-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 266 89.29 53.90 121.90 88.51 53.31 122.11 91.72 53.57 121.92 92.75 54.25 121.91 90.50 54.01 122.72 90.37 53.17 124.00 2 0 16.21-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 267 91.58 52.44 121.24 90.70 51.99 121.39 92.92 52.89 119.22 94.07 53.24 118.96 92.61 51.91 120.35 92.17 50.58 119.76 3 0 17.71-999 ?-999 ?-999 ? CA CA E1125 mILE~A 268 91.88 53.34 118.51 91.00 52.96 118.77 92.69 55.60 117.96 93.61 56.18 117.37 92.07 54.31 117.43 90.72 54.70 116.78 3 0 14.78-999 ?-999 ?-999 ? CA CA E1125 mARG~A 269 92.21 56.03 119.12 91.52 55.45 119.56 94.18 57.28 119.97 94.89 58.24 119.66 92.69 57.29 119.66 91.89 57.71 120.90 2 0 14.29-999 ?-999 ?-999 ? CA CA E1125 mILE~A 270 94.68 56.21 120.61 94.01 55.49 120.80 97.01 55.76 119.85 98.13 56.28 119.76 96.08 56.14 120.99 96.30 55.20 122.19 3 0 18.03-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 271 96.58 54.92 118.92 95.68 54.52 119.10 97.52 55.86 116.87 98.54 56.16 116.25 97.39 54.62 117.74 96.73 53.50 116.92 3 0 18.80-999 ?-999 ?-999 ? CA CA E1125 mVAL~A 272 96.42 56.63 116.76 95.61 56.34 117.28 97.28 58.95 116.52 98.08 59.58 115.83 96.49 57.81 115.90 95.08 58.31 115.53 3 0 16.24-999 ?-999 ?-999 ? CA CA E1125 mSER~A 273 97.02 59.27 117.78 96.42 58.62 118.25 99.04 60.32 118.77 99.76 61.30 119.02 97.58 60.47 118.39 96.74 60.87 119.60 2 0 16.98-999 ?-999 ?-999 ? CA CA E1125 mARG~A 274 99.54 59.09 118.83 98.90 58.36 118.59 101.76 58.53 117.98 102.99 58.55 118.04 100.94 58.88 119.22 101.05 57.74 120.24 2 0 20.71-999 ?-999 ?-999 ? CA CA E1125 mSER~A 275 101.06 58.22 116.91 100.08 58.38 117.03 102.86 58.46 115.25 103.77 57.86 114.67 101.61 57.71 115.67 100.58 57.74 114.54 2 0 21.01-999 ?-999 ?-999 ? CA CA E1125 mGLU.A 276 102.92 59.76 115.50 102.14 60.17 115.99 104.84 61.11 116.24 105.42 62.19 116.10 104.12 60.48 115.06 103.77 61.55 114.02 2 0 22.75-999 ?-999 ?-999 ? CA CA E1125 mILE.A 277 104.79 60.45 117.40 104.27 59.60 117.37 106.24 59.87 119.30 107.47 59.87 119.28 105.45 60.96 118.59 104.47 61.62 119.58 3 0 24.46-999 ?-999 ?-999 ? CA CA E1125 mASP~A 278 105.56 58.91 119.92 104.57 58.99 119.88 105.69 56.46 120.31 105.82 55.54 121.10 106.28 57.83 120.60 106.33 58.06 122.10 2 0 26.31-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 279 105.04 56.28 119.16 105.01 57.05 118.52 105.50 53.88 118.87 105.25 52.74 119.27 104.44 54.97 118.94 103.50 54.94 117.74 3 0 25.08-999 ?-999 ?-999 ? CA CA E1125 mALA~A 280 106.70 54.24 118.43 106.77 55.20 118.14 108.16 52.79 119.78 108.21 51.58 120.03 107.81 53.30 118.39 109.04 53.94 117.75 2 0 28.66-999 ?-999 ?-999 ? CA CA E1125 mASN~A 281 108.41 53.72 120.70 108.34 54.66 120.38 107.64 52.58 122.76 107.86 51.74 123.62 108.76 53.33 122.06 109.13 54.59 122.86 2 0 30.33-999 ?-999 ?-999 ? CA CA E1125 mILE~A 282 106.40 52.91 122.39 106.34 53.60 121.67 105.12 50.80 122.61 104.77 49.96 123.44 105.25 52.26 123.02 103.96 53.03 122.69 3 0 28.00-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 283 105.34 50.50 121.34 105.52 51.30 120.76 106.44 48.32 121.52 106.29 47.14 121.83 105.33 49.13 120.85 105.54 49.11 119.33 2 0 28.91-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 284 107.58 48.97 121.75 107.58 49.93 121.46 108.29 47.84 123.79 108.37 46.66 124.14 108.71 48.30 122.40 109.93 49.21 122.46 2 0 32.51-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 285 107.77 48.79 124.55 107.79 49.69 124.12 106.07 47.58 125.85 105.90 46.74 126.73 107.24 48.55 125.89 106.81 49.90 126.50 2 0 32.33-999 ?-999 ?-999 ? CA CA E1125 mPHE~A 286 105.24 47.65 124.82 105.42 48.38 124.16 104.66 45.27 124.69 104.14 44.44 125.44 104.14 46.71 124.70 103.27 46.96 123.46 3 0 30.49-999 ?-999 ?-999 ? CA CA E1125 mGLN~A 287 105.68 45.00 123.88 106.00 45.78 123.34 106.76 43.21 125.18 106.41 42.14 125.67 106.25 43.66 123.81 107.39 43.56 122.79 2 0 33.55-999 ?-999 ?-999 ? CA CA E1125 mALA~A 288 107.56 44.07 125.80 107.74 44.91 125.30 107.05 43.36 128.13 107.26 42.42 128.89 108.11 43.76 127.12 108.91 44.95 127.64 2 0 34.99-999 ?-999 ?-999 ? CA CA A1131 mMET~A 289 105.90 44.05 128.18 105.78 44.75 127.47 104.05 42.56 128.95 103.49 41.99 129.90 104.93 43.77 129.23 104.03 44.97 129.52 2 0 32.01-999 ?-999 ?-999 ? CA CA A1131 mTYR~A 290 103.81 42.19 127.69 104.35 42.65 126.98 103.26 40.07 126.52 102.46 39.22 126.12 102.79 41.17 127.46 101.51 41.81 126.92 3 0 33.50-999 ?-999 ?-999 ? CA CA A1121 mGLY~A 291 104.54 40.08 126.16 105.05 40.87 126.51 104.74 39.02 123.90 105.36 38.35 123.07 105.15 39.05 125.36-999.99-999.99-999.99 1 0 36.29-999 ?-999 ?-999 ? CA CA E1125 mLYS.A 292 103.67 39.73 123.54 103.22 40.22 124.29 103.53 41.12 121.55 103.57 42.11 122.29 103.24 39.74 122.14 101.75 39.44 122.08 2 0 33.63-999 ?-999 ?-999 ? CA CA E1125 mSER~A 293 103.78 41.25 120.25 103.84 40.41 119.72 102.58 43.31 119.65 101.52 42.69 119.57 103.93 42.60 119.71 104.56 42.55 118.32 2 0 31.54-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 294 102.59 44.63 119.67 103.48 45.06 119.80 100.67 44.97 118.20 99.47 44.72 118.14 101.33 45.36 119.52 101.58 46.86 119.60 3 0 27.79-999 ?-999 ?-999 ? CA CA E1125 mTYR~A 295 101.49 44.87 117.15 102.44 45.10 117.36 100.15 43.23 115.87 99.05 43.21 115.32 101.03 44.47 115.83 102.23 44.20 114.93 3 0 27.66-999 ?-999 ?-999 ? CA CA E1125 mGLU~A 296 100.64 42.17 116.50 101.52 42.32 116.96 98.63 40.99 117.30 97.61 40.40 116.95 99.93 40.89 116.52 100.81 39.77 117.08 2 0 29.68-999 ?-999 ?-999 ? CA CA E1125 mPHE~A 297 98.68 41.75 118.39 99.58 42.14 118.60 96.42 42.67 118.32 95.26 42.25 118.22 97.47 41.98 119.18 97.82 42.83 120.40 3 0 27.76-999 ?-999 ?-999 ? CA CA E1125 mILE~A 298 96.82 43.73 117.63 97.78 44.00 117.76 95.32 43.53 115.66 94.10 43.51 115.47 95.90 44.43 116.75 96.57 45.64 116.07 3 0 24.48-999 ?-999 ?-999 ? CA CA E1125 mALA~A 299 96.19 42.84 114.93 97.14 42.97 115.22 94.92 40.83 114.28 94.08 40.31 113.54 95.81 41.97 113.82 97.05 41.40 113.14 2 0 26.26-999 ?-999 ?-999 ? CA CA E1125 mASP~A 300 95.13 40.38 115.51 95.86 40.84 116.01 92.97 39.83 116.53 91.96 39.13 116.51 94.31 39.29 116.03 95.06 38.57 117.15 2 0 27.96-999 ?-999 ?-999 ? CA CA E1125 mASP~A 301 92.96 41.09 116.94 93.83 41.57 116.82 90.89 42.45 116.54 89.73 42.76 116.85 91.77 41.70 117.52 92.22 42.63 118.66 2 0 24.90-999 ?-999 ?-999 ? CA CA E1125 mCYH~A 302 91.38 42.79 115.35 92.29 42.45 115.14 90.42 43.00 113.09 91.18 42.12 112.71 90.56 43.62 114.47 91.18 45.03 114.32 2 0 22.35-999 ?-999 ?-999 ? CA CA E1125 mSER~A 303 89.48 43.53 112.30 88.96 44.30 112.67 89.16 43.98 109.86 88.92 45.17 110.06 89.26 42.96 110.98 87.98 42.11 110.99 2 0 22.63-999 ?-999 ?-999 ? CA CA E1125 mGLY~A 304 89.29 43.41 108.66 89.54 42.45 108.73 89.94 45.30 107.19 91.07 45.41 107.67 89.13 44.04 107.38-999.99-999.99-999.99 1 0 22.30-999 ?-999 ?-999 ? CA CA E1125 mASP~A 305 89.34 46.24 106.46 88.43 45.98 106.14 90.43 48.21 107.42 91.55 48.71 107.54 89.98 47.51 106.15 89.00 48.36 105.32 2 0 19.99-999 ?-999 ?-999 ? CA CA E1125 mTYR~A 306 89.57 48.17 108.43 88.68 47.75 108.22 91.24 48.10 110.25 92.11 48.82 110.75 89.93 48.69 109.74 88.82 48.34 110.73 3 0 17.91-999 ?-999 ?-999 ? CA CA E1125 mLYS~A 307 91.36 46.78 110.18 90.56 46.31 109.79 93.78 46.46 109.80 94.86 46.75 110.32 92.56 46.09 110.63 92.35 44.57 110.58 2 0 21.26-999 ?-999 ?-999 ? CA CA E1125 mASP~A 308 93.61 46.45 108.48 92.70 46.15 108.19 95.21 48.24 107.90 96.43 48.42 107.95 94.67 46.85 107.56 94.15 46.83 106.12 2 0 22.42-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 309 94.34 49.22 108.13 93.39 48.93 108.11 95.56 50.70 109.67 96.66 51.24 109.74 94.78 50.59 108.38 93.57 51.52 108.39 3 0 19.53-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 310 95.02 50.13 110.74 94.14 49.68 110.58 97.09 49.55 111.94 98.06 50.05 112.52 95.70 50.18 112.03 94.86 49.41 113.06 3 0 19.82-999 ?-999 ?-999 ? CA CA E1125 mLEU~A 311 97.14 48.42 111.25 96.27 48.16 110.84 99.43 48.41 110.32 100.60 48.40 110.71 98.36 47.64 111.10 98.06 46.32 110.39 3 0 23.57-999 ?-999 ?-999 ? CA CA E1125 mGLN~A 312 98.97 49.06 109.25 97.99 48.95 109.09 100.29 51.12 109.08 101.44 51.53 108.89 99.83 49.85 108.39 99.15 50.19 107.06 2 0 23.65-999 ?-999 ?-999 ? CA CA E1125 mILE~A 313 99.46 51.74 109.93 98.55 51.34 110.04 100.94 52.53 111.70 101.88 53.24 112.05 99.96 52.94 110.60 98.94 53.90 111.20 3 0 21.61-999 ?-999 ?-999 ? CA CA E1125 mTHR~A 314 100.68 51.36 112.30 99.93 50.83 111.92 102.83 50.33 112.97 103.86 50.51 113.61 101.51 50.94 113.43 100.75 49.92 114.29 2 0 23.78-999 ?-999 ?-999 ? CA CA E1125 mGLY~A 315 102.78 49.58 111.88 101.87 49.54 111.46 104.25 47.65 112.17 103.76 47.50 113.29 103.93 48.88 111.34-999.99-999.99-999.99 1 0 27.04-999 ?-999 ?-999 ? CA CA E1125 mHIS.A 316 105.06 46.74 111.63 105.38 46.94 110.70 106.31 45.91 113.58 106.10 45.31 114.65 105.44 45.54 112.38 106.18 44.54 111.49 3 0 30.16-999 ?-999 ?-999 ? CA CA E1125 mVAL.B 2 101.75 100.10 82.76 101.88 100.08 81.77 100.08 99.93 84.57 99.18 100.50 83.94 101.55 100.13 84.20 102.03 101.46 84.81 3 0 35.64-999 ?-999 ?-999 ? CA CA D1124 mVAL.B 3 99.84 99.14 85.61 100.64 98.72 86.03 98.21 99.72 87.33 99.00 99.73 88.27 98.46 98.93 86.06 98.11 97.45 86.20 3 0 32.01-999 ?-999 ?-999 ? CA CA D1124 mGLN.B 4 97.11 100.47 87.33 96.52 100.37 86.53 95.35 101.82 88.42 94.64 101.71 87.42 96.81 101.38 88.44 97.70 102.63 88.27 2 0 29.44-999 ?-999 ?-999 ? CA CA D1124 mGLY.B 5 94.88 102.34 89.55 95.53 102.37 90.31 93.40 104.28 89.26 94.33 104.85 88.67 93.50 102.81 89.63-999.99-999.99-999.99 1 0 26.29-999 ?-999 ?-999 ? CA CA D1124 mTHR.B 6 92.28 104.93 89.60 91.62 104.39 90.12 92.04 107.25 90.40 92.13 108.47 90.25 92.08 106.32 89.20 90.75 106.45 88.43 2 0 26.32-999 ?-999 ?-999 ? CA CA D1124 mVAL.B 7 91.85 106.70 91.60 91.78 105.71 91.63 93.09 107.59 93.49 93.64 106.54 93.80 91.75 107.58 92.77 90.65 107.14 93.74 3 0 24.51-999 ?-999 ?-999 ? CA CA D1124 mLYS.B 8 93.62 108.78 93.76 93.07 109.57 93.46 94.75 109.60 95.76 93.81 110.38 95.91 94.91 108.87 94.43 95.94 109.60 93.56 2 0 26.78-999 ?-999 ?-999 ? CA CA D1124 mPRO.B 9 95.71 109.41 96.66 96.42 108.76 96.40 95.62 111.65 97.62 96.40 112.10 96.78 95.66 110.15 97.92 96.97 109.79 98.61 3 0 26.76-999 ?-999 ?-999 ? CA CA D1124 mHIS.B 10 94.76 112.35 98.35 94.17 111.80 98.93 95.89 114.45 98.97 96.31 114.07 100.06 94.71 113.81 98.26 93.40 114.33 98.88 3 0 27.74-999 ?-999 ?-999 ? CA CA D1124 mALA.B 11 96.44 115.49 98.34 96.00 115.73 97.47 97.20 117.07 100.08 96.10 117.60 100.12 97.59 116.20 98.88 98.23 117.06 97.80 2 0 31.23-999 ?-999 ?-999 ? CA CA D1124 mSER.B 12 98.15 117.23 100.99 98.98 116.70 100.82 96.68 117.70 102.85 95.71 118.45 102.94 97.96 118.12 102.14 97.86 119.57 101.67 2 0 32.19-999 ?-999 ?-999 ? CA CA D1124 mPHE.B 13 96.63 116.40 103.16 97.49 115.90 103.00 95.21 116.22 105.13 96.14 116.18 105.94 95.41 115.81 103.69 95.51 114.28 103.62 3 0 28.65-999 ?-999 ?-999 ? CA CA D1124 mASN~B 14 93.98 116.62 105.46 93.35 116.69 104.69 92.31 116.28 107.17 91.27 116.79 106.72 93.66 116.91 106.86 93.60 118.43 107.08 2 0 28.02-999 ?-999 ?-999 ? CA CA D1124 mSER~B 15 92.34 115.12 107.83 93.23 114.84 108.17 90.14 115.15 108.91 88.94 115.09 108.73 91.09 114.37 108.01 91.37 112.98 108.58 2 0 24.53-999 ?-999 ?-999 ? CA CA D1124 mARG~B 16 90.69 115.84 109.91 91.69 115.79 109.96 89.02 117.63 110.06 87.84 117.88 110.31 89.85 116.61 110.83 90.73 117.31 111.87 2 0 24.91-999 ?-999 ?-999 ? CA CA C1133 mGLU~B 17 89.67 118.25 109.07 90.60 117.92 108.95 88.02 118.71 107.32 86.96 119.29 107.10 89.07 119.29 108.26 90.23 119.90 107.48 2 0 24.64-999 ?-999 ?-999 ? CA CA C1133 mASP~B 18 88.35 117.57 106.72 89.25 117.20 106.96 86.14 116.54 106.53 85.06 116.65 105.95 87.41 116.94 105.79 88.05 115.75 105.08 2 0 23.72-999 ?-999 ?-999 ? CA CA D1124 mALA~B 19 86.27 116.10 107.78 87.22 116.08 108.11 84.25 116.89 108.93 83.03 116.83 108.83 85.14 115.70 108.60 85.60 115.02 109.89 2 0 21.63-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 20 84.88 118.02 109.27 85.87 117.96 109.36 83.40 119.65 108.20 82.25 120.10 108.20 84.09 119.24 109.49 85.00 120.34 110.02 2 0 21.06-999 ?-999 ?-999 ? CA CA C1133 mTHR~B 21 84.06 119.43 107.07 84.95 118.98 107.18 82.21 119.04 105.54 81.18 119.56 105.13 83.49 119.83 105.78 84.47 119.61 104.63 2 0 23.30-999 ?-999 ?-999 ? CA CA C1133 mLEU~B 22 82.31 117.74 105.83 83.20 117.44 106.18 80.06 117.23 106.60 78.90 117.22 106.20 81.18 116.85 105.63 81.62 115.39 105.87 3 0 20.39-999 ?-999 ?-999 ? CA CA D1124 mARG~B 23 80.41 117.57 107.84 81.39 117.52 108.01 78.61 119.17 108.29 77.38 119.19 108.29 79.41 117.97 108.83 80.11 118.30 110.14 2 0 20.45-999 ?-999 ?-999 ? CA CA C1133 mLYS~B 24 79.39 120.13 107.83 80.36 119.92 107.89 77.91 121.14 106.14 76.88 121.79 106.04 78.86 121.38 107.30 79.98 122.32 106.86 2 0 19.79-999 ?-999 ?-999 ? CA CA C1133 mALA~B 25 78.22 120.18 105.26 79.11 119.74 105.41 76.02 119.21 104.65 75.05 119.14 103.87 77.32 119.83 104.19 78.01 118.89 103.20 2 0 22.08-999 ?-999 ?-999 ? CA CA D1124 mMET~B 26 75.95 118.64 105.86 76.77 118.70 106.44 73.84 118.76 107.21 72.65 118.49 107.36 74.69 117.98 106.21 74.97 116.58 106.78 2 0 19.85-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 27 74.42 119.67 107.99 75.37 119.88 107.76 72.67 121.34 108.60 72.97 122.18 107.77 73.67 120.29 109.08 74.63 120.89 110.12 2 0 17.97-999 ?-999 ?-999 ? CA CA D1134 mGLY.B 28 71.47 121.28 109.18 71.36 120.52 109.81 69.59 121.96 107.68 69.68 120.89 107.06 70.42 122.24 108.92-999.99-999.99-999.99 1 0 14.37-999 ?-999 ?-999 ? CA CA D1134 mILE.B 29 68.75 122.92 107.32 68.72 123.73 107.91 68.86 122.55 104.90 69.76 123.34 104.63 67.94 122.75 106.11 66.99 123.93 105.85 3 0 12.76-999 ?-999 ?-999 ? CA CA D1134 mGLY.B 30 68.57 121.46 104.21 67.85 120.90 104.61 70.44 120.19 103.17 70.94 119.97 104.28 69.25 121.11 102.98-999.99-999.99-999.99 1 0 15.77-999 ?-999 ?-999 ? CA CA D1134 mTHR.B 31 70.91 119.67 102.04 70.36 119.92 101.24 72.97 119.25 100.79 72.48 119.35 99.67 72.09 118.83 101.96 71.71 117.34 101.75 2 0 19.29-999 ?-999 ?-999 ? CA CA D1134 mASP~B 32 74.24 119.46 101.07 74.48 119.31 102.03 75.87 118.64 99.45 77.01 118.34 99.79 75.20 119.88 100.04 76.23 120.82 100.67 2 0 22.37-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 33 75.14 117.93 98.60 74.24 118.33 98.40 76.90 116.89 97.24 77.74 116.01 97.18 75.62 116.68 98.03 74.57 116.04 97.12 2 0 19.98-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 34 77.04 118.05 96.61 76.27 118.68 96.75 79.49 118.40 96.61 80.53 117.95 96.16 78.20 118.38 95.80 77.99 119.72 95.09 2 0 22.87-999 ?-999 ?-999 ? CA CA D1124 mSER~B 35 79.44 118.89 97.84 78.55 119.27 98.09 80.86 117.46 99.24 82.02 117.04 99.36 80.60 118.88 98.72 80.39 119.86 99.86 2 0 22.99-999 ?-999 ?-999 ? CA CA D1124 mILE~B 36 79.81 116.71 99.55 78.92 117.18 99.47 80.65 114.51 98.86 81.63 113.77 99.06 80.00 115.31 99.97 78.65 114.70 100.39 3 0 19.24-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 37 80.16 114.69 97.63 79.40 115.33 97.57 82.24 114.26 96.37 83.08 113.38 96.16 80.76 113.97 96.50 80.02 114.35 95.20 2 0 19.66-999 ?-999 ?-999 ? CA CA D1124 mHIS~B 38 82.60 115.55 96.48 81.85 116.18 96.68 84.88 115.38 97.38 86.01 114.93 97.16 83.98 115.97 96.32 84.05 117.51 96.34 3 0 22.75-999 ?-999 ?-999 ? CA CA D1124 mILE~B 39 84.43 115.35 98.64 83.52 115.71 98.81 85.53 113.28 99.36 86.65 112.76 99.33 85.35 114.76 99.63 84.86 115.04 101.05 3 0 21.47-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 40 84.43 112.57 99.15 83.59 113.10 99.14 85.25 110.73 97.68 85.98 109.74 97.70 84.49 111.12 98.94 83.08 110.53 98.88 3 0 18.47-999 ?-999 ?-999 ? CA CA D1124 mALA~B 41 85.07 111.42 96.57 84.49 112.24 96.66 87.15 111.42 95.18 87.88 110.83 94.37 85.69 111.00 95.32 84.88 111.51 94.14 2 0 20.64-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 42 87.59 112.43 95.93 86.93 112.79 96.58 89.90 112.57 96.89 91.08 112.95 96.93 88.96 112.93 95.75 88.99 114.45 95.51 2 0 23.78-999 ?-999 ?-999 ? CA CA D1124 mARG~B 43 89.41 111.80 97.85 88.43 111.62 97.77 90.34 109.76 98.69 89.39 109.20 98.15 90.26 111.28 98.91 89.71 111.60 100.29 2 0 22.67-999 ?-999 ?-999 ? CA CA D1124 mSER~B 44 91.47 109.16 99.00 92.17 109.77 99.37 90.95 106.94 99.92 90.62 107.50 100.96 91.65 107.72 98.81 93.15 107.43 98.89 2 0 22.03-999 ?-999 ?-999 ? CA CA D1124 mASN~B 45 90.78 105.63 99.71 91.17 105.27 98.87 90.70 104.94 102.05 90.03 104.96 103.08 90.06 104.82 100.68 89.95 103.36 100.22 2 0 19.00-999 ?-999 ?-999 ? CA CA D1124 mALA~B 46 92.03 105.04 102.07 92.49 105.05 101.18 92.44 106.45 104.02 92.29 106.58 105.23 92.72 105.11 103.35 94.22 104.92 103.14 2 0 21.13-999 ?-999 ?-999 ? CA CA D1124 mGLN~B 47 92.31 107.48 103.21 92.43 107.28 102.23 90.57 108.82 104.30 90.26 109.38 105.35 91.99 108.80 103.77 92.22 109.85 102.69 2 0 21.93-999 ?-999 ?-999 ? CA CA D1124 mARG~B 48 89.66 108.17 103.57 90.02 107.77 102.73 88.15 107.40 105.36 87.24 107.70 106.14 88.27 108.08 104.00 87.49 107.31 102.94 2 0 18.35-999 ?-999 ?-999 ? CA CA D1124 mGLN~B 49 89.04 106.46 105.68 89.74 106.29 104.99 89.29 106.66 108.11 88.72 106.52 109.20 88.95 105.74 106.95 89.86 104.51 106.98 2 0 17.87-999 ?-999 ?-999 ? CA CA D1124 mGLN~B 50 90.21 107.58 107.85 90.59 107.56 106.92 89.56 109.62 109.05 89.26 110.07 110.15 90.62 108.55 108.88 91.99 109.14 108.52 2 0 20.89-999 ?-999 ?-999 ? CA CA D1124 mILE~B 51 88.91 109.99 107.94 89.29 109.60 107.10 86.62 110.29 108.80 85.97 110.99 109.59 87.76 110.87 107.98 87.29 111.24 106.56 3 0 19.75-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 52 86.36 108.99 108.66 86.90 108.50 107.97 85.69 108.44 110.97 84.90 108.73 111.86 85.34 108.36 109.50 85.19 106.89 109.09 2 0 16.65-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 53 86.95 108.12 111.28 87.55 107.90 110.51 87.18 109.50 113.28 86.79 109.66 114.44 87.36 108.11 112.68 88.85 107.72 112.81 2 0 19.09-999 ?-999 ?-999 ? CA CA D1124 mASP~B 54 87.57 110.51 112.50 87.88 110.26 111.58 86.06 112.34 113.12 85.70 113.00 114.09 87.51 111.88 113.01 88.36 112.80 112.15 2 0 21.50-999 ?-999 ?-999 ? CA CA D1124 mTYR~B 55 85.23 112.00 112.13 85.64 111.45 111.40 83.21 111.88 113.47 82.58 112.60 114.26 83.83 112.42 112.19 83.03 111.94 110.97 3 0 19.26-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 56 83.39 110.57 113.69 83.95 110.09 113.02 83.32 110.55 116.14 82.58 110.78 117.09 82.77 109.96 114.86 82.98 108.43 114.85 2 0 18.15-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 57 84.64 110.79 116.19 85.15 110.55 115.36 84.76 112.80 117.62 84.47 113.21 118.74 85.22 111.37 117.40 86.77 111.34 117.31 2 0 21.78-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 58 84.62 113.59 116.56 84.87 113.17 115.69 82.68 115.10 117.12 82.35 115.97 117.93 84.14 114.97 116.69 84.26 115.67 115.32 3 0 19.82-999 ?-999 ?-999 ? CA CA C1133 mPHE~B 59 81.82 114.27 116.54 82.24 113.53 116.01 79.62 113.37 117.39 78.43 113.51 117.74 80.37 114.47 116.68 79.80 114.76 115.29 3 0 18.57-999 ?-999 ?-999 ? CA CA C1133 mGLY~B 60 80.23 112.22 117.67 81.17 112.16 117.33 78.50 110.42 117.64 77.66 109.75 118.24 79.57 111.16 118.42-999.99-999.99-999.99 1 0 19.66-999 ?-999 ?-999 ? CA CA D1124 mLYS.B 61 78.53 110.52 116.32 79.21 111.18 116.00 78.58 109.27 114.27 79.49 110.01 113.88 77.68 109.78 115.40 76.56 110.60 114.77 2 0 16.14-999 ?-999 ?-999 ? CA CA D1124 mHIS~B 62 78.34 108.08 113.75 77.56 107.60 114.15 78.82 108.17 111.34 77.63 108.38 111.12 79.20 107.56 112.69 79.07 106.04 112.59 3 0 13.54-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 63 79.81 108.42 110.49 80.72 108.16 110.83 78.59 108.16 108.38 77.72 108.68 107.67 79.58 109.00 109.18 80.90 109.09 108.39 3 0 13.31-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 64 78.74 106.84 108.48 79.43 106.53 109.13 76.44 106.19 108.00 75.55 106.21 107.16 77.90 105.97 107.65 78.26 104.50 107.94 2 0 9.56-999 ?-999 ?-999 ? CA CA D1124 mASP~B 65 76.18 106.29 109.30 76.97 106.22 109.91 74.25 107.80 109.24 73.09 107.89 108.85 74.79 106.46 109.73 74.74 106.34 111.25 2 0 9.58-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 66 75.08 108.85 109.22 76.00 108.66 109.56 74.25 110.06 107.27 73.20 110.53 106.83 74.64 110.15 108.74 75.73 111.23 108.89 2 0 12.55-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 67 75.10 109.39 106.48 75.93 109.02 106.90 73.55 108.36 104.84 72.86 108.50 103.83 74.75 109.28 105.07 75.95 108.82 104.24 3 0 11.20-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 68 73.31 107.37 105.72 73.95 107.32 106.48 70.88 107.26 105.74 69.83 106.93 105.19 72.17 106.47 105.54 72.18 105.32 106.55 2 0 8.26-999 ?-999 ?-999 ? CA CA D1124 mSER~B 69 70.98 108.31 106.56 71.87 108.43 107.00 69.70 110.24 105.69 68.61 110.45 105.16 69.82 109.18 106.78 69.94 109.90 108.13 2 0 11.45-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 70 70.80 110.93 105.38 71.64 110.54 105.77 70.73 111.86 103.06 70.29 112.71 102.27 70.78 112.13 104.56 71.98 113.02 104.88 2 0 14.05-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 71 71.22 110.69 102.67 71.53 110.11 103.42 70.28 109.21 100.98 69.81 108.58 101.92 71.28 110.32 101.26 72.68 109.86 100.85 3 0 12.80-999 ?-999 ?-999 ? CA CA D1124 mSER~B 72 70.00 108.96 99.71 70.46 109.56 99.05 69.46 107.28 98.00 70.27 107.85 97.28 69.08 107.89 99.35 67.64 108.42 99.27 2 0 11.89-999 ?-999 ?-999 ? CA CA D1124 mGLY~B 73 68.82 106.16 97.68 68.24 105.82 98.41 70.36 105.12 96.05 71.17 104.85 96.94 68.93 105.49 96.40-999.99-999.99-999.99 1 0 12.05-999 ?-999 ?-999 ? CA CA D1124 mASN~B 74 70.67 105.13 94.75 69.94 105.47 94.16 73.10 105.59 94.77 74.20 105.13 95.06 71.97 104.69 94.29 71.98 104.58 92.76 2 0 12.72-999 ?-999 ?-999 ? CA CA D1124 mTYR~B 75 72.79 106.88 94.91 71.88 107.14 94.61 74.14 107.38 96.89 75.33 107.27 97.19 73.78 107.80 95.47 73.29 109.25 95.44 3 0 13.68-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 76 73.14 107.08 97.73 72.21 107.20 97.39 74.38 105.36 99.00 75.38 105.18 99.71 73.49 106.60 99.07 72.22 106.28 99.86 2 0 10.39-999 ?-999 ?-999 ? CA CA D1124 mALA~B 77 73.98 104.43 98.13 73.18 104.65 97.58 76.19 103.42 97.63 77.12 102.89 98.24 74.74 103.18 98.03 74.09 102.24 97.03 2 0 8.93-999 ?-999 ?-999 ? CA CA D1124 mALA~B 78 76.38 104.21 96.58 75.55 104.60 96.18 78.58 105.19 97.12 79.78 104.89 97.28 77.74 104.46 96.10 77.68 105.23 94.78 2 0 12.08-999 ?-999 ?-999 ? CA CA D1124 mALA~B 79 78.00 106.15 97.83 77.04 106.33 97.62 79.24 105.90 99.96 80.40 105.92 100.39 78.80 106.85 98.85 77.96 107.97 99.47 2 0 12.26-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 80 78.27 105.11 100.44 77.37 105.28 100.05 79.55 103.09 100.97 80.33 102.57 101.75 78.52 104.11 101.46 77.25 103.37 101.84 3 0 9.00-999 ?-999 ?-999 ? CA CA D1124 mALA~B 81 79.49 102.74 99.69 78.78 103.19 99.16 81.88 102.29 99.26 82.84 101.59 99.58 80.45 101.77 99.17 80.09 101.47 97.71 2 0 10.35-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 82 82.04 103.59 98.98 81.22 104.10 98.74 83.92 104.16 100.46 85.14 104.16 100.65 83.39 104.15 99.05 83.41 105.57 98.45 3 0 13.59-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 83 83.06 104.19 101.48 82.10 104.12 101.21 84.02 102.98 103.43 84.79 102.92 104.38 83.54 104.31 102.86 82.43 104.89 103.74 3 0 12.54-999 ?-999 ?-999 ? CA CA D1124 mARG~B 84 83.52 101.90 102.85 82.89 102.10 102.10 85.33 100.27 102.94 85.78 100.61 101.84 83.86 100.54 103.26 83.02 99.53 102.47 2 0 11.44-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 85 86.02 99.61 103.85 85.56 99.46 104.73 87.25 98.12 102.38 86.20 97.47 102.28 87.37 99.15 103.50 88.06 98.59 104.74 2 0 14.68-999 ?-999 ?-999 ? CA CA D1124 mPRO~B 86 88.25 98.00 101.52 89.08 98.51 101.77 87.77 95.73 100.61 86.91 95.17 99.94 88.12 97.19 100.31 89.46 97.30 99.59 3 0 16.10-999 ?-999 ?-999 ? CA CA D1124 mASP~B 87 88.41 95.10 101.59 89.11 95.64 102.05 86.63 93.63 102.43 85.84 92.77 102.03 88.06 93.71 101.91 89.03 93.13 102.93 2 0 16.24-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 88 86.27 94.53 103.34 86.99 95.17 103.60 83.88 94.78 102.80 82.76 94.27 102.87 84.92 94.55 103.88 84.79 95.69 104.90 2 0 12.72-999 ?-999 ?-999 ? CA CA D1124 mPHE~B 89 84.22 95.63 101.82 85.14 96.01 101.89 82.90 94.66 99.99 81.72 94.38 99.77 83.27 95.93 100.75 83.87 96.96 99.79 3 0 11.59-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 90 83.91 93.88 99.60 84.83 94.18 99.88 82.81 91.67 99.64 81.83 91.08 99.15 83.62 92.67 98.82 84.93 92.05 98.32 3 0 13.73-999 ?-999 ?-999 ? CA CA D1124 mALA~B 91 83.17 91.52 100.91 83.96 92.07 101.19 81.00 91.01 101.99 80.06 90.21 101.85 82.45 90.61 101.81 83.15 90.56 103.16 2 0 12.75-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 92 80.74 92.30 102.28 81.52 92.91 102.41 78.67 92.55 101.00 77.45 92.34 100.92 79.32 92.67 102.37 79.13 94.07 102.95 2 0 9.03-999 ?-999 ?-999 ? CA CA D1124 mGLN~B 93 79.45 92.68 99.92 80.40 92.90 100.10 78.44 91.03 98.41 77.43 90.71 97.79 78.88 92.49 98.58 79.89 92.88 97.50 2 0 10.67-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 94 79.22 90.13 99.00 80.03 90.51 99.45 77.64 88.43 99.80 76.70 87.77 99.35 78.89 88.71 98.97 80.08 87.91 99.51 3 0 11.17-999 ?-999 ?-999 ? CA CA B1122 mHIS~B 95 77.64 88.97 101.02 78.46 89.48 101.27 75.19 89.18 101.23 74.16 88.50 101.32 76.49 88.79 101.90 76.68 89.57 103.21 3 0 9.43-999 ?-999 ?-999 ? CA CA B1122 mALA~B 96 75.22 90.30 100.52 76.11 90.76 100.52 73.72 89.91 98.61 72.58 89.93 98.15 74.06 90.80 99.80 74.30 92.22 99.29 2 0 8.45-999 ?-999 ?-999 ? CA CA B1122 mALA~B 97 74.70 89.19 98.07 75.59 89.24 98.53 73.59 87.15 97.25 72.89 86.54 96.44 74.39 88.39 96.87 75.67 88.00 96.15 2 0 7.44-999 ?-999 ?-999 ? CA CA B1122 mMET~B 98 73.74 86.76 98.51 74.27 87.40 99.06 71.90 85.76 99.82 70.93 85.01 99.66 73.18 85.53 99.04 74.20 84.86 99.98 2 0 -4.74-999 ?-999 ?-999 ? CA CA B1122smLYS~B 99 71.92 86.73 100.73 72.68 87.37 100.63 69.82 87.84 101.49 68.95 88.10 102.33 70.91 86.84 101.76 71.57 87.08 103.12 2 0 4.21-999 ?-999 ?-999 ? CA CA B1122 mGLY~B 100 69.75 88.35 100.26 70.53 88.17 99.66 67.44 88.12 99.56 67.43 87.02 100.11 68.56 89.11 99.89-999.99-999.99-999.99 1 0 -4.78-999 ?-999 ?-999 ? CA CA B1122smLEU.B 101 66.54 88.50 98.67 66.63 89.48 98.46 66.17 86.95 96.86 66.55 87.57 95.86 65.53 87.64 98.06 64.37 88.52 97.61 3 0 4.64-999 ?-999 ?-999 ? CA CA B1122 mGLY.B 102 66.36 85.63 96.92 66.05 85.15 97.75 68.50 85.19 95.74 69.10 85.68 96.69 67.00 85.01 95.76-999.99-999.99-999.99 1 0 -3.90-999 ?-999 ?-999 ? CA CA B1122smTHR.B 103 69.15 84.75 94.66 68.57 84.43 93.91 71.15 85.59 93.47 70.82 85.35 92.31 70.61 84.77 94.63 71.19 83.34 94.55 2 0 5.06-999 ?-999 ?-999 ? CA CA B1122 mASP~B 104 72.05 86.53 93.76 72.21 86.68 94.74 73.93 86.42 92.23 75.07 86.61 92.64 72.73 87.25 92.69 73.18 88.64 93.14 2 0 8.28-999 ?-999 ?-999 ? CA CA B1122 mLYS~B 105 73.63 85.48 91.34 72.69 85.49 90.98 75.80 85.19 90.19 76.97 84.87 90.41 74.67 84.53 90.95 74.01 83.35 90.24 2 0 10.29-999 ?-999 ?-999 ? CA CA B1122 mASN~B 106 75.49 86.18 89.36 74.52 86.40 89.26 77.49 87.62 89.60 78.70 87.74 89.36 76.58 86.87 88.66 76.01 87.79 87.57 2 0 13.51-999 ?-999 ?-999 ? CA CA B1122 mALA~B 107 76.94 88.13 90.71 75.95 88.03 90.79 78.77 87.80 92.32 79.92 88.10 92.61 77.80 88.79 91.69 76.99 89.45 92.79 2 0 12.71-999 ?-999 ?-999 ? CA CA B1122 mLEU~B 108 78.26 86.60 92.59 77.31 86.46 92.32 80.33 85.24 92.36 81.46 85.15 92.83 79.11 85.58 93.22 78.23 84.35 93.47 3 0 12.18-999 ?-999 ?-999 ? CA CA B1122 mILE~B 109 80.10 85.11 91.07 79.14 85.23 90.82 82.13 85.96 89.95 83.34 85.71 90.07 81.15 84.81 90.10 80.50 84.44 88.75 3 0 15.54-999 ?-999 ?-999 ? CA CA B1122 mASP~B 110 81.65 87.19 89.80 80.65 87.25 89.75 83.53 88.38 90.86 84.70 88.72 90.69 82.54 88.35 89.71 81.76 89.67 89.70 2 0 17.36-999 ?-999 ?-999 ? CA CA B1122 mILE~B 111 83.06 88.04 92.06 82.11 87.72 92.07 84.69 86.88 93.52 85.83 86.92 93.98 83.93 88.16 93.22 83.08 88.55 94.45 3 0 16.90-999 ?-999 ?-999 ? CA CA B1122 mLEU~B 112 84.08 85.72 93.28 83.21 85.78 92.80 85.50 83.75 92.68 86.37 82.93 93.02 84.70 84.48 93.73 83.60 83.56 94.31 3 0 17.03-999 ?-999 ?-999 ? CA CA B1122 mCYH~B 113 85.26 83.99 91.39 84.58 84.70 91.19 87.09 84.05 89.72 87.52 83.74 88.61 86.00 83.21 90.39 85.05 82.68 89.32 2 0 19.57-999 ?-999 ?-999 ? CA CA B1122 mTHR.B 114 87.49 85.13 90.39 87.14 85.22 91.33 89.54 86.52 90.64 90.22 87.48 90.27 88.39 86.07 89.75 87.63 87.36 89.35 2 0 22.03-999 ?-999 ?-999 ? CA CA B1122 mGLN.B 115 89.74 85.87 91.78 89.13 85.09 91.92 91.95 85.34 92.81 91.82 84.16 92.50 90.75 86.29 92.74 90.18 86.37 94.16 2 0 23.18-999 ?-999 ?-999 ? CA CA B1122 mSER~B 116 93.04 85.90 93.30 92.95 86.90 93.37 94.04 84.57 95.07 93.12 84.97 95.79 94.26 85.23 93.71 95.39 86.25 93.83 2 0 26.27-999 ?-999 ?-999 ? CA CA B1122 mASN~B 117 94.84 83.58 95.43 95.53 83.32 94.75 94.72 83.99 97.85 93.93 83.94 98.79 94.69 82.95 96.74 95.80 81.93 96.99 2 0 26.25-999 ?-999 ?-999 ? CA CA B1122 mALA~B 118 95.64 84.96 97.76 96.21 84.94 96.94 94.48 86.77 98.96 93.98 87.06 100.05 95.75 85.94 98.85 96.95 86.85 98.63 2 0 26.78-999 ?-999 ?-999 ? CA CA D1124 mGLN~B 119 93.96 87.15 97.81 94.46 86.83 97.00 91.56 87.25 98.34 90.79 87.78 99.13 92.75 87.97 97.75 92.51 88.37 96.29 2 0 23.63-999 ?-999 ?-999 ? CA CA D1124 mILE~B 120 91.43 85.97 97.97 92.12 85.62 97.34 90.39 84.98 100.00 89.34 84.96 100.65 90.33 85.17 98.49 90.25 83.82 97.75 3 0 21.76-999 ?-999 ?-999 ? CA CA B1122 mHIS~B 121 91.58 84.83 100.57 92.36 84.84 99.95 91.33 85.99 102.73 90.69 86.03 103.78 91.66 84.68 102.03 93.03 84.17 102.45 3 0 23.24-999 ?-999 ?-999 ? CA CA B1122 mALA~B 122 91.72 87.12 102.13 92.25 87.01 101.29 89.84 88.60 102.75 89.27 89.10 103.72 91.35 88.41 102.73 92.02 89.54 101.97 2 0 21.12-999 ?-999 ?-999 ? CA CA D1124 mILE~B 123 89.17 88.19 101.68 89.72 87.78 100.96 87.00 87.53 102.64 86.04 87.99 103.27 87.72 88.36 101.59 87.20 87.98 100.20 3 0 18.24-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 124 87.45 86.30 102.85 88.23 86.04 102.29 87.03 85.94 105.25 86.18 85.85 106.13 86.81 85.43 103.83 87.41 84.02 103.71 2 0 18.81-999 ?-999 ?-999 ? CA CA B1122 mALA~B 125 88.25 86.42 105.51 88.89 86.39 104.74 87.68 88.15 107.15 87.16 88.30 108.26 88.56 86.94 106.84 90.03 87.30 106.96 2 0 19.44-999 ?-999 ?-999 ? CA CA D1124 mALA~B 126 87.50 89.01 106.14 87.98 88.78 105.30 85.20 89.75 106.59 84.53 90.35 107.43 86.64 90.17 106.32 86.73 91.07 105.10 2 0 16.04-999 ?-999 ?-999 ? CA CA D1124 mPHE~B 127 84.74 88.72 105.90 85.40 88.32 105.26 83.12 87.67 107.46 82.06 87.89 108.05 83.37 88.22 106.06 83.10 87.14 105.01 3 0 14.58-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 128 84.06 86.88 107.97 84.81 86.72 107.34 83.98 87.43 110.36 83.20 87.45 111.31 84.00 86.32 109.32 85.22 85.41 109.52 2 0 16.85-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 129 84.89 88.39 110.18 85.53 88.24 109.43 83.54 90.27 110.98 82.93 90.61 111.99 84.89 89.57 111.04 85.97 90.55 110.57 3 0 15.96-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 130 83.06 90.48 109.75 83.64 90.12 109.02 80.60 90.40 110.00 79.68 90.92 110.64 81.81 91.17 109.51 81.66 91.45 108.01 3 0 12.21-999 ?-999 ?-999 ? CA CA D1124 mTYR~B 131 80.51 89.12 109.62 81.31 88.69 109.19 79.26 87.46 110.99 78.22 86.91 111.37 79.22 88.48 109.88 78.68 87.92 108.56 3 0 12.57-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 132 80.46 87.15 111.49 81.24 87.64 111.10 80.04 84.79 112.05 79.66 83.93 112.85 80.53 86.14 112.54 79.70 86.64 113.73 2 0 16.11-999 ?-999 ?-999 ? CA CA D1124 mGLU.B 133 80.04 84.58 110.74 80.31 85.38 110.22 80.79 82.93 109.13 81.58 83.81 108.79 79.69 83.31 110.12 78.34 83.35 109.41 2 0 15.56-999 ?-999 ?-999 ? CA CA B1122 mASP~B 134 80.83 81.67 108.72 80.13 81.08 109.11 81.32 81.43 106.34 80.17 81.10 106.06 81.85 81.22 107.76 82.23 79.76 107.98 2 0 16.06-999 ?-999 ?-999 ? CA CA B1122 mLEU~B 135 82.15 82.05 105.50 83.05 82.26 105.87 81.21 81.14 103.39 80.16 81.16 102.76 81.73 82.37 104.14 82.87 83.00 103.34 3 0 14.15-999 ?-999 ?-999 ? CA CA B1122 mGLU~B 136 82.01 80.08 103.44 82.85 80.21 103.97 80.32 78.28 103.23 79.55 77.74 102.43 81.64 78.84 102.75 82.75 77.80 102.95 2 0 14.60-999 ?-999 ?-999 ? CA CA B1122 mLYS~B 137 80.03 78.39 104.53 80.72 78.85 105.10 77.58 78.47 104.29 76.64 77.81 103.84 78.76 77.84 105.02 78.63 78.08 106.52 2 0 13.39-999 ?-999 ?-999 ? CA CA B1122 mGLU~B 138 77.63 79.80 104.17 78.48 80.22 104.50 76.36 80.20 102.12 75.27 80.05 101.57 76.50 80.52 103.60 76.68 82.03 103.79 2 0 9.81-999 ?-999 ?-999 ? CA CA B1122 mILE~B 139 77.53 80.07 101.48 78.34 80.23 102.05 76.86 78.41 99.81 76.06 78.28 98.88 77.58 79.73 100.07 79.02 79.67 99.55 3 0 10.15-999 ?-999 ?-999 ? CA CA B1122 mILE~B 140 77.17 77.40 100.61 77.82 77.62 101.34 75.06 76.17 100.61 74.29 75.43 100.01 76.55 76.08 100.38 77.16 75.04 101.33 3 0 11.55-999 ?-999 ?-999 ? CA CA B1122 mSER~B 141 74.62 77.16 101.41 75.31 77.75 101.81 72.46 77.94 100.45 71.28 77.67 100.25 73.18 77.27 101.61 72.83 77.94 102.94 2 0 8.78-999 ?-999 ?-999 ? CA CA B1122 mGLU~B 142 73.12 78.82 99.69 74.09 78.93 99.90 72.73 79.08 97.24 72.22 79.60 96.24 72.39 79.53 98.64 72.55 81.04 98.80 2 0 -6.19-999 ?-999 ?-999 ? CA CA B1122smTHR~B 143 73.57 78.08 97.08 73.96 77.72 97.93 73.87 76.04 95.81 73.95 75.50 96.91 73.88 77.56 95.74 75.27 78.01 95.25 2 0 9.31-999 ?-999 ?-999 ? CA CA B1122 mSER~B 144 73.83 75.34 94.68 73.77 75.87 93.83 74.52 73.30 93.51 74.86 74.06 92.61 73.88 73.88 94.77 72.50 73.28 95.02 2 0 12.58-999 ?-999 ?-999 ? CA CA B1122 mGLY~B 145 74.67 71.97 93.46 74.40 71.49 94.30 76.60 71.65 91.91 77.45 71.83 92.79 75.17 71.31 92.28-999.99-999.99-999.99 1 0 16.21-999 ?-999 ?-999 ? CA CA B1122 mASN~B 146 76.87 71.70 90.61 76.07 71.53 90.03 78.67 73.40 90.40 79.84 73.64 90.65 78.19 71.98 90.07 78.17 71.80 88.55 2 0 15.60-999 ?-999 ?-999 ? CA CA B1132 mPHE~B 147 77.73 74.34 90.34 76.82 74.00 90.09 78.47 75.90 92.06 79.45 76.56 92.38 78.03 75.74 90.61 76.81 76.60 90.30 3 0 15.44-999 ?-999 ?-999 ? CA CA B1122 mGLN~B 148 77.78 75.21 92.97 76.96 74.74 92.63 79.65 74.66 94.49 80.44 75.17 95.29 78.22 75.18 94.36 77.31 74.25 95.17 2 0 14.19-999 ?-999 ?-999 ? CA CA B1122 mARG~B 149 79.95 73.57 93.78 79.23 73.25 93.16 82.36 73.83 93.44 83.40 73.91 94.08 81.24 72.91 93.93 81.26 71.57 93.18 2 0 17.88-999 ?-999 ?-999 ? CA CA B1122 mLEU~B 150 82.14 74.53 92.33 81.25 74.37 91.91 83.45 76.56 92.80 84.60 76.93 93.03 83.18 75.44 91.81 82.70 76.03 90.49 3 0 18.66-999 ?-999 ?-999 ? CA CA B1122 mLEU~B 151 82.39 77.10 93.43 81.50 76.74 93.15 83.27 77.61 95.69 84.11 78.28 96.29 82.57 78.13 94.44 81.24 78.78 94.81 3 0 16.05-999 ?-999 ?-999 ? CA CA B1122 mVAL~B 152 82.98 76.38 96.13 82.26 75.89 95.64 85.21 75.72 96.92 86.12 75.95 97.72 83.73 75.85 97.27 83.20 74.46 97.69 3 0 17.49-999 ?-999 ?-999 ? CA CA B1122 mSER~B 153 85.47 75.39 95.65 84.67 75.24 95.07 87.52 76.63 95.29 88.57 76.78 95.92 86.85 75.26 95.19 86.90 74.75 93.75 2 0 20.81-999 ?-999 ?-999 ? CA CA B1122 mMET~B 154 86.87 77.65 94.74 85.99 77.41 94.32 87.75 79.44 96.20 88.79 80.08 96.42 87.43 79.00 94.78 86.49 80.01 94.12 2 0 20.10-999 ?-999 ?-999 ? CA CA B1122 mLEU~B 155 86.89 79.12 97.15 86.13 78.55 96.84 88.22 78.95 99.28 88.64 79.41 100.36 87.05 79.56 98.53 85.75 79.31 99.31 3 0 19.08-999 ?-999 ?-999 ? CA CA B1122 mGLN~B 156 88.81 77.89 98.71 88.45 77.61 97.82 91.19 78.02 99.30 92.12 77.88 100.10 89.89 77.23 99.43 90.08 75.81 98.90 2 0 20.95-999 ?-999 ?-999 ? CA CA E1125 mGLY~B 157 91.27 78.83 98.24 90.46 78.88 97.66 93.67 78.61 97.86 94.74 78.80 98.43 92.51 79.57 98.00-999.99-999.99-999.99 1 0 24.43-999 ?-999 ?-999 ? CA CA B1122 mGLY.B 158 93.46 77.53 97.12 92.56 77.50 96.67 94.99 76.38 95.58 95.51 75.33 95.18 94.47 76.50 96.99-999.99-999.99-999.99 1 0 24.31-999 ?-999 ?-999 ? CA CA E1125 mARG.B 159 94.91 77.45 94.79 94.46 78.26 95.16 96.99 77.10 93.57 97.64 77.65 94.47 95.49 77.34 93.44 95.19 78.59 92.62 2 0 26.09-999 ?-999 ?-999 ? CA CA B1132 mLYS.B 160 97.58 76.26 92.73 96.98 75.78 92.09 99.71 77.23 92.05 100.03 77.09 90.87 99.04 76.09 92.81 99.47 74.76 92.21 2 0 27.47-999 ?-999 ?-999 ? CA CA B1132 mGLU.B 161 99.86 78.38 92.71 99.68 78.34 93.69 101.72 79.55 91.55 102.14 80.34 90.70 100.27 79.58 91.99 99.94 80.81 92.86 2 0 29.30-999 ?-999 ?-999 ? CA CA B1132 mASP.B 162 102.50 78.64 92.11 102.05 78.07 92.80 104.08 77.37 90.72 105.18 76.88 90.44 103.90 78.50 91.72 104.75 78.25 92.98 2 0 31.34-999 ?-999 ?-999 ? CA CA B1132 mGLU.B 163 102.98 76.86 90.16 102.11 77.24 90.48 103.69 76.46 87.88 103.11 77.41 87.36 103.14 75.81 89.15 101.79 75.15 88.89 2 0 28.48-999 ?-999 ?-999 ? CA CA B1132 mPRO.B 164 104.83 75.97 87.40 105.22 75.21 87.92 104.71 76.11 84.92 104.10 75.05 84.88 105.43 76.55 86.20 106.86 75.98 86.20 3 0 29.45-999 ?-999 ?-999 ? CA CA B1132 mVAL.B 165 104.84 76.94 83.89 105.27 77.81 84.13 105.15 75.38 82.04 106.38 75.29 82.13 104.40 76.61 82.55 104.64 77.79 81.59 3 0 27.47-999 ?-999 ?-999 ? CA CA B1132 mASN~B 166 104.42 74.41 81.51 103.44 74.61 81.48 104.10 72.55 79.97 102.99 72.13 80.28 105.02 73.17 81.02 105.28 72.21 82.19 2 0 26.56-999 ?-999 ?-999 ? CA CA B1132 mALA~B 167 104.57 72.57 78.73 105.49 72.96 78.68 103.32 70.67 77.71 102.18 70.39 77.33 103.86 72.08 77.56 104.78 72.15 76.34 2 0 24.70-999 ?-999 ?-999 ? CA CA B1132 mALA~B 168 104.12 69.74 78.23 105.01 70.06 78.54 102.49 68.24 79.28 101.42 67.69 79.01 103.64 68.36 78.29 104.76 67.41 78.67 2 0 23.90-999 ?-999 ?-999 ? CA CA B1132 mHIS~B 169 102.73 68.75 80.50 103.61 69.18 80.66 100.42 69.40 80.98 99.28 68.99 81.17 101.63 68.61 81.47 102.11 69.05 82.84 3 0 22.52-999 ?-999 ?-999 ? CA CA B1132 mALA~B 170 100.70 70.48 80.25 101.67 70.67 80.14 98.88 70.54 78.60 97.65 70.63 78.48 99.63 71.29 79.68 100.21 72.59 79.13 2 0 20.71-999 ?-999 ?-999 ? CA CA B1132 mALA~B 171 99.60 69.79 77.76 100.59 69.80 77.90 98.03 67.96 77.40 96.92 67.66 76.96 98.89 69.02 76.73 99.86 68.38 75.75 2 0 19.16-999 ?-999 ?-999 ? CA CA B1132 mGLU~B 172 98.54 67.39 78.49 99.45 67.70 78.76 96.41 66.97 79.62 95.36 66.49 79.19 97.76 66.38 79.19 98.50 65.85 80.40 2 0 18.08-999 ?-999 ?-999 ? CA CA B1132 mASP~B 173 96.48 68.01 80.44 97.42 68.31 80.64 94.26 68.95 79.92 93.08 68.69 80.11 95.30 68.66 80.99 95.70 69.98 81.66 2 0 16.39-999 ?-999 ?-999 ? CA CA B1132 mALA~B 174 94.76 69.52 78.82 95.76 69.61 78.82 93.25 68.78 77.03 92.09 68.84 76.64 93.91 69.97 77.72 94.72 70.79 76.74 2 0 14.61-999 ?-999 ?-999 ? CA CA B1132 mALA~B 175 94.03 67.71 76.90 94.97 67.83 77.22 92.50 65.87 77.32 91.42 65.42 76.94 93.50 66.47 76.34 94.64 65.50 76.05 2 0 13.52-999 ?-999 ?-999 ? CA CA B1132 mALA~B 176 92.85 65.89 78.61 93.75 66.27 78.81 90.65 66.22 79.56 89.52 65.76 79.73 91.91 65.38 79.60 92.53 65.37 80.98 2 0 12.52-999 ?-999 ?-999 ? CA CA B1132 mILE~B 177 90.84 67.52 79.31 91.78 67.82 79.20 88.88 68.03 77.94 87.64 67.97 77.97 89.64 68.36 79.21 90.04 69.85 79.27 3 0 10.51-999 ?-999 ?-999 ? CA CA B1132 mTYR~B 178 89.58 67.78 76.83 90.57 67.88 76.93 87.98 66.18 75.80 86.85 66.11 75.33 88.89 67.39 75.60 89.89 67.10 74.47 3 0 9.01-999 ?-999 ?-999 ? CA CA B1132 mGLN~B 179 88.53 65.17 76.48 89.45 65.35 76.83 86.61 64.10 77.61 85.63 63.34 77.53 87.80 63.93 76.68 88.75 62.86 77.22 2 0 8.11-999 ?-999 ?-999 ? CA CA B1132 mALA~B 180 86.67 65.08 78.51 87.47 65.67 78.46 84.38 65.96 78.94 83.31 65.99 79.54 85.58 65.21 79.49 86.10 65.82 80.78 2 0 6.73-999 ?-999 ?-999 ? CA CA B1132 mGLY~B 181 84.53 66.60 77.78 85.44 66.54 77.38 83.21 66.88 75.73 82.54 65.88 75.46 83.42 67.32 77.17-999.99-999.99-999.99 1 0 -3.93-999 ?-999 ?-999 ? CA CA B1132smGLU.B 182 83.79 67.62 74.81 84.32 68.37 75.22 83.89 65.93 73.01 83.12 65.40 72.22 83.71 67.41 73.38 84.84 68.19 72.70 2 0 4.67-999 ?-999 ?-999 ? CA CA B1132 mGLY.B 183 84.94 65.34 73.56 85.46 65.91 74.19 84.28 62.94 73.57 84.25 61.90 72.89 85.33 63.98 73.25-999.99-999.99-999.99 1 0 6.23-999 ?-999 ?-999 ? CA CA B1132 mGLN.B 184 83.44 63.17 74.57 83.52 64.08 74.98 81.03 62.62 74.89 80.77 63.78 74.57 82.48 62.16 75.02 82.79 61.73 76.45 2 0 -4.60-999 ?-999 ?-999 ? CA CA B1132smILE.B 185 80.11 61.68 75.08 80.46 60.78 75.32 78.19 62.68 76.20 77.60 63.75 76.14 78.69 61.98 74.94 77.78 60.77 74.70 3 0 -4.27-999 ?-999 ?-999 ? CA CA B1132smGLY.B 186 78.44 62.04 77.35 78.85 61.14 77.25 79.18 63.71 78.96 79.97 64.09 78.09 78.12 62.68 78.62-999.99-999.99-999.99 1 0 -4.72-999 ?-999 ?-999 ? CA CA B1132smTHR.B 187 79.24 64.17 80.21 78.55 63.81 80.84 80.93 64.76 81.90 80.25 64.32 82.83 80.28 65.13 80.57 79.73 66.56 80.71 2 0 4.85-999 ?-999 ?-999 ? CA CA B1132 mASP~B 188 82.24 64.98 81.99 82.70 65.18 81.13 83.16 66.38 83.70 84.26 66.90 83.51 82.89 64.93 83.29 84.20 64.15 83.29 2 0 8.10-999 ?-999 ?-999 ? CA CA B1132 mGLU~B 189 82.13 67.01 84.25 81.30 66.47 84.34 83.46 68.54 85.63 84.19 69.54 85.58 82.28 68.41 84.68 80.96 68.86 85.29 2 0 9.49-999 ?-999 ?-999 ? CA CA B1132 mSER~B 190 83.65 67.58 86.53 83.04 66.79 86.43 86.05 67.91 87.00 86.94 68.41 87.68 84.66 67.68 87.57 84.68 66.46 88.48 2 0 12.77-999 ?-999 ?-999 ? CA CA B1132 mARG~B 191 86.27 67.47 85.76 85.49 67.08 85.28 87.88 69.08 84.91 88.93 69.59 85.25 87.63 67.60 85.24 87.85 66.67 84.06 2 0 12.25-999 ?-999 ?-999 ? CA CA B1132 mPHE~B 192 86.89 69.72 84.31 86.14 69.12 84.03 87.10 71.88 85.43 87.93 72.77 85.54 86.89 71.16 84.09 85.56 71.64 83.51 3 0 11.97-999 ?-999 ?-999 ? CA CA B1132 mASN~B 193 86.35 71.45 86.45 85.73 70.70 86.24 87.86 71.97 88.31 88.43 72.93 88.83 86.46 72.08 87.75 85.46 71.49 88.75 2 0 14.90-999 ?-999 ?-999 ? CA CA B1132 mALA~B 194 88.44 70.78 88.25 87.88 70.08 87.80 90.84 71.34 88.09 91.71 71.94 88.74 89.76 70.54 88.80 90.11 69.05 88.76 2 0 16.89-999 ?-999 ?-999 ? CA CA B1132 mVAL~B 195 90.84 71.34 86.75 90.07 70.88 86.30 91.86 73.53 86.28 92.85 74.21 86.54 91.96 72.01 86.08 92.03 71.72 84.58 3 0 16.89-999 ?-999 ?-999 ? CA CA B1132 mLEU~B 196 90.65 74.05 86.14 89.91 73.39 85.99 90.61 76.05 87.63 90.82 77.25 87.84 90.46 75.50 86.22 89.12 75.89 85.62 3 0 17.59-999 ?-999 ?-999 ? CA CA B1132 mALA~B 197 90.54 75.20 88.65 90.39 74.24 88.41 92.11 75.60 90.53 92.54 76.36 91.40 90.68 75.71 90.01 89.73 74.93 90.93 2 0 20.27-999 ?-999 ?-999 ? CA CA B1132 mTHR~B 198 92.87 74.63 90.02 92.50 74.13 89.24 95.35 74.88 89.83 96.40 75.08 90.45 94.16 74.36 90.63 94.39 72.85 90.89 2 0 22.16-999 ?-999 ?-999 ? CA CA B1132 mARG~B 199 95.24 75.01 88.52 94.32 74.85 88.15 96.76 76.86 87.90 95.89 77.73 87.92 96.40 75.39 87.72 96.19 75.17 86.22 2 0 22.36-999 ?-999 ?-999 ? CA CA B1132 mSER~B 200 98.07 77.14 87.94 98.68 76.35 87.95 97.93 79.26 86.76 97.61 78.61 85.77 98.48 78.55 87.99 100.00 78.67 88.09 2 0 25.47-999 ?-999 ?-999 ? CA CA B1132 mTYR~B 201 97.71 80.56 86.83 97.89 80.99 87.72 98.14 81.10 84.45 97.62 80.98 83.33 97.23 81.28 85.65 97.06 82.77 85.97 3 0 25.08-999 ?-999 ?-999 ? CA CA B1132 mPRO~B 202 99.46 81.15 84.57 99.79 81.35 85.49 100.17 79.55 82.79 100.09 79.39 81.56 100.31 80.94 83.39 101.73 81.15 83.92 3 0 26.35-999 ?-999 ?-999 ? CA CA B1132 mGLN~B 203 100.17 78.50 83.61 100.31 78.72 84.58 98.60 77.07 82.40 98.48 76.47 81.33 99.95 77.16 83.08 100.14 76.09 84.14 2 0 24.01-999 ?-999 ?-999 ? CA CA B1132 mLEU~B 204 97.59 77.74 82.97 97.82 78.22 83.82 96.35 78.36 80.96 95.77 77.87 80.00 96.26 77.75 82.36 95.26 78.50 83.22 3 0 21.13-999 ?-999 ?-999 ? CA CA B1132 mHIS~B 205 97.14 79.43 80.86 97.58 79.74 81.70 97.83 79.07 78.53 97.30 78.93 77.43 97.31 80.07 79.56 98.27 81.26 79.64 3 0 22.65-999 ?-999 ?-999 ? CA CA B1132 mGLN~B 206 98.86 78.33 78.92 99.17 78.54 79.84 98.45 76.24 77.71 98.28 75.82 76.57 99.46 77.32 78.06 100.65 76.70 78.80 2 0 22.65-999 ?-999 ?-999 ? CA CA B1132 mILE~B 207 97.77 75.79 78.77 98.01 76.19 79.66 95.72 75.21 77.57 95.18 74.41 76.79 96.76 74.75 78.57 96.09 74.34 79.89 3 0 19.13-999 ?-999 ?-999 ? CA CA B1132 mPHE~B 208 95.41 76.51 77.50 95.91 77.13 78.12 94.93 76.89 75.13 94.24 76.63 74.14 94.37 76.91 76.54 93.73 78.24 76.89 3 0 18.08-999 ?-999 ?-999 ? CA CA B1132 mHIS~B 209 96.23 77.14 74.99 96.69 77.40 75.84 96.86 75.56 73.22 96.44 75.22 72.12 96.89 77.02 73.68 98.32 77.53 73.77 3 0 20.30-999 ?-999 ?-999 ? CA CA B1132 mGLU~B 210 97.32 74.67 74.08 97.69 75.07 74.92 95.91 72.74 73.41 95.81 71.74 72.69 97.29 73.24 73.81 97.79 72.50 75.05 2 0 18.87-999 ?-999 ?-999 ? CA CA B1132 mTYR~B 211 94.83 73.38 73.86 95.02 74.17 74.44 93.22 73.23 72.01 92.68 72.41 71.28 93.49 72.93 73.48 92.39 73.58 74.34 3 0 15.36-999 ?-999 ?-999 ? CA CA B1132 mSER~B 212 93.64 74.43 71.61 94.05 74.97 72.34 94.30 74.02 69.27 94.00 73.96 68.08 93.54 74.91 70.24 94.04 76.36 70.15 2 0 17.16-999 ?-999 ?-999 ? CA CA B1132 mLYS~B 213 95.28 73.29 69.80 95.43 73.45 70.78 95.26 71.06 68.75 95.54 70.37 67.76 96.05 72.34 69.02 97.36 71.97 69.72 2 0 18.56-999 ?-999 ?-999 ? CA CA B1132 mILE~B 214 94.32 70.72 69.63 94.16 71.37 70.36 92.13 69.63 69.12 91.42 68.65 68.86 93.61 69.46 69.46 93.72 68.58 70.72 3 0 15.42-999 ?-999 ?-999 ? CA CA B1132 mSER~B 215 91.62 70.86 69.10 92.25 71.60 69.32 90.02 72.20 67.82 90.81 73.14 67.83 90.20 71.04 68.78 89.41 71.28 70.08 2 0 13.39-999 ?-999 ?-999 ? CA CA B1132 mASN.B 216 88.94 72.18 67.04 88.42 71.32 67.04 87.83 74.36 67.13 87.47 75.47 66.74 88.58 73.36 66.27 87.73 72.97 65.06 2 0 14.81-999 ?-999 ?-999 ? CA CA B1132 mLYS.B 217 87.59 73.98 68.39 87.85 73.04 68.62 88.04 75.47 70.28 88.94 74.74 70.70 86.98 74.93 69.32 85.89 74.27 70.16 2 0 13.09-999 ?-999 ?-999 ? CA CA B1132 mTHR~B 218 87.89 76.74 70.64 87.18 77.23 70.14 88.17 76.85 73.04 87.15 76.17 73.09 88.71 77.34 71.69 88.67 78.88 71.67 2 0 14.91-999 ?-999 ?-999 ? CA CA B1132 mILE~B 219 88.84 77.18 74.14 89.63 77.77 73.99 87.03 77.22 75.79 86.31 76.55 76.52 88.41 76.68 75.44 89.42 77.06 76.55 3 0 13.64-999 ?-999 ?-999 ? CA CA B1132 mLEU~B 220 86.74 78.42 75.31 87.47 78.78 74.74 84.35 78.48 74.78 83.28 78.24 75.32 85.50 79.14 75.55 85.59 80.59 75.10 3 0 14.28-999 ?-999 ?-999 ? CA CA B1132 mGLN~B 221 84.60 78.25 73.49 85.48 78.59 73.17 83.28 76.21 73.21 82.12 75.81 73.21 83.63 77.58 72.64 84.18 77.37 71.22 2 0 12.58-999 ?-999 ?-999 ? CA CA B1132 mALA~B 222 84.32 75.54 73.68 85.19 76.01 73.61 83.26 74.24 75.50 82.35 73.43 75.69 84.15 74.21 74.26 85.53 73.65 74.60 2 0 9.36-999 ?-999 ?-999 ? CA CA B1132 mILE~B 223 83.54 75.21 76.37 84.29 75.83 76.13 81.33 75.78 77.26 80.35 75.20 77.75 82.74 75.31 77.59 83.41 76.19 78.64 3 0 9.90-999 ?-999 ?-999 ? CA CA B1132 mGLU~B 224 81.22 76.78 76.39 82.10 77.14 76.07 79.07 76.13 75.44 77.89 75.97 75.73 79.91 77.28 75.97 80.14 78.37 74.94 2 0 11.33-999 ?-999 ?-999 ? CA CA B1132 mASN~B 225 79.74 75.29 74.65 80.69 75.55 74.50 78.73 73.09 75.13 77.63 72.54 75.05 79.14 74.10 74.07 80.12 73.46 73.08 2 0 8.37-999 ?-999 ?-999 ? CA CA B1132 mGLU~B 226 79.58 72.82 76.13 80.39 73.39 76.15 78.40 72.13 78.25 77.85 71.25 78.92 79.31 71.75 77.08 80.64 71.25 77.66 2 0 -5.98-999 ?-999 ?-999 ? CA CA B1132smPHE~B 227 78.32 73.41 78.60 78.78 74.07 78.01 76.52 74.82 79.54 76.36 75.29 78.42 77.58 73.76 79.81 78.49 74.25 80.93 3 0 9.10-999 ?-999 ?-999 ? CA CA B1132 mSER~B 228 75.82 75.16 80.62 76.04 74.64 81.44 74.59 76.75 81.99 74.90 76.09 82.98 74.82 76.22 80.58 73.52 75.75 79.94 2 0 12.45-999 ?-999 ?-999 ? CA CA B1132 mGLY~B 229 74.07 77.97 82.07 73.92 78.41 81.19 74.93 78.93 84.20 76.03 79.18 83.70 73.74 78.61 83.33-999.99-999.99-999.99 1 0 16.00-999 ?-999 ?-999 ? CA CA B1132 mASP~B 230 74.74 78.94 85.51 73.83 78.63 85.79 77.10 78.68 86.26 78.15 79.33 86.22 75.76 79.37 86.44 75.25 79.19 87.88 2 0 15.52-999 ?-999 ?-999 ? CA CA B1122 mILE~B 231 77.12 77.35 86.20 76.24 76.87 86.19 79.17 77.09 84.87 80.38 77.29 84.87 78.45 76.72 86.16 78.39 75.18 86.28 3 0 15.01-999 ?-999 ?-999 ? CA CA B1132 mLYS~B 232 78.42 77.22 83.78 77.46 76.98 83.87 79.66 79.08 82.75 80.85 79.30 82.53 79.04 77.70 82.54 78.04 77.74 81.40 2 0 13.57-999 ?-999 ?-999 ? CA CA B1132 mASN~B 233 78.87 80.01 83.26 77.94 79.71 83.46 80.55 81.38 84.44 81.51 82.14 84.28 79.38 81.36 83.49 78.26 82.25 84.05 2 0 17.23-999 ?-999 ?-999 ? CA CA B1132 mGLY~B 234 80.52 80.54 85.48 79.73 79.94 85.58 82.95 80.12 85.74 84.03 80.66 86.00 81.67 80.60 86.39-999.99-999.99-999.99 1 0 18.15-999 ?-999 ?-999 ? CA CA B1132 mLEU~B 235 82.86 79.08 84.92 81.93 78.73 84.78 84.59 79.44 83.20 85.79 79.68 83.07 84.05 78.51 84.28 83.71 77.13 83.69 3 0 15.68-999 ?-999 ?-999 ? CA CA B1132 mLEU~B 236 83.69 80.05 82.44 82.75 79.76 82.62 84.74 82.24 82.12 85.75 82.78 81.65 84.06 81.06 81.45 82.78 81.54 80.75 3 0 16.63-999 ?-999 ?-999 ? CA CA B1132 mALA~B 237 84.19 82.66 83.26 83.37 82.18 83.57 86.28 83.45 84.32 87.20 84.27 84.26 84.84 83.76 83.98 84.03 84.10 85.22 2 0 20.18-999 ?-999 ?-999 ? CA CA B1132 mILE~B 238 86.54 82.22 84.79 85.78 81.57 84.85 88.85 82.02 83.94 89.97 82.52 84.00 87.94 81.95 85.16 88.07 80.59 85.86 3 0 20.16-999 ?-999 ?-999 ? CA CA B1132 mVAL~B 239 88.36 81.53 82.80 87.43 81.16 82.85 89.46 83.01 81.18 90.63 83.34 80.98 89.18 81.57 81.60 88.57 80.79 80.42 3 0 19.01-999 ?-999 ?-999 ? CA CA B1132 mLYS~B 240 88.40 83.79 81.08 87.53 83.32 81.25 89.38 85.94 81.77 90.19 86.77 81.37 88.50 85.21 80.76 87.13 85.89 80.70 2 0 21.63-999 ?-999 ?-999 ? CA CA B1132 mSER~B 241 89.25 85.63 83.06 88.55 84.95 83.29 91.59 85.96 83.73 92.48 86.79 83.88 90.14 86.30 84.01 89.79 85.99 85.47 2 0 24.17-999 ?-999 ?-999 ? CA CA B1132 mVAL~B 242 91.85 84.72 83.29 91.05 84.12 83.21 93.70 85.06 81.71 94.83 85.53 81.65 93.22 84.33 82.96 93.35 82.81 82.76 3 0 23.74-999 ?-999 ?-999 ? CA CA B1132 mGLU~B 243 92.83 85.16 80.71 91.90 84.85 80.90 93.42 87.23 79.49 94.48 87.76 79.14 93.26 85.72 79.43 92.29 85.30 78.33 2 0 24.07-999 ?-999 ?-999 ? CA CA B1132 mASN~B 244 92.40 87.92 79.98 91.61 87.36 80.25 91.47 89.86 81.18 90.29 90.07 80.89 92.44 89.38 80.10 92.09 90.02 78.76 2 0 26.86-999 ?-999 ?-999 ? CA CA B1132 mARG~B 245 91.96 90.07 82.39 92.94 89.92 82.48 90.46 91.85 83.15 89.30 92.10 83.47 91.09 90.50 83.49 91.91 90.58 84.78 2 0 28.01-999 ?-999 ?-999 ? CA CA B1132 mPHE~B 246 91.24 92.73 82.52 92.16 92.41 82.30 89.48 93.91 81.34 88.46 94.56 81.58 90.72 94.06 82.21 91.76 94.95 81.54 3 0 29.44-999 ?-999 ?-999 ? CA CA D1124 mALA~B 247 89.58 93.03 80.34 90.45 92.53 80.27 87.25 92.21 80.14 86.10 92.39 79.72 88.44 92.84 79.45 88.86 92.07 78.21 2 0 28.42-999 ?-999 ?-999 ? CA CA B1132 mTYR~B 248 87.47 91.45 81.21 88.43 91.33 81.48 85.50 91.99 82.57 84.30 92.13 82.34 86.30 90.88 81.91 86.73 89.83 82.93 3 0 25.63-999 ?-999 ?-999 ? CA CA B1122 mPHE~B 249 86.14 92.84 83.37 87.11 92.63 83.51 84.79 94.89 82.93 83.63 95.27 83.11 85.44 93.98 83.96 86.41 94.80 84.82 3 0 24.70-999 ?-999 ?-999 ? CA CA B1122 mALA~B 250 85.53 95.20 81.87 86.46 94.86 81.91 83.63 95.47 80.32 82.65 96.19 80.29 85.00 95.98 80.75 85.97 95.89 79.58 2 0 27.32-999 ?-999 ?-999 ? CA CA B1122 mGLU~B 251 83.61 94.17 80.03 84.50 93.74 80.15 81.34 93.46 80.63 80.15 93.55 80.33 82.43 93.45 79.57 82.89 92.02 79.27 2 0 25.72-999 ?-999 ?-999 ? CA CA B1122 mARG~B 252 81.72 93.36 81.90 82.71 93.28 82.05 80.18 94.78 83.21 78.98 94.97 83.39 80.72 93.37 82.97 81.29 92.77 84.25 2 0 22.21-999 ?-999 ?-999 ? CA CA B1122 mLEU~B 253 81.05 95.78 83.14 82.01 95.52 83.02 79.57 97.44 82.11 78.43 97.85 82.33 80.56 97.17 83.23 81.72 98.16 83.19 3 0 23.33-999 ?-999 ?-999 ? CA CA D1124 mHIS~B 254 80.01 97.14 80.89 80.94 96.77 80.89 77.84 96.68 79.83 76.82 97.28 79.49 79.22 97.31 79.68 79.96 96.66 78.51 3 0 25.76-999 ?-999 ?-999 ? CA CA B1122 mHIS~B 255 77.84 95.45 80.33 78.74 95.10 80.57 75.76 95.31 81.61 74.54 95.36 81.50 76.61 94.70 80.50 76.89 93.22 80.80 3 0 22.86-999 ?-999 ?-999 ? CA CA B1122 mALA~B 256 76.42 95.80 82.67 77.41 95.67 82.69 74.88 97.66 83.09 73.73 97.93 83.43 75.62 96.48 83.70 76.47 96.96 84.86 2 0 20.93-999 ?-999 ?-999 ? CA CA B1122 mMET~B 257 75.54 98.41 82.20 76.46 98.11 81.96 74.10 99.28 80.39 73.46 100.17 79.84 74.87 99.60 81.67 75.89 100.71 81.45 2 0 23.67-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 258 74.16 98.03 79.98 74.76 97.48 80.56 72.09 98.07 78.61 72.09 99.25 78.27 73.49 97.46 78.83 73.39 95.93 78.95 2 0 24.75-999 ?-999 ?-999 ? CA CA B1122 mGLY.B 259 71.02 97.33 78.82 71.30 96.41 79.10 69.29 99.12 78.58 69.90 99.89 77.83 69.63 97.66 78.70-999.99-999.99-999.99 1 0 24.50-999 ?-999 ?-999 ? CA CA B1122 mLEU.B 260 68.15 99.54 79.18 67.60 98.81 79.60 67.83 101.53 80.60 67.42 102.70 80.75 67.77 100.94 79.20 66.36 101.15 78.64 3 0 26.02-999 ?-999 ?-999 ? CA CA B1122 mGLY.B 261 68.28 100.92 81.68 68.17 101.62 82.39 69.56 99.79 83.44 68.95 100.11 84.46 68.82 99.68 82.11-999.99-999.99-999.99 1 0 22.99-999 ?-999 ?-999 ? CA CA B1122 mTHR.B 262 70.85 99.55 83.43 71.15 99.27 82.52 71.58 98.64 85.66 70.70 98.85 86.49 71.80 99.63 84.51 71.95 101.03 85.16 2 0 20.78-999 ?-999 ?-999 ? CA CA D1124 mSER~B 263 72.46 97.64 85.76 72.99 97.44 84.94 73.50 97.79 87.88 74.72 97.71 87.78 72.56 96.93 87.03 73.10 95.51 86.93 2 0 17.97-999 ?-999 ?-999 ? CA CA B1122 mASP~B 264 72.87 98.68 88.64 71.87 98.62 88.61 74.48 98.97 90.48 75.63 99.38 90.70 73.61 99.65 89.43 72.65 100.69 90.00 2 0 15.87-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 265 73.96 97.91 91.10 73.03 97.69 90.84 76.06 96.72 91.45 77.15 96.86 92.00 74.74 97.16 92.08 73.96 95.93 92.54 2 0 13.32-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 266 75.96 96.18 90.24 75.03 96.12 89.88 78.06 96.91 89.18 79.26 96.85 89.41 77.14 95.74 89.52 76.76 94.99 88.23 2 0 16.47-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 267 77.47 97.96 88.60 76.49 97.85 88.43 79.00 99.69 89.45 80.20 99.96 89.42 78.26 99.14 88.25 77.29 100.20 87.69 3 0 17.84-999 ?-999 ?-999 ? CA CA D1124 mILE~B 268 78.30 99.86 90.58 77.34 99.60 90.54 80.08 99.50 92.25 81.19 99.95 92.56 78.97 100.40 91.76 77.94 100.65 92.88 3 0 14.95-999 ?-999 ?-999 ? CA CA D1124 mARG~B 269 79.83 98.19 92.32 78.93 97.89 92.00 82.14 97.33 92.08 83.25 97.30 92.65 80.85 97.29 92.86 80.35 95.83 92.91 2 0 14.76-999 ?-999 ?-999 ? CA CA D1124 mILE~B 270 82.06 97.37 90.75 81.14 97.45 90.36 84.09 98.59 90.02 85.30 98.61 90.25 83.31 97.29 89.99 83.04 96.86 88.54 3 0 18.51-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 271 83.43 99.72 89.78 82.44 99.62 89.62 84.77 101.21 91.15 85.93 101.58 91.31 84.17 100.99 89.77 83.26 102.16 89.39 3 0 19.36-999 ?-999 ?-999 ? CA CA D1124 mVAL~B 272 83.98 100.94 92.20 83.06 100.59 92.01 85.67 100.19 93.84 86.79 100.55 94.23 84.57 101.18 93.52 83.49 101.12 94.61 3 0 16.83-999 ?-999 ?-999 ? CA CA D1124 mSER~B 273 85.36 98.90 93.63 84.46 98.72 93.22 87.62 98.02 93.22 88.68 97.64 93.71 86.32 97.86 94.00 85.73 96.47 93.79 2 0 17.55-999 ?-999 ?-999 ? CA CA D1124 mARG~B 274 87.53 98.58 92.01 86.62 98.91 91.76 89.33 100.07 91.15 90.46 100.22 90.68 88.71 98.68 91.16 88.30 98.27 89.74 2 0 21.21-999 ?-999 ?-999 ? CA CA D1124 mSER~B 275 88.65 101.07 91.69 87.79 100.76 92.10 90.54 102.66 92.08 91.15 103.61 91.58 89.07 102.46 91.71 88.17 103.26 92.65 2 0 21.54-999 ?-999 ?-999 ? CA CA D1124 mGLU.B 276 91.11 101.79 92.91 90.51 101.04 93.18 93.38 100.78 92.96 94.46 100.56 93.50 92.48 101.93 93.38 92.48 102.10 94.91 2 0 23.24-999 ?-999 ?-999 ? CA CA D1124 mILE.B 277 92.96 100.04 91.94 92.09 100.31 91.53 94.09 98.99 90.01 95.22 99.30 89.63 93.77 98.90 91.49 93.07 97.56 91.82 3 0 25.05-999 ?-999 ?-999 ? CA CA D1124 mASP~B 278 93.11 98.77 89.15 92.21 98.62 89.56 92.28 99.46 86.92 92.10 99.21 85.73 93.36 98.76 87.71 93.48 97.30 87.25 2 0 26.99-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 279 91.51 100.37 87.53 91.75 100.59 88.47 90.89 101.76 85.57 90.21 101.85 84.54 90.40 100.97 86.76 89.55 101.84 87.68 3 0 25.63-999 ?-999 ?-999 ? CA CA D1124 mALA~B 280 92.07 102.38 85.68 92.51 102.29 86.58 92.81 102.17 83.35 92.40 102.52 82.23 92.64 103.10 84.55 93.98 103.73 84.93 2 0 29.05-999 ?-999 ?-999 ? CA CA D1124 mASN~B 281 93.36 100.97 83.57 93.65 100.81 84.51 92.17 99.49 82.00 91.94 99.25 80.81 93.51 100.00 82.48 94.38 98.83 82.94 2 0 30.79-999 ?-999 ?-999 ? CA CA D1124 mILE~B 282 91.25 99.28 82.95 91.57 99.42 83.89 89.28 99.99 81.72 88.54 99.73 80.78 89.89 98.89 82.58 89.03 98.65 83.83 3 0 28.36-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 283 89.64 101.23 82.06 90.23 101.31 82.86 89.72 102.30 79.85 89.02 102.51 78.86 89.14 102.35 81.26 89.48 103.68 81.93 2 0 29.28-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 284 91.00 101.98 79.75 91.46 101.86 80.63 90.95 100.73 77.66 90.55 100.89 76.51 91.65 101.82 78.46 93.11 101.41 78.68 2 0 32.91-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 285 90.83 99.56 78.29 91.14 99.56 79.24 88.87 98.63 77.11 88.54 98.33 75.96 90.29 98.39 77.60 90.34 97.17 78.54 2 0 32.67-999 ?-999 ?-999 ? CA CA D1124 mPHE~B 286 88.03 99.19 77.97 88.42 99.35 78.87 86.60 100.41 76.37 85.75 100.24 75.49 86.65 99.52 77.61 85.97 100.23 78.79 3 0 30.90-999 ?-999 ?-999 ? CA CA D1124 mGLN~B 287 87.47 101.41 76.30 88.11 101.49 77.06 87.68 101.47 73.87 86.94 101.53 72.89 87.42 102.30 75.13 88.48 103.39 75.26 2 0 33.69-999 ?-999 ?-999 ? CA CA D1124 mALA~B 288 88.73 100.67 73.98 89.21 100.76 74.86 88.03 98.82 72.51 87.75 98.71 71.31 89.15 99.75 72.94 90.39 98.98 73.38 2 0 35.13-999 ?-999 ?-999 ? CA CA B1132 mMET~B 289 87.35 98.16 73.46 87.61 98.38 74.40 85.05 97.85 72.57 84.29 97.26 71.80 86.32 97.19 73.08 85.99 96.25 74.24 2 0 31.99-999 ?-999 ?-999 ? CA CA B1132 mTYR~B 290 84.75 99.07 73.00 85.42 99.54 73.58 83.55 100.95 71.87 82.51 101.51 71.49 83.46 99.61 72.56 82.49 99.68 73.75 3 0 33.98-999 ?-999 ?-999 ? CA CA B1132 mGLY~B 291 84.74 101.51 71.69 85.50 101.02 72.14 84.25 103.94 71.51 84.16 104.98 70.86 84.92 102.72 70.92-999.99-999.99-999.99 1 0 36.64-999 ?-999 ?-999 ? CA CA D1124 mLYS.B 292 83.77 103.81 72.73 83.82 102.86 73.05 83.89 104.77 74.94 84.31 103.70 75.38 83.23 104.87 73.56 81.71 104.77 73.67 2 0 33.97-999 ?-999 ?-999 ? CA CA D1124 mSER~B 293 84.06 105.90 75.61 83.70 106.73 75.18 83.77 105.32 77.96 82.58 105.56 77.82 84.75 105.83 76.90 85.28 107.20 77.33 2 0 31.65-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 294 84.35 104.67 78.95 85.32 104.49 78.81 82.89 105.49 80.73 81.68 105.46 80.94 83.60 104.26 80.14 84.57 103.61 81.13 3 0 27.95-999 ?-999 ?-999 ? CA CA D1124 mTYR~B 295 83.62 106.58 80.91 84.58 106.45 80.68 81.79 108.24 80.67 80.73 108.51 81.25 83.07 107.85 81.38 84.12 108.98 81.21 3 0 27.67-999 ?-999 ?-999 ? CA CA D1124 mGLU~B 296 81.87 108.43 79.35 82.75 108.25 78.91 79.56 107.86 78.76 78.38 108.19 78.72 80.66 108.90 78.67 80.97 109.29 77.22 2 0 29.66-999 ?-999 ?-999 ? CA CA D1124 mPHE~B 297 79.95 106.60 78.94 80.94 106.45 78.92 78.23 105.74 80.46 77.00 105.76 80.54 78.96 105.54 79.14 79.64 104.17 79.12 3 0 27.76-999 ?-999 ?-999 ? CA CA D1124 mILE~B 298 78.98 105.88 81.54 79.97 105.82 81.39 77.47 107.38 82.77 76.33 107.42 83.23 78.32 106.12 82.83 79.41 106.24 83.92 3 0 24.36-999 ?-999 ?-999 ? CA CA D1124 mALA~B 299 78.02 108.44 82.17 78.94 108.27 81.81 75.98 109.62 81.39 75.00 110.27 81.78 77.35 109.72 82.05 78.22 110.69 81.24 2 0 26.25-999 ?-999 ?-999 ? CA CA D1124 mASP~B 300 75.91 108.82 80.33 76.76 108.33 80.11 73.72 107.70 80.25 72.54 107.63 79.90 74.66 108.69 79.59 74.97 108.27 78.15 2 0 27.73-999 ?-999 ?-999 ? CA CA D1124 mASP~B 301 74.21 106.91 81.19 75.17 107.08 81.42 72.94 106.25 83.24 72.01 105.61 83.75 73.38 105.90 81.83 74.15 104.57 81.86 2 0 24.61-999 ?-999 ?-999 ? CA CA D1124 mCYH~B 302 73.61 107.19 83.90 74.32 107.65 83.36 72.78 108.95 85.41 72.93 109.75 84.49 73.29 107.52 85.29 74.53 107.35 86.17 2 0 21.99-999 ?-999 ?-999 ? CA CA D1124 mSER~B 303 72.19 109.29 86.56 72.11 108.58 87.25 72.02 111.23 88.08 72.27 110.46 89.01 71.72 110.68 86.69 70.22 110.77 86.39 2 0 22.34-999 ?-999 ?-999 ? CA CA D1124 mGLY~B 304 71.97 112.55 88.20 71.88 113.01 87.32 73.34 113.19 90.20 74.43 113.16 89.64 72.04 113.28 89.44-999.99-999.99-999.99 1 0 21.81-999 ?-999 ?-999 ? CA CA D1124 mASP~B 305 73.26 113.19 91.53 72.34 113.24 91.91 75.13 111.72 92.21 76.34 111.57 92.35 74.50 113.11 92.31 74.20 113.44 93.77 2 0 19.75-999 ?-999 ?-999 ? CA CA D1124 mTYR~B 306 74.31 110.71 91.95 73.34 110.96 91.93 75.81 109.37 90.55 76.98 109.03 90.69 74.82 109.35 91.71 73.65 108.41 91.44 3 0 17.60-999 ?-999 ?-999 ? CA CA D1124 mLYS~B 307 75.37 109.84 89.38 74.42 110.13 89.36 77.50 110.78 88.56 78.62 110.44 88.17 76.30 109.90 88.25 75.59 110.39 87.00 2 0 20.87-999 ?-999 ?-999 ? CA CA D1124 mASP~B 308 77.28 111.88 89.28 76.33 112.02 89.54 79.47 112.07 90.38 80.66 112.14 90.07 78.38 112.79 89.62 77.86 113.97 90.45 2 0 22.04-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 309 79.10 111.34 91.43 78.12 111.35 91.64 80.80 109.57 91.28 82.01 109.43 91.25 80.11 110.59 92.18 79.41 109.90 93.35 3 0 19.38-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 310 80.01 108.82 90.51 79.03 109.01 90.56 81.55 108.40 88.64 82.62 107.88 88.35 80.61 107.79 89.67 79.50 107.01 88.96 3 0 19.84-999 ?-999 ?-999 ? CA CA D1124 mLEU~B 311 81.15 109.54 88.05 80.26 109.88 88.33 83.34 110.63 87.69 84.40 110.59 87.09 82.03 110.17 87.07 81.33 111.36 86.42 3 0 23.59-999 ?-999 ?-999 ? CA CA D1124 mGLN~B 312 83.27 111.11 88.93 82.38 111.06 89.37 85.41 110.52 89.95 86.63 110.61 89.83 84.48 111.65 89.55 84.12 112.57 90.72 2 0 23.69-999 ?-999 ?-999 ? CA CA D1124 mILE~B 313 84.83 109.43 90.44 83.83 109.46 90.51 86.42 107.76 89.64 87.58 107.38 89.74 85.67 108.30 90.85 84.75 107.22 91.45 3 0 21.73-999 ?-999 ?-999 ? CA CA D1124 mTHR~B 314 85.72 107.71 88.52 84.81 108.11 88.60 87.20 108.05 86.57 88.31 107.64 86.20 86.23 107.12 87.29 85.08 106.76 86.33 2 0 24.08-999 ?-999 ?-999 ? CA CA D1124 mGLY~B 315 86.78 109.28 86.32 85.86 109.47 86.67 87.34 110.15 84.13 86.75 109.15 83.70 87.60 110.26 85.62-999.99-999.99-999.99 1 0 27.32-999 ?-999 ?-999 ? CA CA D1124 mHIS.B 316 87.77 111.12 83.33 88.23 111.89 83.78 88.35 109.88 81.28 87.90 109.31 80.26 87.53 111.01 81.89 87.85 112.33 81.20 3 0 30.39-999 ?-999 ?-999 ? CA CA D1124 mVAL.C 2 106.90 112.71 141.04 106.85 113.51 141.65 105.66 110.80 140.14 105.06 110.56 141.20 106.99 111.54 140.16 108.10 110.58 140.62 3 0 35.78-999 ?-999 ?-999 ? CA CA F1126 mVAL.C 3 105.16 110.42 138.96 105.73 110.61 138.16 103.98 108.27 139.13 104.65 107.58 138.38 103.85 109.78 138.96 103.01 110.17 137.74 3 0 32.29-999 ?-999 ?-999 ? CA CA F1126 mGLN.C 4 103.33 107.77 140.18 102.79 108.43 140.70 102.27 105.93 141.43 101.57 106.78 141.99 103.43 106.36 140.53 104.77 106.13 141.24 2 0 29.79-999 ?-999 ?-999 ? CA CA F1126 mGLY.C 5 102.07 104.61 141.54 102.71 104.05 141.01 101.51 103.82 143.80 102.57 104.34 144.17 101.02 104.05 142.38-999.99-999.99-999.99 1 0 26.55-999 ?-999 ?-999 ? CA CA F1126 mTHR.C 6 100.75 103.06 144.58 99.92 102.73 144.14 101.34 101.25 146.15 101.76 100.82 147.22 101.09 102.75 145.96 99.98 103.14 146.95 2 0 26.37-999 ?-999 ?-999 ? CA CA F1126 mVAL.C 7 101.04 100.44 145.13 100.71 100.89 144.30 102.41 98.56 144.45 102.48 98.85 143.26 101.23 99.00 145.31 99.95 98.20 144.97 3 0 24.57-999 ?-999 ?-999 ? CA CA F1126 mLYS.C 8 103.38 97.92 145.09 103.19 97.78 146.06 104.75 95.96 144.64 104.26 95.46 145.65 104.61 97.47 144.43 105.84 98.19 144.99 2 0 26.94-999 ?-999 ?-999 ? CA CA F1126 mPRO.C 9 105.35 95.28 143.68 105.69 95.85 142.94 106.22 93.38 145.00 107.20 94.02 145.38 105.50 93.82 143.72 106.43 93.53 142.54 3 0 26.75-999 ?-999 ?-999 ? CA CA F1126 mHIS.C 10 105.73 92.31 145.62 104.93 91.90 145.18 107.71 91.16 146.60 107.89 90.33 145.70 106.35 91.81 146.84 105.43 90.82 147.55 3 0 27.82-999 ?-999 ?-999 ? CA CA F1126 mALA.C 11 108.68 91.50 147.45 108.42 92.17 148.14 109.92 89.40 147.52 108.90 88.96 148.07 110.01 90.91 147.32 110.96 91.51 148.35 2 0 31.40-999 ?-999 ?-999 ? CA CA F1126 mSER.C 12 110.92 88.67 147.07 111.61 89.21 146.60 109.68 86.52 146.97 109.15 85.83 147.84 111.01 87.22 147.26 111.44 86.88 148.69 2 0 32.32-999 ?-999 ?-999 ? CA CA F1126 mPHE.C 13 109.08 86.82 145.82 109.65 87.34 145.19 107.61 84.90 145.30 108.31 84.34 144.47 107.72 86.40 145.54 107.18 87.14 144.30 3 0 28.82-999 ?-999 ?-999 ? CA CA F1126 mASN~C 14 106.67 84.25 145.99 106.19 84.80 146.68 104.90 82.63 145.65 104.23 82.69 146.69 106.40 82.85 145.71 107.02 81.92 146.76 2 0 28.08-999 ?-999 ?-999 ? CA CA F1126 mSER~C 15 104.39 82.47 144.44 105.06 82.39 143.71 102.38 81.11 144.79 101.31 81.10 145.40 102.94 82.42 144.24 102.62 82.53 142.75 2 0 24.62-999 ?-999 ?-999 ? CA CA F1126 mARG~C 16 103.11 80.02 144.59 103.94 80.14 144.05 102.50 78.87 146.66 101.49 78.49 147.25 102.68 78.75 145.16 103.68 77.63 144.82 2 0 24.68-999 ?-999 ?-999 ? CA CA A1131 mGLU~C 17 103.49 79.44 147.34 104.27 79.74 146.80 102.17 80.48 149.10 101.30 80.17 149.92 103.37 79.59 148.79 104.64 80.22 149.37 2 0 24.47-999 ?-999 ?-999 ? CA CA A1131 mASP~C 18 102.10 81.60 148.37 102.82 81.72 147.70 99.66 81.87 148.42 98.76 82.03 149.25 101.01 82.54 148.60 101.16 83.75 147.68 2 0 23.84-999 ?-999 ?-999 ? CA CA F1126 mALA~C 19 99.52 81.06 147.37 100.31 80.99 146.76 97.98 79.44 148.39 96.85 79.29 148.84 98.25 80.35 147.20 98.27 79.56 145.90 2 0 21.64-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 20 99.03 78.80 148.90 99.91 78.99 148.47 98.40 78.67 151.26 97.60 78.20 152.06 98.84 77.89 150.03 100.08 77.04 150.29 2 0 21.03-999 ?-999 ?-999 ? CA CA A1131 mTHR~C 21 98.88 79.91 151.37 99.50 80.18 150.64 97.01 81.12 152.43 96.34 81.23 153.46 98.50 80.78 152.48 99.30 82.10 152.41 2 0 23.25-999 ?-999 ?-999 ? CA CA A1131 mLEU~C 22 96.51 81.33 151.22 97.16 81.21 150.48 94.19 80.53 151.30 93.15 80.67 151.95 95.11 81.71 151.01 94.94 82.21 149.57 3 0 20.11-999 ?-999 ?-999 ? CA CA F1126 mARG~C 23 94.57 79.33 150.87 95.41 79.34 150.32 93.68 77.94 152.70 92.60 77.70 153.24 93.81 78.13 151.19 94.49 76.90 150.59 2 0 20.20-999 ?-999 ?-999 ? CA CA A1131 mLYS~C 24 94.80 78.05 153.41 95.62 78.24 152.87 93.87 78.90 155.51 93.24 78.59 156.53 94.80 77.90 154.85 96.22 78.07 155.39 2 0 19.65-999 ?-999 ?-999 ? CA CA A1131 mALA~C 25 93.81 80.13 154.99 94.33 80.30 154.16 91.50 80.88 155.47 90.64 81.47 156.12 92.98 81.12 155.69 93.38 82.53 155.32 2 0 21.69-999 ?-999 ?-999 ? CA CA F1126 mMET~C 26 91.15 80.00 154.54 91.92 79.59 154.04 89.36 78.27 154.72 88.18 77.93 154.76 89.75 79.68 154.30 89.43 79.83 152.81 2 0 19.42-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 27 90.32 77.38 154.96 91.26 77.72 154.93 89.56 75.81 156.71 90.17 76.40 157.59 89.94 76.00 155.25 91.07 75.04 154.87 2 0 17.94-999 ?-999 ?-999 ? CA CA A1131 mGLY.C 28 88.54 74.99 156.96 88.09 74.63 156.14 87.29 75.67 159.01 86.47 76.38 158.41 88.13 74.64 158.30-999.99-999.99-999.99 1 0 17.33-999 ?-999 ?-999 ? CA CA A1131 mILE.C 29 87.44 75.75 160.33 88.12 75.13 160.72 86.93 78.12 160.72 88.06 78.60 160.86 86.64 76.68 161.12 86.86 76.57 162.63 3 0 20.34-999 ?-999 ?-999 ? CA CA A1131 mGLY.C 30 85.91 78.80 160.21 85.08 78.25 160.09 86.94 80.54 158.75 87.30 79.72 157.91 85.97 80.19 159.86-999.99-999.99-999.99 1 0 22.10-999 ?-999 ?-999 ? CA CA F1126 mTHR.C 31 87.34 81.80 158.76 87.03 82.28 159.59 89.14 83.41 158.34 88.82 84.16 159.27 88.12 82.46 157.73 87.18 83.28 156.82 2 0 20.25-999 ?-999 ?-999 ? CA CA F1126 mASP~C 32 90.36 83.39 157.82 90.51 82.72 157.10 91.41 85.55 157.40 92.29 85.70 156.56 91.38 84.33 158.32 92.75 83.65 158.35 2 0 21.86-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 33 90.39 86.39 157.54 89.75 86.18 158.27 91.56 88.39 156.73 92.03 88.98 155.75 90.29 87.55 156.65 89.08 88.39 157.05 2 0 19.46-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 34 92.15 88.42 157.93 91.70 87.87 158.63 94.51 88.72 157.28 95.27 89.52 156.73 93.36 89.21 158.14 93.74 89.21 159.63 2 0 22.45-999 ?-999 ?-999 ? CA CA F1126 mSER~C 35 94.62 87.41 157.09 93.94 86.85 157.58 95.35 87.08 154.76 96.22 87.22 153.90 95.67 86.87 156.23 95.86 85.38 156.53 2 0 22.65-999 ?-999 ?-999 ? CA CA F1126 mILE~C 36 94.06 87.10 154.42 93.40 86.97 155.16 94.01 88.73 152.58 94.57 88.98 151.51 93.72 87.30 153.01 92.24 86.93 152.77 3 0 19.01-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 37 93.65 89.68 153.42 93.19 89.31 154.23 95.38 91.35 153.00 95.80 92.05 152.08 93.89 91.10 153.21 93.40 91.87 154.45 2 0 19.37-999 ?-999 ?-999 ? CA CA F1126 mHIS~C 38 96.18 90.69 153.83 95.72 90.11 154.50 98.18 90.37 152.40 99.04 91.03 151.81 97.63 90.83 153.74 98.35 90.08 154.86 3 0 22.57-999 ?-999 ?-999 ? CA CA F1126 mILE~C 39 97.71 89.24 151.88 96.99 88.77 152.39 97.82 89.63 149.45 98.63 90.01 148.59 98.28 88.77 150.61 97.94 87.29 150.37 3 0 21.37-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 40 96.53 89.98 149.46 96.00 89.66 150.25 96.61 92.18 148.32 96.96 92.65 147.24 95.99 90.78 148.37 94.47 90.90 148.48 3 0 18.43-999 ?-999 ?-999 ? CA CA F1126 mALA~C 41 96.73 92.79 149.49 96.50 92.20 150.27 98.65 94.37 149.44 99.08 95.47 149.07 97.16 94.17 149.62 96.72 94.73 150.96 2 0 20.65-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 42 99.48 93.35 149.68 99.04 92.48 149.91 101.59 92.88 148.43 102.82 92.88 148.32 100.92 93.57 149.61 101.64 93.13 150.90 2 0 23.83-999 ?-999 ?-999 ? CA CA F1126 mARG~C 43 100.79 92.29 147.55 99.83 92.27 147.83 100.74 92.63 145.17 99.73 93.28 145.42 101.29 91.74 146.29 100.85 90.30 146.09 2 0 22.80-999 ?-999 ?-999 ? CA CA F1126 mSER~C 44 101.40 92.66 144.03 102.22 92.09 144.01 99.92 92.70 142.07 99.81 91.48 142.20 100.93 93.49 142.91 102.13 93.86 142.03 2 0 22.15-999 ?-999 ?-999 ? CA CA F1126 mASN~C 45 99.21 93.38 141.18 99.40 94.36 141.14 98.84 91.54 139.57 98.32 90.43 139.58 98.23 92.71 140.33 97.55 93.68 139.35 2 0 19.22-999 ?-999 ?-999 ? CA CA F1126 mALA~C 46 99.96 91.79 138.89 100.30 92.73 138.93 100.92 89.51 139.06 100.80 88.36 138.64 100.59 90.69 138.15 101.85 91.18 137.45 2 0 21.39-999 ?-999 ?-999 ? CA CA F1126 mGLN~C 47 101.33 89.79 140.29 101.41 90.76 140.50 100.35 88.01 141.65 100.27 86.79 141.73 101.64 88.71 141.24 102.40 89.25 142.45 2 0 22.22-999 ?-999 ?-999 ? CA CA F1126 mARG~C 48 99.29 88.81 141.81 99.47 89.78 141.71 97.52 87.29 141.02 96.85 86.28 141.24 97.97 88.23 142.12 96.96 89.35 142.33 2 0 18.62-999 ?-999 ?-999 ? CA CA F1126 mGLN~C 49 97.93 87.56 139.77 98.56 88.33 139.67 98.12 85.36 138.72 97.54 84.35 138.31 97.44 86.73 138.68 97.65 87.41 137.33 2 0 18.22-999 ?-999 ?-999 ? CA CA F1126 mGLN~C 50 99.37 85.36 139.16 99.73 86.26 139.41 99.65 83.32 140.45 99.53 82.10 140.39 100.12 84.11 139.23 101.62 84.39 139.32 2 0 21.24-999 ?-999 ?-999 ? CA CA F1126 mILE~C 51 99.30 84.04 141.51 99.50 85.02 141.44 97.36 82.75 142.28 97.08 81.63 142.72 98.68 83.42 142.66 98.42 84.41 143.80 3 0 20.07-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 52 96.57 83.41 141.43 96.91 84.30 141.12 95.49 81.55 140.22 94.86 80.53 140.51 95.29 82.84 141.01 94.46 83.83 140.18 2 0 16.92-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 53 96.41 81.62 139.26 96.84 82.51 139.16 97.18 79.29 139.29 96.81 78.13 139.07 96.73 80.46 138.42 97.84 80.82 137.42 2 0 19.28-999 ?-999 ?-999 ? CA CA F1126 mASP~C 54 97.99 79.60 140.31 98.19 80.57 140.46 97.43 77.91 142.05 97.40 76.71 142.32 98.49 78.49 141.13 99.74 78.93 141.90 2 0 21.64-999 ?-999 ?-999 ? CA CA F1126 mTYR~C 55 96.53 78.75 142.56 96.62 79.72 142.31 94.62 77.23 142.63 94.30 76.12 143.06 95.48 78.20 143.43 94.67 79.34 144.03 3 0 19.41-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 56 94.28 77.61 141.40 94.67 78.47 141.10 94.07 75.48 140.20 93.47 74.41 140.17 93.39 76.78 140.60 92.89 77.54 139.36 2 0 18.37-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 57 95.37 75.59 139.90 95.76 76.51 139.91 96.24 73.50 140.82 96.06 72.29 140.71 96.11 74.37 139.58 97.49 74.67 138.97 2 0 22.02-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 58 96.54 74.08 141.96 96.66 75.06 141.86 95.36 72.74 143.65 95.36 71.61 144.14 96.68 73.39 143.23 97.07 74.33 144.38 3 0 19.54-999 ?-999 ?-999 ? CA CA A1131 mPHE~C 59 94.28 73.51 143.52 94.38 74.35 142.99 91.89 72.78 143.22 90.93 72.11 143.63 93.04 73.06 144.16 92.69 74.07 145.27 3 0 18.38-999 ?-999 ?-999 ? CA CA A1131 mGLY~C 60 91.90 73.18 141.95 92.69 73.75 141.69 89.54 73.58 141.26 88.45 73.21 140.84 90.83 72.80 141.05-999.99-999.99-999.99 1 0 19.58-999 ?-999 ?-999 ? CA CA F1126 mLYS.C 61 89.66 74.71 141.95 90.56 74.81 142.37 89.25 77.06 141.85 90.42 77.18 142.23 88.60 75.69 142.08 87.97 75.67 143.46 2 0 16.00-999 ?-999 ?-999 ? CA CA F1126 mHIS~C 62 88.54 78.04 141.33 87.61 77.80 141.05 89.08 80.18 142.47 88.07 80.25 143.17 89.14 79.38 141.19 88.47 80.13 140.04 3 0 13.49-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 63 90.17 80.89 142.77 90.94 80.72 142.16 89.03 82.77 143.92 88.49 83.04 144.99 90.22 81.81 143.90 91.52 82.62 143.82 3 0 13.24-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 64 88.63 83.33 142.78 89.15 83.07 141.97 86.26 83.55 143.35 85.48 84.11 144.12 87.49 84.26 142.78 87.15 84.78 141.39 2 0 9.48-999 ?-999 ?-999 ? CA CA F1126 mASP~C 65 86.10 82.29 142.96 86.83 81.95 142.36 85.00 81.18 144.86 83.97 81.08 145.54 84.95 81.51 143.38 84.83 80.27 142.52 2 0 9.51-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 66 86.21 81.04 145.42 87.00 81.07 144.81 85.83 82.14 147.55 85.04 82.13 148.50 86.28 80.86 146.87 87.68 80.44 147.32 2 0 12.19-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 67 86.35 83.29 147.10 86.92 83.24 146.28 84.56 84.85 147.79 83.98 85.33 148.77 86.05 84.51 147.86 86.94 85.66 147.39 3 0 10.72-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 68 83.93 84.62 146.65 84.56 84.29 145.95 81.65 84.04 147.41 80.54 84.46 147.75 82.51 84.81 146.40 82.15 84.30 145.00 2 0 7.68-999 ?-999 ?-999 ? CA CA F1126 mSER~C 69 82.16 82.91 147.89 83.05 82.64 147.52 81.87 82.53 150.30 81.07 82.66 151.24 81.42 82.16 148.90 81.62 80.64 148.70 2 0 10.80-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 70 83.18 82.67 150.48 83.73 82.61 149.64 83.64 84.33 152.28 83.60 84.53 153.50 83.75 82.90 151.80 85.22 82.45 151.80 2 0 13.38-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 71 83.62 85.32 151.39 83.64 85.00 150.44 82.21 87.36 151.47 81.46 86.90 150.61 83.56 86.72 151.78 84.64 87.54 151.05 3 0 12.13-999 ?-999 ?-999 ? CA CA F1126 mSER~C 72 81.93 88.50 152.10 82.62 88.80 152.77 80.88 90.73 151.76 81.89 91.30 152.15 80.70 89.21 151.82 79.64 88.90 152.89 2 0 11.35-999 ?-999 ?-999 ? CA CA F1126 mGLY~C 73 79.81 91.40 151.35 79.08 90.82 151.00 80.85 93.55 150.69 81.44 93.04 149.75 79.71 92.84 151.40-999.99-999.99-999.99 1 0 11.61-999 ?-999 ?-999 ? CA CA F1126 mASN~C 74 81.11 94.77 151.13 80.55 95.07 151.90 83.48 94.87 150.52 84.28 94.94 149.59 82.14 95.59 150.50 82.22 96.94 151.21 2 0 12.39-999 ?-999 ?-999 ? CA CA F1126 mTYR~C 75 83.72 94.11 151.59 83.00 94.08 152.27 85.14 92.40 150.53 86.18 92.40 149.87 85.00 93.39 151.68 85.19 92.74 153.04 3 0 13.29-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 76 84.08 91.65 150.23 83.29 91.79 150.82 84.43 91.44 147.83 85.28 91.04 147.03 84.12 90.69 149.12 82.79 89.96 148.93 2 0 9.97-999 ?-999 ?-999 ? CA CA F1126 mALA~C 77 83.69 92.53 147.66 83.07 92.73 148.42 85.20 93.85 146.24 85.70 93.76 145.12 83.79 93.33 146.46 82.78 94.47 146.51 2 0 8.67-999 ?-999 ?-999 ? CA CA F1126 mALA~C 78 85.84 94.40 147.26 85.35 94.37 148.13 88.22 93.93 146.75 89.05 94.07 145.85 87.18 94.98 147.06 87.56 95.83 148.27 2 0 11.90-999 ?-999 ?-999 ? CA CA F1126 mALA~C 79 88.23 92.81 147.49 87.55 92.80 148.22 89.02 91.23 145.76 90.00 91.03 145.05 89.16 91.72 147.20 88.92 90.56 148.17 2 0 12.16-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 80 87.78 91.02 145.32 87.06 91.23 145.98 88.04 91.54 142.95 88.54 91.28 141.86 87.53 90.53 143.97 86.02 90.33 143.79 3 0 8.98-999 ?-999 ?-999 ? CA CA F1126 mALA~C 81 87.84 92.80 143.33 87.40 92.92 144.22 89.80 93.75 142.32 90.39 93.92 141.25 88.29 93.88 142.44 87.90 95.19 143.09 2 0 10.43-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 82 90.44 93.47 143.46 89.87 93.31 144.27 92.39 92.28 142.54 93.50 92.30 142.01 91.90 93.42 143.41 92.46 93.31 144.84 3 0 13.64-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 83 91.54 91.26 142.37 90.63 91.41 142.74 91.82 90.18 140.18 92.50 89.47 139.44 91.94 90.05 141.69 91.13 88.84 142.19 3 0 12.64-999 ?-999 ?-999 ? CA CA F1126 mARG~C 84 90.92 91.06 139.76 90.42 91.53 140.49 91.93 91.86 137.65 92.61 92.73 138.18 90.69 91.30 138.34 89.54 92.31 138.18 2 0 11.77-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 85 92.19 91.41 136.42 91.71 90.58 136.13 92.57 93.56 135.37 91.35 93.72 135.36 93.15 92.17 135.60 93.41 91.45 134.29 2 0 14.99-999 ?-999 ?-999 ? CA CA F1126 mPRO~C 86 93.42 94.58 135.31 94.37 94.29 135.25 92.04 96.35 134.20 91.09 97.10 134.44 92.99 95.97 135.32 94.30 96.76 135.18 3 0 16.25-999 ?-999 ?-999 ? CA CA F1126 mASP~C 87 92.28 95.89 132.98 93.10 95.32 132.90 90.04 95.47 132.07 88.99 96.04 131.81 91.37 96.20 131.88 92.00 95.83 130.54 2 0 16.55-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 88 90.11 94.24 132.56 91.05 93.91 132.69 88.12 94.11 133.97 86.89 94.16 133.88 88.93 93.45 132.87 89.28 92.01 133.26 2 0 13.11-999 ?-999 ?-999 ? CA CA F1126 mPHE~C 89 88.78 94.59 135.02 89.77 94.46 134.97 87.28 96.44 135.63 86.18 96.76 136.09 88.09 95.24 136.13 89.10 95.67 137.20 3 0 11.71-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 90 87.82 97.16 134.65 88.69 96.84 134.28 85.92 98.01 133.30 84.86 98.63 133.43 87.09 98.36 134.21 88.06 99.35 133.57 3 0 13.85-999 ?-999 ?-999 ? CA CA F1126 mALA~C 91 86.13 97.02 132.44 87.06 96.65 132.45 83.87 96.07 132.39 82.73 96.22 131.97 85.07 96.52 131.56 85.56 95.39 130.68 2 0 13.18-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 92 84.16 95.50 133.56 85.14 95.47 133.78 82.48 96.12 135.22 81.28 96.16 135.50 83.10 94.99 134.42 83.62 93.88 135.32 2 0 9.51-999 ?-999 ?-999 ? CA CA F1126 mGLN~C 93 83.29 97.13 135.52 84.26 97.02 135.30 81.67 98.94 135.20 80.57 99.30 135.59 82.67 98.31 136.16 83.74 99.31 136.61 2 0 11.04-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 94 82.02 99.02 133.92 82.94 98.67 133.73 79.86 98.73 132.80 78.76 99.28 132.84 81.13 99.57 132.90 81.85 99.61 131.55 3 0 10.39-999 ?-999 ?-999 ? CA CA C1123 mHIS~C 95 80.08 97.43 132.67 81.05 97.17 132.67 77.99 96.64 133.66 76.79 96.75 133.42 78.99 96.47 132.53 79.51 95.02 132.54 3 0 8.71-999 ?-999 ?-999 ? CA CA C1123 mALA~C 96 78.49 96.69 134.89 79.49 96.61 134.95 76.94 98.23 136.05 75.82 98.40 136.53 77.61 96.86 136.05 78.39 96.65 137.34 2 0 7.62-999 ?-999 ?-999 ? CA CA C1123 mALA~C 97 77.62 99.23 135.51 78.51 98.99 135.12 75.84 100.67 134.59 75.00 101.55 134.80 77.06 100.57 135.50 78.12 101.59 135.07 2 0 6.74-999 ?-999 ?-999 ? CA CA C1123 mMET~C 98 75.78 99.78 133.62 76.52 99.10 133.69 73.68 98.70 132.71 72.53 98.93 132.34 74.79 99.74 132.56 75.50 99.42 131.23 2 0 -4.19-999 ?-999 ?-999 ? CA CA C1123smLYS~C 99 74.04 97.49 133.13 74.99 97.43 133.45 72.55 95.99 134.47 71.86 94.97 134.60 73.13 96.36 133.11 73.80 95.13 132.47 2 0 -3.67-999 ?-999 ?-999 ? CA CA C1123smGLY~C 100 72.77 96.81 135.49 73.46 97.51 135.33 70.71 97.43 136.63 70.37 97.89 135.53 72.02 96.66 136.73-999.99-999.99-999.99 1 0 -4.20-999 ?-999 ?-999 ? CA CA C1123smLEU.C 101 69.97 97.60 137.72 70.34 97.12 138.51 69.11 99.86 137.43 69.77 100.53 138.25 68.75 98.41 137.74 68.14 98.34 139.13 3 0 4.68-999 ?-999 ?-999 ? CA CA C1123 mGLY.C 102 68.74 100.38 136.27 68.22 99.78 135.66 70.55 101.88 135.48 71.21 100.87 135.21 69.12 101.76 135.97-999.99-999.99-999.99 1 0 -3.93-999 ?-999 ?-999 ? CA CA C1123smTHR.C 103 71.03 103.10 135.33 70.39 103.81 135.64 73.18 104.18 135.79 72.70 105.20 136.30 72.35 103.40 134.78 72.20 104.20 133.48 2 0 4.71-999 ?-999 ?-999 ? CA CA C1123 mASP~C 104 74.40 103.74 136.11 74.62 102.84 135.75 76.12 105.47 136.02 77.24 105.18 135.60 75.33 104.52 136.93 76.32 103.64 137.69 2 0 7.82-999 ?-999 ?-999 ? CA CA C1123 mLYS~C 105 75.53 106.62 135.73 74.66 106.79 136.19 77.45 108.13 135.28 78.35 108.33 134.47 76.16 107.53 134.78 75.13 108.56 134.31 2 0 10.06-999 ?-999 ?-999 ? CA CA C1123 mASN~C 106 77.58 108.38 136.58 76.78 108.16 137.14 79.99 107.96 136.89 81.11 108.38 136.61 78.84 108.94 137.07 78.73 109.37 138.53 2 0 13.18-999 ?-999 ?-999 ? CA CA C1123 mALA~C 107 79.72 106.66 137.00 78.78 106.43 137.27 81.11 105.64 135.24 82.31 105.57 134.90 80.76 105.68 136.72 80.43 104.32 137.28 2 0 12.36-999 ?-999 ?-999 ? CA CA C1123 mLEU~C 108 80.16 105.75 134.32 79.22 105.77 134.67 81.42 107.06 132.64 82.37 106.98 131.87 80.52 105.84 132.90 79.30 105.97 131.99 3 0 11.86-999 ?-999 ?-999 ? CA CA C1123 mILE~C 109 81.12 108.18 133.29 80.31 108.13 133.88 83.36 109.17 133.71 84.36 109.47 133.06 81.96 109.37 133.13 81.30 110.60 133.76 3 0 15.18-999 ?-999 ?-999 ? CA CA C1123 mASP~C 110 83.47 108.64 134.93 82.60 108.46 135.39 85.65 107.49 134.61 86.86 107.63 134.56 84.78 108.36 135.52 84.61 107.61 136.84 2 0 16.89-999 ?-999 ?-999 ? CA CA C1123 mILE~C 111 85.02 106.52 133.94 84.02 106.53 134.00 86.03 105.97 131.75 87.15 105.83 131.24 85.79 105.54 133.18 85.09 104.17 133.23 3 0 16.34-999 ?-999 ?-999 ? CA CA C1123 mLEU~C 112 85.02 106.50 131.06 84.19 106.69 131.58 85.63 108.17 129.30 86.11 108.43 128.19 85.17 106.76 129.64 83.82 106.50 128.93 3 0 16.76-999 ?-999 ?-999 ? CA CA C1123 mCYH~C 113 85.51 109.12 130.21 85.16 108.82 131.10 87.27 110.89 130.34 87.68 112.04 130.17 85.86 110.50 129.90 84.85 111.42 130.59 2 0 19.25-999 ?-999 ?-999 ? CA CA C1123 mTHR.C 114 88.05 109.98 130.91 87.65 109.06 130.92 90.49 109.45 130.94 91.54 109.44 131.59 89.35 110.29 131.49 89.28 110.02 133.01 2 0 21.77-999 ?-999 ?-999 ? CA CA C1123 mGLN.C 115 90.34 108.73 129.84 89.46 108.90 129.39 92.08 108.28 128.10 91.57 109.06 127.30 91.32 107.79 129.33 90.63 106.49 128.88 2 0 22.70-999 ?-999 ?-999 ? CA CA C1123 mSER~C 116 93.25 107.67 127.89 93.55 107.10 128.65 93.36 106.95 125.57 92.57 106.05 125.89 94.01 107.82 126.65 95.43 107.28 126.90 2 0 25.76-999 ?-999 ?-999 ? CA CA C1123 mASN~C 117 93.72 107.15 124.31 94.35 107.91 124.14 93.58 104.82 123.60 92.77 103.90 123.48 93.17 106.26 123.29 93.65 106.63 121.89 2 0 25.66-999 ?-999 ?-999 ? CA CA C1123 mALA~C 118 94.83 104.63 124.01 95.36 105.47 124.14 94.52 102.56 125.33 94.16 101.39 125.21 95.33 103.27 124.24 96.79 103.31 124.64 2 0 26.60-999 ?-999 ?-999 ? CA CA C1123 mGLN~C 119 94.25 103.31 126.39 94.61 104.24 126.31 92.08 102.43 127.14 91.61 101.36 127.53 93.50 102.83 127.54 93.49 103.90 128.63 2 0 23.81-999 ?-999 ?-999 ? CA CA F1126 mILE~C 120 91.42 103.26 126.33 91.91 104.10 126.08 90.04 101.67 125.02 89.13 100.84 125.06 90.07 102.91 125.89 89.43 104.10 125.16 3 0 21.11-999 ?-999 ?-999 ? CA CA C1123 mHIS~C 121 91.02 101.53 124.12 91.72 102.25 124.14 91.18 99.09 123.99 90.61 98.06 123.62 91.01 100.39 123.21 92.09 100.54 122.14 3 0 22.77-999 ?-999 ?-999 ? CA CA C1123 mALA~C 122 91.93 99.17 125.09 92.29 100.08 125.30 90.94 97.63 126.71 90.61 96.46 126.90 92.17 97.96 125.88 93.42 98.08 126.73 2 0 21.52-999 ?-999 ?-999 ? CA CA F1126 mILE~C 123 90.25 98.67 127.17 90.66 99.57 127.00 87.96 97.83 126.93 87.25 96.89 127.31 88.99 98.45 127.86 88.43 99.76 128.45 3 0 18.63-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 124 87.85 98.32 125.70 88.47 99.07 125.48 87.17 96.28 124.49 86.29 95.44 124.33 86.87 97.76 124.77 86.89 98.51 123.44 2 0 18.40-999 ?-999 ?-999 ? CA CA C1123 mALA~C 125 88.46 96.01 124.32 89.07 96.80 124.43 88.62 93.74 125.16 88.20 92.61 124.94 88.92 94.67 123.99 90.41 94.70 123.68 2 0 19.99-999 ?-999 ?-999 ? CA CA F1126 mALA~C 126 88.81 94.24 126.38 89.15 95.18 126.39 87.02 93.23 127.71 86.57 92.14 128.09 88.53 93.45 127.57 89.09 94.11 128.81 2 0 16.54-999 ?-999 ?-999 ? CA CA F1126 mPHE~C 127 86.23 94.25 127.39 86.72 95.08 127.11 84.26 93.08 126.48 83.33 92.33 126.79 84.78 94.14 127.46 84.11 95.48 127.14 3 0 15.15-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 128 84.82 93.08 125.27 85.54 93.76 125.15 84.74 90.71 124.61 84.03 89.76 124.32 84.40 92.15 124.23 85.10 92.50 122.91 2 0 17.40-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 129 85.87 90.57 125.29 86.36 91.44 125.40 85.39 88.75 126.86 84.88 87.63 126.71 86.36 89.31 125.82 87.73 89.52 126.46 3 0 16.29-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 130 85.14 89.51 127.91 85.61 90.40 127.86 82.86 88.83 128.60 82.20 87.95 129.14 84.29 89.14 129.02 84.20 90.30 130.02 3 0 12.52-999 ?-999 ?-999 ? CA CA F1126 mTYR~C 131 82.32 89.63 127.68 82.93 90.23 127.17 80.44 89.14 126.12 79.24 89.07 125.85 80.87 89.55 127.51 80.25 90.90 127.89 3 0 13.14-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 132 81.39 88.94 125.22 82.33 89.06 125.54 80.09 89.60 123.24 79.20 89.31 122.45 81.01 88.56 123.86 80.32 87.20 123.88 2 0 16.77-999 ?-999 ?-999 ? CA CA F1126 mGLU.C 133 80.29 90.85 123.66 81.02 90.94 124.34 80.43 93.16 122.87 81.58 93.21 123.32 79.52 91.97 123.17 78.44 92.41 124.16 2 0 15.36-999 ?-999 ?-999 ? CA CA C1123 mASP~C 134 79.86 94.09 122.12 78.93 93.82 121.84 80.13 96.40 122.79 78.95 96.55 123.09 80.46 95.35 121.73 79.82 95.78 120.41 2 0 15.76-999 ?-999 ?-999 ? CA CA C1123 mLEU~C 135 81.12 97.06 123.36 82.02 96.83 123.00 80.08 99.23 123.89 79.13 99.67 124.55 80.89 98.05 124.41 82.21 98.55 125.01 3 0 13.69-999 ?-999 ?-999 ? CA CA C1123 mGLU~C 136 80.39 99.71 122.69 81.15 99.25 122.23 78.15 100.51 121.96 77.25 101.34 122.17 79.62 100.83 122.14 80.21 101.32 120.82 2 0 14.56-999 ?-999 ?-999 ? CA CA C1123 mLYS~C 137 77.83 99.29 121.55 78.59 98.68 121.35 75.69 98.96 122.75 74.53 99.37 122.85 76.41 98.94 121.42 76.30 97.56 120.76 2 0 13.40-999 ?-999 ?-999 ? CA CA C1123 mGLU~C 138 76.30 98.47 123.83 77.23 98.13 123.66 75.39 99.86 125.66 74.39 100.20 126.29 75.64 98.45 125.13 76.48 97.65 126.12 2 0 9.77-999 ?-999 ?-999 ? CA CA C1123 mILE~C 139 76.39 100.71 125.38 77.15 100.29 124.88 75.16 102.82 125.15 74.41 103.52 125.85 76.35 102.11 125.78 77.67 102.80 125.39 3 0 10.04-999 ?-999 ?-999 ? CA CA C1123 mILE~C 140 74.96 102.64 123.86 75.63 102.03 123.44 72.51 102.78 123.54 71.46 103.39 123.33 73.88 103.29 123.12 74.08 103.06 121.61 3 0 11.67-999 ?-999 ?-999 ? CA CA C1123 mSER~C 141 72.50 101.61 124.17 73.41 101.19 124.24 70.90 101.56 126.06 69.76 101.39 126.51 71.31 100.99 124.71 71.57 99.48 124.93 2 0 9.07-999 ?-999 ?-999 ? CA CA C1123 mGLU~C 142 71.84 102.18 126.79 72.73 102.29 126.36 71.74 104.12 128.32 71.69 104.63 129.44 71.50 102.63 128.13 72.31 101.86 129.18 2 0 6.52-999 ?-999 ?-999 ? CA CA C1123 mTHR~C 143 72.02 104.82 127.22 72.10 104.27 126.39 71.54 106.86 126.03 71.20 106.12 125.11 72.20 106.26 127.27 73.67 106.73 127.29 2 0 9.63-999 ?-999 ?-999 ? CA CA C1123 mSER~C 144 71.39 108.18 125.99 71.72 108.69 126.79 71.14 110.26 124.68 71.78 110.81 125.57 70.78 108.79 124.81 69.25 108.63 124.82 2 0 13.05-999 ?-999 ?-999 ? CA CA C1123 mGLY~C 145 70.72 110.87 123.58 70.23 110.27 122.95 72.40 112.69 123.33 73.32 111.98 122.92 70.94 112.28 123.33-999.99-999.99-999.99 1 0 16.68-999 ?-999 ?-999 ? CA CA C1123 mASN~C 146 72.66 113.89 123.83 71.88 114.37 124.22 74.95 113.63 124.68 76.14 113.51 124.38 74.01 114.44 123.80 74.02 115.91 124.21 2 0 15.64-999 ?-999 ?-999 ? CA CA C1133 mPHE~C 147 74.43 113.11 125.78 73.46 113.28 125.94 75.78 111.08 125.96 76.98 110.81 125.95 75.30 112.34 126.67 74.60 112.08 127.99 3 0 15.58-999 ?-999 ?-999 ? CA CA C1123 mGLN~C 148 74.91 110.34 125.28 73.96 110.66 125.36 76.39 109.52 123.48 77.40 108.82 123.35 75.29 109.19 124.48 74.08 108.65 123.68 2 0 14.29-999 ?-999 ?-999 ? CA CA C1123 mARG~C 149 76.16 110.58 122.72 75.29 111.04 122.93 78.48 111.31 122.27 79.49 110.91 121.68 77.10 111.03 121.69 76.54 112.28 120.97 2 0 17.97-999 ?-999 ?-999 ? CA CA C1123 mLEU~C 150 78.55 111.96 123.43 77.67 112.26 123.80 80.51 110.86 124.38 81.71 110.72 124.16 79.84 112.19 124.07 79.71 112.98 125.38 3 0 18.53-999 ?-999 ?-999 ? CA CA C1123 mLEU~C 151 79.75 109.89 124.90 78.79 110.15 125.03 80.75 107.85 123.96 81.83 107.26 123.85 80.32 108.58 125.22 79.32 107.78 126.05 3 0 15.82-999 ?-999 ?-999 ? CA CA C1123 mVAL~C 152 79.95 107.93 122.89 79.07 108.39 123.03 81.71 107.97 121.15 82.60 107.27 120.66 80.42 107.34 121.64 79.33 107.47 120.57 3 0 17.41-999 ?-999 ?-999 ? CA CA C1123 mSER~C 153 81.86 109.30 121.27 81.07 109.79 121.64 84.31 109.36 121.63 85.35 109.03 121.06 83.12 109.93 120.85 83.08 111.45 121.10 2 0 20.76-999 ?-999 ?-999 ? CA CA C1123 mMET~C 154 84.12 109.31 122.95 83.24 109.68 123.25 85.53 107.35 123.48 86.70 106.98 123.68 85.12 108.77 123.86 84.61 108.77 125.30 2 0 19.84-999 ?-999 ?-999 ? CA CA C1123 mLEU~C 155 84.61 106.56 122.94 83.74 107.02 122.77 85.58 104.93 121.32 85.97 103.80 121.02 84.84 105.16 122.62 83.53 104.35 122.56 3 0 18.82-999 ?-999 ?-999 ? CA CA C1123 mGLN~C 156 85.75 105.96 120.50 85.35 106.82 120.81 87.98 105.72 119.53 88.76 105.24 118.71 86.48 105.79 119.25 86.18 106.97 118.33 2 0 20.99-999 ?-999 ?-999 ? CA CA D1124 mGLY.C 157 88.38 106.22 120.70 87.65 106.48 121.33 90.47 107.14 119.85 91.45 106.72 119.23 89.82 106.34 120.96-999.99-999.99-999.99 1 0 23.96-999 ?-999 ?-999 ? CA CA C1123 mGLY.C 158 89.89 108.31 119.53 89.15 108.59 120.14 90.92 110.43 118.72 91.02 111.30 117.85 90.34 109.08 118.38-999.99-999.99-999.99 1 0 24.45-999 ?-999 ?-999 ? CA CA D1124 mARG.C 159 91.31 110.66 119.97 91.22 109.90 120.62 93.15 112.18 119.53 93.94 111.24 119.45 91.84 111.98 120.30 92.09 112.15 121.79 2 0 25.83-999 ?-999 ?-999 ? CA CA C1133 mLYS.C 160 93.32 113.38 118.96 92.56 114.02 119.00 95.63 114.00 119.42 96.00 115.15 119.66 94.62 113.65 118.33 94.53 114.76 117.29 2 0 27.16-999 ?-999 ?-999 ? CA CA C1133 mGLU.C 161 96.03 112.98 120.17 95.72 112.09 119.83 98.17 113.82 121.06 98.81 114.41 121.93 96.84 113.15 121.36 97.01 111.78 122.04 2 0 28.70-999 ?-999 ?-999 ? CA CA C1133 mASP.C 162 98.62 113.76 119.81 98.01 113.36 119.13 99.90 115.69 118.97 100.89 116.18 118.43 99.97 114.29 119.56 100.71 113.35 118.60 2 0 30.89-999 ?-999 ?-999 ? CA CA C1133 mGLU.C 163 98.73 116.32 119.04 98.01 115.82 119.53 99.45 118.66 119.11 99.41 118.84 120.33 98.54 117.64 118.44 97.09 118.10 118.59 2 0 28.27-999 ?-999 ?-999 ? CA CA C1133 mPRO.C 164 100.33 119.31 118.35 100.33 119.05 117.38 100.36 121.52 119.39 99.43 121.91 118.70 101.20 120.32 118.95 102.15 120.73 117.83 3 0 29.54-999 ?-999 ?-999 ? CA CA C1133 mVAL.C 165 100.70 122.06 120.55 101.37 121.55 121.09 100.26 124.33 119.82 101.33 124.44 119.24 100.11 123.33 120.96 100.78 123.94 122.20 3 0 27.33-999 ?-999 ?-999 ? CA CA C1133 mASN~C 166 99.17 125.00 119.47 98.35 124.75 119.99 98.33 127.18 118.89 97.12 127.01 119.04 99.20 126.01 118.42 98.76 125.41 117.10 2 0 26.36-999 ?-999 ?-999 ? CA CA C1133 mALA~C 167 98.96 128.32 119.17 99.93 128.37 118.93 97.12 129.94 118.85 96.01 130.29 119.26 98.20 129.41 119.78 99.13 130.51 120.25 2 0 24.79-999 ?-999 ?-999 ? CA CA C1133 mALA~C 168 97.42 130.01 117.55 98.34 129.73 117.30 95.19 129.55 116.59 94.03 129.94 116.59 96.39 130.48 116.63 97.01 130.65 115.25 2 0 23.84-999 ?-999 ?-999 ? CA CA C1133 mHIS~C 169 95.45 128.24 116.56 96.42 127.97 116.55 93.61 127.32 117.90 92.39 127.15 117.96 94.33 127.31 116.56 94.83 125.90 116.25 3 0 22.09-999 ?-999 ?-999 ? CA CA C1133 mALA~C 170 94.35 127.50 118.99 95.33 127.65 118.83 92.77 128.66 120.47 91.75 128.55 121.16 93.72 127.48 120.31 94.75 127.50 121.43 2 0 20.45-999 ?-999 ?-999 ? CA CA C1133 mALA~C 171 93.11 129.78 119.84 93.96 129.73 119.30 91.04 130.77 119.06 89.93 131.17 119.38 92.26 130.96 119.96 93.01 132.23 119.59 2 0 18.95-999 ?-999 ?-999 ? CA CA C1133 mGLU~C 172 91.27 130.12 117.92 92.22 129.88 117.72 89.14 128.91 117.79 87.92 129.08 117.69 90.13 129.81 117.05 90.61 129.06 115.80 2 0 17.85-999 ?-999 ?-999 ? CA CA C1133 mASP~C 173 89.68 127.90 118.47 90.68 127.88 118.48 88.10 127.56 120.29 86.93 127.27 120.55 88.83 126.91 119.12 89.61 125.70 119.60 2 0 16.18-999 ?-999 ?-999 ? CA CA C1133 mALA~C 174 88.78 128.46 121.01 89.72 128.65 120.72 87.01 130.03 121.64 85.93 130.09 122.23 88.09 129.08 122.14 89.06 129.77 123.08 2 0 14.45-999 ?-999 ?-999 ? CA CA C1133 mALA~C 175 87.22 130.71 120.52 88.12 130.60 120.11 84.98 130.74 119.47 83.82 131.17 119.51 86.15 131.56 119.98 86.66 132.46 118.87 2 0 13.15-999 ?-999 ?-999 ? CA CA C1133 mALA~C 176 85.22 129.54 118.94 86.17 129.23 118.93 83.23 128.28 119.59 82.01 128.20 119.55 84.05 128.80 118.43 84.53 127.69 117.51 2 0 11.87-999 ?-999 ?-999 ? CA CA C1133 mILE~C 177 83.92 127.91 120.68 84.91 127.97 120.59 82.45 128.61 122.52 81.31 128.45 122.96 83.21 127.46 121.88 84.19 126.84 122.89 3 0 10.03-999 ?-999 ?-999 ? CA CA C1133 mTYR~C 178 83.06 129.79 122.51 84.00 129.80 122.17 81.06 131.20 122.14 79.99 131.46 122.71 82.32 130.98 122.96 83.19 132.22 122.90 3 0 8.64-999 ?-999 ?-999 ? CA CA C1133 mGLN~C 179 81.15 131.13 120.82 82.07 130.92 120.48 78.96 130.23 120.07 77.76 130.42 119.79 79.99 131.34 119.95 80.44 131.49 118.50 2 0 7.67-999 ?-999 ?-999 ? CA CA C1133 mALA~C 180 79.39 129.04 120.49 80.37 128.99 120.71 77.74 127.89 121.93 76.80 127.11 122.12 78.48 127.92 120.61 79.24 126.60 120.41 2 0 6.33-999 ?-999 ?-999 ? CA CA C1133 mGLY~C 181 78.14 128.72 122.90 78.91 129.31 122.67 77.14 130.15 124.62 76.14 130.72 124.18 77.46 128.72 124.18-999.99-999.99-999.99 1 0 -3.86-999 ?-999 ?-999 ? CA CA C1133smGLU.C 182 78.03 130.68 125.44 78.79 130.07 125.65 77.52 133.05 124.95 76.73 133.95 125.23 77.95 132.02 125.99 79.31 132.44 126.57 2 0 4.83-999 ?-999 ?-999 ? CA CA C1133 mGLY.C 183 78.09 132.94 123.76 78.69 132.14 123.69 76.52 133.98 122.07 76.25 134.93 121.33 77.90 133.83 122.65-999.99-999.99-999.99 1 0 5.79-999 ?-999 ?-999 ? CA CA C1133 mGLN.C 184 75.60 133.06 122.32 75.88 132.34 122.97 73.20 132.73 122.65 73.51 132.22 123.74 74.29 133.12 121.67 74.28 132.19 120.45 2 0 -4.09-999 ?-999 ?-999 ? CA CA C1133smILE.C 185 71.93 132.90 122.28 71.75 133.32 121.39 70.87 130.93 123.32 70.99 130.35 124.39 70.91 132.45 123.25 69.51 133.03 123.00 3 0 -3.94-999 ?-999 ?-999 ? CA CA C1133smGLY.C 186 70.72 130.30 122.16 70.63 130.89 121.36 72.09 128.25 122.32 72.97 128.89 122.91 70.71 128.84 122.10-999.99-999.99-999.99 1 0 -4.06-999 ?-999 ?-999 ? CA CA C1133smTHR.C 187 72.30 127.02 121.88 71.53 126.62 121.39 73.90 125.42 120.93 73.00 124.84 120.31 73.57 126.32 122.11 73.50 125.45 123.38 2 0 4.38-999 ?-999 ?-999 ? CA CA C1133 mASP~C 188 75.19 125.34 120.64 75.77 125.97 121.16 76.49 123.33 120.37 77.71 123.38 120.39 75.69 124.41 119.63 76.55 125.14 118.60 2 0 7.60-999 ?-999 ?-999 ? CA CA C1133 mGLU~C 189 75.79 122.45 121.05 74.80 122.54 120.94 77.49 120.68 121.08 78.52 120.29 121.63 76.43 121.44 121.88 75.37 120.50 122.47 2 0 9.35-999 ?-999 ?-999 ? CA CA C1133 mSER~C 190 77.22 120.46 119.80 76.37 120.87 119.45 79.54 120.26 119.01 80.54 119.54 118.95 78.15 119.66 119.00 77.63 119.39 117.59 2 0 12.48-999 ?-999 ?-999 ? CA CA C1133 mARG~C 191 79.66 121.58 119.17 78.81 122.08 119.33 81.78 121.93 120.39 83.00 121.72 120.33 80.99 122.19 119.12 80.88 123.69 118.83 2 0 11.85-999 ?-999 ?-999 ? CA CA C1133 mPHE~C 192 81.12 121.91 121.55 80.16 122.16 121.50 82.33 120.11 122.66 83.45 119.78 123.05 81.81 121.54 122.78 80.89 121.63 123.99 3 0 11.77-999 ?-999 ?-999 ? CA CA C1133 mASN~C 193 81.44 119.27 122.15 80.58 119.69 121.88 83.00 117.70 121.14 83.98 117.08 121.55 81.75 117.84 122.00 80.58 117.07 121.37 2 0 14.75-999 ?-999 ?-999 ? CA CA C1133 mALA~C 194 82.94 118.31 119.96 82.10 118.83 119.81 85.33 118.67 119.57 86.33 117.94 119.53 84.01 118.21 118.99 83.64 118.94 117.71 2 0 16.52-999 ?-999 ?-999 ? CA CA C1133 mVAL~C 195 85.38 119.87 120.16 84.51 120.37 120.24 87.20 119.52 121.79 88.38 119.16 121.77 86.67 120.36 120.64 86.68 121.86 121.04 3 0 16.50-999 ?-999 ?-999 ? CA CA C1133 mLEU~C 196 86.36 119.23 122.76 85.41 119.52 122.60 87.18 117.07 123.71 87.83 116.44 124.54 86.81 118.53 123.96 85.74 118.59 125.05 3 0 17.36-999 ?-999 ?-999 ? CA CA C1133 mALA~C 197 86.77 116.47 122.60 86.26 117.04 121.95 88.29 114.82 121.54 88.89 113.75 121.50 87.10 115.06 122.43 85.87 114.34 121.85 2 0 20.12-999 ?-999 ?-999 ? CA CA C1133 mTHR~C 198 88.65 115.79 120.70 88.20 116.68 120.84 90.97 116.21 119.93 92.02 115.78 119.43 89.64 115.51 119.67 89.11 115.94 118.29 2 0 21.98-999 ?-999 ?-999 ? CA CA C1133 mARG~C 199 90.93 117.32 120.66 90.04 117.58 121.04 93.09 117.38 121.84 92.67 116.74 122.80 92.18 118.06 120.84 91.90 119.52 121.22 2 0 22.19-999 ?-999 ?-999 ? CA CA C1133 mSER~C 200 94.40 117.57 121.67 94.68 118.07 120.84 95.13 117.79 123.99 94.78 118.98 124.03 95.32 117.06 122.67 96.78 117.25 122.21 2 0 25.16-999 ?-999 ?-999 ? CA CA C1133 mTYR~C 201 95.47 117.11 125.08 95.70 116.15 124.91 96.31 119.01 126.43 95.83 120.02 126.99 95.50 117.73 126.40 95.97 116.72 127.44 3 0 25.00-999 ?-999 ?-999 ? CA CA C1133 mPRO~C 202 97.51 119.08 125.86 97.84 118.24 125.45 97.50 121.43 125.08 97.43 122.59 125.49 98.22 120.37 125.90 99.61 120.08 125.31 3 0 26.28-999 ?-999 ?-999 ? CA CA C1133 mGLN~C 203 96.95 121.07 123.92 97.07 120.11 123.65 94.96 122.55 123.86 94.65 123.74 123.84 96.22 122.08 123.14 95.92 121.58 121.74 2 0 23.79-999 ?-999 ?-999 ? CA CA C1133 mLEU~C 204 94.28 121.65 124.57 94.65 120.72 124.50 93.46 122.96 126.49 92.76 123.94 126.76 93.11 121.99 125.37 92.44 120.73 125.93 3 0 20.91-999 ?-999 ?-999 ? CA CA C1133 mHIS~C 205 94.57 122.68 127.18 95.01 121.81 126.94 95.21 125.00 127.59 94.71 125.95 128.18 95.07 123.60 128.19 96.43 123.14 128.73 3 0 22.52-999 ?-999 ?-999 ? CA CA C1133 mGLN~C 206 95.82 125.08 126.41 96.12 124.20 126.03 94.69 126.99 125.36 94.45 128.18 125.53 96.02 126.37 125.75 96.92 126.23 124.53 2 0 22.53-999 ?-999 ?-999 ? CA CA C1133 mILE~C 207 93.77 126.14 124.89 94.06 125.19 124.81 91.75 127.23 125.77 91.15 128.31 125.69 92.44 126.64 124.56 91.60 125.51 123.93 3 0 18.91-999 ?-999 ?-999 ? CA CA C1133 mPHE~C 208 91.85 126.56 126.92 92.41 125.74 126.89 91.69 128.42 128.56 90.92 129.21 129.12 91.16 127.05 128.11 91.27 126.06 129.26 3 0 17.97-999 ?-999 ?-999 ? CA CA C1133 mHIS~C 209 92.97 128.66 128.33 93.44 127.88 127.92 93.17 131.00 127.69 92.87 132.12 128.11 93.65 129.91 128.64 95.17 129.76 128.53 3 0 20.26-999 ?-999 ?-999 ? CA CA C1133 mGLU~C 210 93.04 130.64 126.41 93.32 129.70 126.21 91.08 131.95 125.70 90.69 133.10 125.50 92.52 131.55 125.40 92.61 130.97 124.00 2 0 18.76-999 ?-999 ?-999 ? CA CA C1133 mTYR~C 211 90.31 131.00 126.25 90.76 130.13 126.42 88.82 132.46 127.54 88.16 133.48 127.29 88.92 131.28 126.57 88.20 130.06 127.14 3 0 15.28-999 ?-999 ?-999 ? CA CA C1133 mSER~C 212 89.61 132.40 128.60 90.16 131.57 128.64 90.20 134.76 129.04 90.22 135.75 129.77 89.68 133.45 129.60 90.62 133.01 130.74 2 0 17.02-999 ?-999 ?-999 ? CA CA C1133 mLYS~C 213 90.63 134.81 127.78 90.69 133.95 127.28 89.80 136.76 126.53 89.75 137.97 126.29 90.99 136.13 127.24 92.19 136.07 126.31 2 0 18.41-999 ?-999 ?-999 ? CA CA C1133 mILE~C 214 88.79 135.97 126.18 88.90 135.01 126.42 86.37 136.46 126.35 85.31 136.95 125.95 87.62 136.52 125.49 87.36 135.80 124.15 3 0 15.25-999 ?-999 ?-999 ? CA CA C1133 mSER~C 215 86.44 135.84 127.53 87.34 135.49 127.79 85.51 136.08 129.79 86.66 136.06 130.23 85.23 135.74 128.34 84.67 134.31 128.24 2 0 13.32-999 ?-999 ?-999 ? CA CA C1133 mASN.C 216 84.45 136.36 130.55 83.58 136.37 130.06 84.48 135.32 132.76 84.89 135.22 133.91 84.60 136.62 131.98 83.54 137.63 132.46 2 0 14.72-999 ?-999 ?-999 ? CA CA C1133 mLYS.C 217 83.93 134.29 132.13 83.61 134.49 131.20 85.04 132.10 132.46 85.59 132.23 131.37 83.83 132.97 132.76 82.58 132.27 132.20 2 0 13.37-999 ?-999 ?-999 ? CA CA C1133 mTHR~C 218 85.41 131.15 133.32 85.00 131.18 134.23 85.64 129.16 131.94 84.41 129.16 131.83 86.38 130.15 132.84 87.03 129.35 133.97 2 0 15.13-999 ?-999 ?-999 ? CA CA C1133 mILE~C 219 86.36 128.22 131.33 87.35 128.23 131.48 84.72 126.38 131.34 83.66 125.93 130.90 85.63 127.25 130.49 86.59 126.38 129.66 3 0 13.58-999 ?-999 ?-999 ? CA CA C1133 mLEU~C 220 85.12 126.09 132.57 86.02 126.46 132.79 82.98 126.01 133.74 81.88 125.45 133.70 84.32 125.31 133.50 85.06 125.19 134.82 3 0 14.69-999 ?-999 ?-999 ? CA CA C1133 mGLN~C 221 83.07 127.31 134.01 84.00 127.68 134.02 80.97 128.18 133.05 79.75 128.14 133.15 81.88 128.11 134.27 82.29 129.53 134.70 2 0 12.90-999 ?-999 ?-999 ? CA CA C1133 mALA~C 222 81.58 128.30 131.87 82.58 128.34 131.87 79.95 127.06 130.52 78.78 127.03 130.16 80.72 128.36 130.68 81.58 128.64 129.46 2 0 9.49-999 ?-999 ?-999 ? CA CA C1133 mILE~C 223 80.64 125.94 130.79 81.59 126.06 131.07 78.88 124.51 131.73 77.76 124.08 131.42 79.96 124.66 130.66 80.93 123.47 130.74 3 0 10.31-999 ?-999 ?-999 ? CA CA C1133 mGLU~C 224 79.22 124.87 132.97 80.16 125.18 133.08 77.00 125.60 133.69 75.87 125.18 133.93 78.23 124.78 134.05 78.81 125.29 135.36 2 0 11.87-999 ?-999 ?-999 ? CA CA C1133 mASN~C 225 77.19 126.79 133.12 78.15 127.00 132.93 75.34 127.28 131.55 74.17 127.63 131.38 76.07 127.68 132.82 76.55 129.12 132.76 2 0 9.07-999 ?-999 ?-999 ? CA CA C1133 mGLU~C 226 76.00 126.54 130.66 76.92 126.26 130.93 74.57 124.89 129.44 73.54 124.75 128.77 75.38 126.18 129.39 76.45 126.09 128.30 2 0 -6.54-999 ?-999 ?-999 ? CA CA C1133smPHE~C 227 75.03 123.92 130.22 75.80 124.18 130.78 73.95 122.19 131.62 74.36 122.82 132.59 74.44 122.59 130.23 75.50 121.56 129.77 3 0 9.53-999 ?-999 ?-999 ? CA CA C1133 mSER~C 228 73.23 121.07 131.70 72.93 120.71 130.81 72.99 118.92 132.85 73.07 118.38 131.74 72.92 120.44 132.97 71.49 120.82 133.40 2 0 12.95-999 ?-999 ?-999 ? CA CA C1133 mGLY~C 229 72.91 118.21 133.97 72.92 118.76 134.80 74.06 116.05 133.46 75.18 116.53 133.63 72.82 116.76 133.96-999.99-999.99-999.99 1 0 16.44-999 ?-999 ?-999 ? CA CA C1133 mASP~C 230 73.86 114.87 132.88 72.90 114.63 132.76 75.88 114.70 131.48 77.11 114.60 131.62 74.96 114.01 132.45 74.41 112.72 131.82 2 0 15.51-999 ?-999 ?-999 ? CA CA C1123 mILE~C 231 75.35 115.33 130.43 74.35 115.35 130.38 77.15 116.99 130.10 78.37 117.06 129.86 76.27 115.93 129.45 75.56 116.51 128.23 3 0 15.22-999 ?-999 ?-999 ? CA CA C1133 mLYS~C 232 76.59 117.80 130.99 75.60 117.68 131.12 78.55 118.08 132.46 79.71 118.42 132.26 77.40 118.78 131.71 76.59 119.61 132.70 2 0 13.94-999 ?-999 ?-999 ? CA CA C1133 mASN~C 233 78.20 117.11 133.30 77.21 116.94 133.37 80.25 115.71 133.13 81.41 115.65 133.53 79.21 116.36 134.03 78.56 115.27 134.91 2 0 17.61-999 ?-999 ?-999 ? CA CA C1133 mGLY~C 234 79.86 115.21 131.97 78.88 115.29 131.77 81.86 115.59 130.58 83.08 115.40 130.58 80.84 114.58 131.09-999.99-999.99-999.99 1 0 18.27-999 ?-999 ?-999 ? CA CA C1133 mLEU~C 235 81.34 116.71 130.09 80.34 116.78 130.11 83.11 118.31 130.67 84.29 118.54 130.45 82.22 117.76 129.56 81.39 118.87 128.93 3 0 15.77-999 ?-999 ?-999 ? CA CA C1133 mLEU~C 236 82.54 118.46 131.86 81.57 118.24 131.90 84.44 117.97 133.35 85.53 118.44 133.67 83.32 118.94 133.00 82.40 119.16 134.21 3 0 16.97-999 ?-999 ?-999 ? CA CA C1133 mALA~C 237 84.18 116.66 133.32 83.25 116.42 133.04 86.39 115.75 132.71 87.55 115.58 133.09 85.21 115.68 133.66 84.64 114.26 133.68 2 0 20.56-999 ?-999 ?-999 ? CA CA C1133 mILE~C 238 86.11 116.01 131.43 85.13 116.09 131.21 88.04 117.38 130.80 89.28 117.33 130.83 87.19 116.16 130.48 86.68 116.24 129.04 3 0 20.23-999 ?-999 ?-999 ? CA CA C1133 mVAL~C 239 87.39 118.52 131.04 86.39 118.46 131.00 89.00 119.54 132.58 90.16 119.95 132.62 88.14 119.73 131.33 87.17 120.92 131.54 3 0 18.97-999 ?-999 ?-999 ? CA CA C1133 mLYS~C 240 88.39 118.93 133.60 87.45 118.65 133.41 90.21 117.69 134.72 91.23 117.86 135.40 89.07 118.69 134.88 88.11 118.17 135.94 2 0 21.72-999 ?-999 ?-999 ? CA CA C1133 mSER~C 241 90.04 116.71 133.86 89.14 116.71 133.43 92.29 116.34 132.87 93.42 115.89 133.09 91.07 115.73 133.57 90.53 114.60 132.68 2 0 24.23-999 ?-999 ?-999 ? CA CA C1133 mVAL~C 242 92.06 117.32 132.00 91.10 117.52 131.86 93.92 118.88 132.32 95.15 118.93 132.40 93.16 118.02 131.33 92.57 118.90 130.21 3 0 23.81-999 ?-999 ?-999 ? CA CA C1133 mGLU~C 243 93.18 119.63 133.14 92.19 119.47 133.06 94.53 119.91 135.20 95.62 120.35 135.59 93.77 120.58 134.06 92.71 121.55 134.59 2 0 24.11-999 ?-999 ?-999 ? CA CA C1133 mASN~C 244 93.96 118.85 135.76 93.06 118.61 135.39 93.87 116.82 137.13 92.93 116.79 137.93 94.63 118.11 136.82 94.79 118.98 138.06 2 0 27.03-999 ?-999 ?-999 ? CA CA C1133 mARG~C 245 94.24 115.73 136.47 95.03 115.83 135.87 93.51 114.02 138.10 92.51 113.50 138.58 93.50 114.49 136.66 93.97 113.36 135.75 2 0 27.61-999 ?-999 ?-999 ? CA CA C1123 mPHE~C 246 94.64 114.19 138.79 95.38 114.64 138.28 93.62 114.35 141.00 93.00 113.69 141.82 94.75 113.75 140.17 96.09 114.15 140.78 3 0 28.85-999 ?-999 ?-999 ? CA CA C1123 mALA~C 247 93.38 115.64 140.78 93.98 116.04 140.09 90.95 115.88 141.14 90.08 115.82 142.00 92.35 116.40 141.46 92.47 117.85 140.99 2 0 28.66-999 ?-999 ?-999 ? CA CA C1133 mTYR~C 248 90.74 115.53 139.87 91.50 115.69 139.25 89.17 113.73 140.34 88.09 113.57 140.90 89.45 114.97 139.47 89.46 114.53 138.00 3 0 25.19-999 ?-999 ?-999 ? CA CA C1123 mPHE~C 249 90.18 112.88 140.44 91.01 113.15 139.96 89.87 111.95 142.68 89.00 111.39 143.34 90.04 111.64 141.21 91.29 110.78 140.98 3 0 24.21-999 ?-999 ?-999 ? CA CA C1123 mALA~C 250 90.69 112.88 143.19 91.36 113.25 142.55 89.14 113.77 144.86 88.55 113.46 145.89 90.56 113.29 144.59 91.52 114.43 144.90 2 0 26.71-999 ?-999 ?-999 ? CA CA C1123 mGLU~C 251 88.67 114.58 143.90 89.29 114.75 143.14 86.27 114.08 144.05 85.31 114.12 144.81 87.34 115.16 144.02 87.07 116.13 142.86 2 0 25.32-999 ?-999 ?-999 ? CA CA C1123 mARG~C 252 86.42 113.06 143.20 87.23 113.07 142.61 85.48 111.25 144.52 84.50 110.92 145.18 85.38 112.03 143.23 85.48 111.14 141.99 2 0 21.75-999 ?-999 ?-999 ? CA CA C1123 mLEU~C 253 86.72 110.99 144.95 87.46 111.34 144.38 86.24 110.90 147.37 85.61 110.24 148.18 86.91 110.23 146.18 88.41 110.04 146.45 3 0 23.30-999 ?-999 ?-999 ? CA CA C1123 mHIS~C 254 86.43 112.21 147.46 87.01 112.58 146.74 84.31 112.96 148.44 83.63 112.72 149.44 85.83 113.03 148.51 86.33 114.47 148.40 3 0 25.37-999 ?-999 ?-999 ? CA CA C1123 mHIS~C 255 83.73 113.10 147.25 84.36 113.29 146.50 81.77 111.64 147.59 80.77 111.57 148.32 82.29 112.99 147.10 81.89 113.18 145.63 3 0 22.54-999 ?-999 ?-999 ? CA CA C1123 mALA~C 256 82.43 110.56 147.19 83.25 110.75 146.64 81.98 109.00 149.05 81.17 108.24 149.59 81.98 109.23 147.55 82.81 108.17 146.84 2 0 20.57-999 ?-999 ?-999 ? CA CA C1123 mMET~C 257 82.89 109.67 149.76 83.49 110.27 149.23 82.14 110.55 151.95 82.08 110.55 153.18 82.96 109.50 151.21 84.42 109.49 151.67 2 0 23.63-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 258 81.47 111.42 151.20 81.63 111.32 150.22 79.20 111.82 152.04 78.81 110.81 151.46 80.58 112.41 151.78 80.46 113.65 150.89 2 0 24.59-999 ?-999 ?-999 ? CA CA C1123 mGLY.C 259 78.45 112.50 152.90 78.89 113.34 153.23 77.22 111.14 154.52 78.31 110.81 155.00 77.13 112.07 153.33-999.99-999.99-999.99 1 0 24.46-999 ?-999 ?-999 ? CA CA C1123 mLEU.C 260 76.07 110.68 155.02 75.25 111.02 154.55 76.09 108.32 155.70 75.35 107.49 156.22 76.05 109.77 156.16 74.82 110.01 157.04 3 0 25.52-999 ?-999 ?-999 ? CA CA C1123 mGLY.C 261 76.97 108.04 154.74 77.48 108.86 154.46 78.43 106.74 153.25 79.38 107.51 153.45 77.20 106.76 154.14-999.99-999.99-999.99 1 0 22.70-999 ?-999 ?-999 ? CA CA F1126 mTHR.C 262 78.43 105.84 152.27 77.61 105.28 152.21 79.18 105.14 150.03 78.68 104.01 149.94 79.58 105.71 151.38 80.65 104.79 151.99 2 0 20.16-999 ?-999 ?-999 ? CA CA F1126 mSER~C 263 79.47 105.84 148.93 79.72 106.80 149.04 80.64 104.27 147.54 81.69 104.68 147.05 79.37 105.11 147.66 79.20 105.99 146.43 2 0 17.56-999 ?-999 ?-999 ? CA CA C1123 mASP~C 264 80.51 103.07 148.10 79.61 102.89 148.49 82.04 101.71 146.73 83.21 101.39 146.48 81.64 102.14 148.13 81.25 100.96 149.03 2 0 15.58-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 265 81.08 101.75 145.80 80.19 102.02 146.16 82.43 102.31 143.84 83.41 101.83 143.29 81.32 101.43 144.40 80.04 101.65 143.59 2 0 13.42-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 266 82.27 103.62 144.00 81.43 103.87 144.48 84.55 104.54 144.29 85.63 104.60 143.70 83.24 104.59 143.51 82.63 106.01 143.55 2 0 16.59-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 267 84.49 104.42 145.60 83.56 104.40 145.99 86.54 103.14 145.96 87.71 103.31 145.58 85.71 104.33 146.40 85.36 104.25 147.88 3 0 17.82-999 ?-999 ?-999 ? CA CA F1126 mILE~C 268 85.99 101.92 145.94 85.04 101.89 146.24 87.31 100.92 144.10 88.46 100.59 143.78 86.76 100.76 145.51 85.90 99.48 145.56 3 0 14.95-999 ?-999 ?-999 ? CA CA F1126 mARG~C 269 86.46 101.39 143.18 85.55 101.64 143.52 88.13 102.39 141.66 89.07 102.04 140.95 86.90 101.50 141.80 85.77 102.04 140.91 2 0 14.86-999 ?-999 ?-999 ? CA CA F1126 mILE~C 270 88.13 103.55 142.31 87.37 103.69 142.94 90.51 104.06 142.76 91.62 104.15 142.22 89.23 104.49 142.06 88.82 105.92 142.49 3 0 18.64-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 271 90.37 103.54 143.98 89.43 103.47 144.32 92.22 101.96 144.03 93.42 102.00 143.78 91.55 103.13 144.73 91.21 102.79 146.18 3 0 19.29-999 ?-999 ?-999 ? CA CA F1126 mVAL~C 272 91.44 100.94 143.67 90.48 101.04 143.92 92.53 100.10 141.58 93.64 99.68 141.22 91.99 99.80 142.97 90.90 98.70 142.81 3 0 16.93-999 ?-999 ?-999 ? CA CA F1126 mSER~C 273 91.71 100.79 140.77 90.85 101.10 141.18 93.37 101.87 139.27 94.07 101.75 138.26 92.09 101.05 139.40 90.96 101.70 138.60 2 0 17.72-999 ?-999 ?-999 ? CA CA F1126 mARG~C 274 93.69 102.66 140.28 93.11 102.55 141.09 96.01 103.17 141.01 97.09 103.78 140.90 94.81 103.60 140.18 94.33 104.98 140.67 2 0 21.41-999 ?-999 ?-999 ? CA CA F1126 mSER~C 275 95.81 102.19 141.88 94.89 101.80 141.80 98.18 101.48 142.24 99.20 101.51 142.92 96.79 101.69 142.83 96.26 100.39 143.46 2 0 21.80-999 ?-999 ?-999 ? CA CA F1126 mGLU.C 276 98.26 101.19 140.94 97.40 101.15 140.44 99.84 101.90 139.20 100.63 101.58 138.32 99.58 100.95 140.36 99.74 99.49 139.94 2 0 23.58-999 ?-999 ?-999 ? CA CA F1126 mILE.C 277 99.17 103.04 139.23 98.53 103.12 139.99 99.71 105.41 138.90 100.81 105.95 138.72 99.36 104.09 138.23 98.10 104.32 137.37 3 0 25.27-999 ?-999 ?-999 ? CA CA F1126 mASP~C 278 98.75 105.96 139.64 97.91 105.44 139.78 98.39 107.62 141.50 98.27 108.80 141.87 99.03 107.31 140.17 98.61 108.34 139.12 2 0 27.02-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 279 98.01 106.61 142.27 98.22 105.71 141.88 98.22 107.56 144.54 97.72 108.15 145.50 97.34 106.81 143.55 96.92 105.46 144.16 3 0 25.64-999 ?-999 ?-999 ? CA CA F1126 mALA~C 280 99.54 107.50 144.35 99.86 106.93 143.60 100.18 109.76 145.00 99.94 110.54 145.92 100.42 108.27 145.24 101.88 107.92 144.98 2 0 29.07-999 ?-999 ?-999 ? CA CA F1126 mASN~C 281 100.25 110.14 143.72 100.47 109.42 143.07 98.59 111.97 143.73 98.38 113.14 144.05 100.01 111.54 143.36 100.21 111.73 141.86 2 0 30.86-999 ?-999 ?-999 ? CA CA F1126 mILE~C 282 97.65 111.03 143.66 97.98 110.13 143.37 96.12 111.62 145.48 95.36 112.48 145.93 96.26 111.33 144.00 95.32 110.18 143.59 3 0 28.40-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 283 96.90 110.91 146.28 97.48 110.23 145.81 97.41 112.51 148.11 96.90 113.14 149.04 96.89 111.14 147.72 97.78 110.06 148.35 2 0 29.31-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 284 98.46 112.98 147.43 98.82 112.34 146.75 97.96 115.38 147.43 97.55 116.14 148.30 99.02 114.30 147.68 100.21 114.52 146.75 2 0 33.01-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 285 97.52 115.41 146.18 97.95 114.73 145.59 95.27 116.34 146.60 94.69 117.39 146.88 96.50 116.34 145.70 96.13 115.94 144.26 2 0 32.88-999 ?-999 ?-999 ? CA CA F1126 mPHE~C 286 94.90 115.15 147.07 95.43 114.37 146.73 94.16 115.76 149.30 93.37 116.49 149.90 93.78 115.04 148.01 93.44 113.58 148.31 3 0 30.90-999 ?-999 ?-999 ? CA CA F1126 mGLN~C 287 95.40 115.53 149.74 95.96 114.90 149.19 95.76 117.71 150.78 95.12 118.43 151.54 95.83 116.19 150.97 97.25 115.77 151.37 2 0 33.66-999 ?-999 ?-999 ? CA CA F1126 mALA~C 288 96.41 118.15 149.70 96.88 117.45 149.17 94.98 120.12 149.31 94.73 121.20 149.86 96.40 119.56 149.36 97.11 119.78 148.03 2 0 35.27-999 ?-999 ?-999 ? CA CA C1133 mMET~C 289 94.04 119.41 148.67 94.32 118.52 148.32 91.85 119.89 149.79 91.02 120.76 150.04 92.70 119.98 148.53 91.92 119.34 147.38 2 0 32.27-999 ?-999 ?-999 ? CA CA C1133 mTYR~C 290 92.00 118.84 150.61 92.72 118.18 150.39 91.71 118.94 153.10 91.01 119.14 154.09 91.07 118.75 151.74 90.27 117.44 151.63 3 0 33.58-999 ?-999 ?-999 ? CA CA C1123 mGLY~C 291 93.05 118.94 153.16 93.51 118.77 152.29 93.93 117.92 155.21 94.87 117.81 156.00 93.75 119.18 154.40-999.99-999.99-999.99 1 0 36.40-999 ?-999 ?-999 ? CA CA F1126 mLYS.C 292 93.05 116.94 155.02 92.33 117.18 154.38 93.73 114.63 154.73 93.47 114.74 153.53 93.14 115.65 155.70 91.75 115.21 156.14 2 0 33.81-999 ?-999 ?-999 ? CA CA F1126 mSER~C 293 94.51 113.65 155.18 94.70 113.66 156.17 93.88 111.77 153.73 92.86 111.64 154.40 95.02 112.67 154.23 96.13 111.83 154.86 2 0 31.69-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 294 94.09 111.20 152.55 94.93 111.49 152.09 92.98 109.04 152.94 91.89 108.51 153.15 93.14 110.22 151.99 93.65 109.74 150.63 3 0 27.96-999 ?-999 ?-999 ? CA CA F1126 mTYR~C 295 94.07 108.61 153.54 94.90 109.11 153.27 93.09 107.75 155.64 92.29 106.89 155.99 94.07 107.51 154.50 95.49 107.30 155.02 3 0 27.61-999 ?-999 ?-999 ? CA CA F1126 mGLU~C 296 93.12 108.93 156.26 93.77 109.59 155.88 90.79 109.31 156.99 89.87 109.11 157.77 92.25 109.18 157.40 92.68 110.43 158.16 2 0 29.45-999 ?-999 ?-999 ? CA CA F1126 mPHE~C 297 90.56 109.72 155.75 91.37 109.93 155.21 88.55 108.45 155.12 87.43 108.16 155.53 89.18 109.83 155.26 89.19 110.56 153.92 3 0 27.53-999 ?-999 ?-999 ? CA CA F1126 mILE~C 298 89.32 107.56 154.51 90.19 107.92 154.18 88.67 105.53 155.74 87.66 104.87 155.96 88.89 106.16 154.37 89.95 105.38 153.57 3 0 24.18-999 ?-999 ?-999 ? CA CA F1126 mALA~C 299 89.61 105.80 156.64 90.35 106.37 156.29 88.31 105.80 158.72 87.63 105.05 159.41 89.57 105.31 158.01 90.80 105.75 158.79 2 0 26.14-999 ?-999 ?-999 ? CA CA F1126 mASP~C 300 88.01 107.08 158.52 88.64 107.58 157.93 85.55 107.04 158.57 84.59 106.84 159.30 86.82 107.65 159.14 86.78 109.17 158.96 2 0 27.55-999 ?-999 ?-999 ? CA CA F1126 mASP~C 301 85.55 106.75 157.27 86.44 106.81 156.83 84.05 104.88 156.51 82.89 104.49 156.31 84.33 106.37 156.57 84.37 106.93 155.15 2 0 24.34-999 ?-999 ?-999 ? CA CA F1126 mCYH~C 302 85.06 104.01 156.60 85.96 104.39 156.80 84.95 101.78 157.68 85.44 102.26 158.70 84.77 102.59 156.40 85.68 102.00 155.32 2 0 21.74-999 ?-999 ?-999 ? CA CA F1126 mSER~C 303 84.59 100.50 157.59 84.24 100.20 156.70 85.19 98.23 158.41 85.07 97.75 157.29 84.71 99.63 158.76 83.36 99.56 159.49 2 0 21.88-999 ?-999 ?-999 ? CA CA F1126 mGLY~C 304 85.73 97.56 159.42 85.88 98.12 160.23 87.15 95.80 158.38 87.99 96.63 158.04 86.07 96.16 159.38-999.99-999.99-999.99 1 0 21.31-999 ?-999 ?-999 ? CA CA F1126 mASP~C 305 87.14 94.55 157.92 86.41 93.97 158.26 88.15 94.98 155.71 89.18 95.22 155.08 88.17 94.12 156.97 87.98 92.64 156.66 2 0 19.37-999 ?-999 ?-999 ? CA CA F1126 mTYR~C 306 86.97 95.48 155.37 86.21 95.20 155.97 87.70 97.60 154.41 88.53 97.91 153.56 86.81 96.37 154.22 85.36 96.79 154.04 3 0 17.33-999 ?-999 ?-999 ? CA CA F1126 mLYS~C 307 87.56 98.27 155.55 86.86 97.93 156.18 89.88 99.00 155.78 90.73 99.62 155.14 88.43 99.44 155.76 88.02 100.16 157.03 2 0 20.67-999 ?-999 ?-999 ? CA CA F1126 mASP~C 308 90.16 97.90 156.47 89.37 97.49 156.92 92.17 97.22 155.19 93.32 97.60 155.01 91.51 97.36 156.56 91.46 96.02 157.29 2 0 21.84-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 309 91.44 96.66 154.23 90.50 96.45 154.49 92.25 97.67 152.15 93.31 97.92 151.56 92.02 96.38 152.91 91.07 95.43 152.17 3 0 19.24-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 310 91.25 98.54 152.15 90.43 98.24 152.65 92.58 100.59 151.96 93.38 101.15 151.21 91.36 99.83 151.45 90.10 100.64 151.76 3 0 19.62-999 ?-999 ?-999 ? CA CA F1126 mLEU~C 311 92.72 100.61 153.28 92.01 100.08 153.75 95.14 100.74 153.62 96.08 101.49 153.35 93.78 101.30 153.99 93.53 101.23 155.51 3 0 23.35-999 ?-999 ?-999 ? CA CA F1126 mGLN~C 312 95.24 99.41 153.55 94.40 98.91 153.75 96.88 99.04 151.76 98.05 99.14 151.38 96.51 98.79 153.21 96.47 97.29 153.51 2 0 23.53-999 ?-999 ?-999 ? CA CA F1126 mILE~C 313 95.88 99.15 150.89 94.95 99.05 151.27 96.70 100.82 149.30 97.65 101.05 148.56 96.19 99.40 149.48 94.94 99.13 148.62 3 0 21.79-999 ?-999 ?-999 ? CA CA F1126 mTHR~C 314 96.03 101.75 149.96 95.32 101.37 150.56 97.64 103.52 150.49 98.45 104.23 149.89 96.30 103.17 149.85 95.19 104.02 150.50 2 0 24.08-999 ?-999 ?-999 ? CA CA F1126 mGLY~C 315 97.88 102.99 151.68 97.17 102.38 152.03 98.93 104.64 153.11 97.94 105.33 152.85 99.11 103.31 152.40-999.99-999.99-999.99 1 0 27.22-999 ?-999 ?-999 ? CA CA F1126 mHIS.C 316 99.82 105.01 154.02 100.61 104.40 154.15 99.74 107.49 153.85 98.96 108.45 154.02 99.58 106.26 154.74 100.49 106.32 155.97 3 0 30.26-999 ?-999 ?-999 ? CA CA F1126 mVAL.D 2 33.51 94.96 98.59 32.91 95.75 98.54 35.84 94.13 98.31 36.19 94.50 97.19 34.39 93.80 98.66 33.94 92.65 97.72 3 0 35.48-999 ?-999 ?-999 ? CA CA B1122 mVAL.D 3 36.71 93.90 99.30 36.30 93.64 100.17 38.73 92.65 98.78 38.49 91.71 99.53 38.15 94.03 99.05 38.84 94.75 100.22 3 0 31.94-999 ?-999 ?-999 ? CA CA B1122 mGLN.D 4 39.44 92.48 97.67 39.59 93.30 97.11 41.22 91.14 96.51 41.63 92.14 95.93 39.94 91.15 97.34 38.84 90.38 96.59 2 0 29.51-999 ?-999 ?-999 ? CA CA B1122 mGLY.D 5 41.85 89.97 96.43 41.42 89.23 96.94 42.81 89.23 94.29 41.66 88.97 93.96 43.07 89.81 95.67-999.99-999.99-999.99 1 0 26.34-999 ?-999 ?-999 ? CA CA B1122 mTHR.D 6 43.86 89.04 93.49 44.74 89.27 93.90 44.15 87.10 91.99 44.10 86.52 90.90 43.71 88.55 92.13 44.53 89.42 91.15 2 0 26.23-999 ?-999 ?-999 ? CA CA B1122 mVAL.D 7 44.65 86.53 93.08 44.68 87.11 93.89 44.17 84.26 93.86 43.97 84.48 95.05 45.11 85.15 93.05 46.56 85.00 93.56 3 0 24.31-999 ?-999 ?-999 ? CA CA B1122 mLYS.D 8 43.61 83.26 93.19 43.91 83.20 92.24 43.16 80.90 93.77 43.84 80.47 92.85 42.65 82.33 93.77 41.34 82.43 92.98 2 0 26.60-999 ?-999 ?-999 ? CA CA B1122 mPRO.D 9 42.83 80.18 94.84 42.29 80.66 95.53 42.72 77.98 93.75 41.56 78.09 93.37 43.24 78.77 94.94 42.61 78.27 96.23 3 0 26.33-999 ?-999 ?-999 ? CA CA B1122 mHIS.D 10 43.62 77.17 93.20 44.54 77.27 93.59 42.21 75.27 92.58 42.23 74.79 93.71 43.28 76.24 92.13 44.54 75.47 91.73 3 0 27.53-999 ?-999 ?-999 ? CA CA B1122 mALA.D 11 41.21 75.04 91.74 41.22 75.57 90.89 40.74 72.67 91.79 41.59 72.55 90.89 40.19 74.06 92.11 38.89 74.29 91.36 2 0 31.06-999 ?-999 ?-999 ? CA CA B1122 mSER.D 12 40.29 71.64 92.51 39.60 71.85 93.19 42.36 70.35 92.42 43.12 69.90 91.57 40.85 70.32 92.23 40.53 69.88 90.80 2 0 31.89-999 ?-999 ?-999 ? CA CA B1122 mPHE.D 13 42.78 70.92 93.55 42.04 71.26 94.12 44.79 69.65 94.17 44.24 68.88 94.96 44.19 71.03 93.90 44.31 71.89 95.18 3 0 28.33-999 ?-999 ?-999 ? CA CA B1122 mASN~D 14 45.93 69.36 93.57 46.20 70.00 92.86 48.18 68.54 94.03 48.87 68.62 93.00 46.70 68.18 93.95 46.49 67.03 92.97 2 0 27.74-999 ?-999 ?-999 ? CA CA B1122 mSER~D 15 48.69 68.75 95.24 48.06 68.55 96.00 51.10 68.22 94.93 52.18 68.61 94.48 50.06 69.22 95.39 50.31 69.64 96.84 2 0 24.25-999 ?-999 ?-999 ? CA CA B1122 mARG~D 16 50.82 66.92 95.05 49.92 66.71 95.41 52.08 66.00 93.15 53.24 65.97 92.71 51.81 65.92 94.65 51.38 64.50 95.02 2 0 25.02-999 ?-999 ?-999 ? CA CA E1135 mGLU~D 17 51.00 66.11 92.39 50.15 66.11 92.91 51.79 67.52 90.56 52.65 67.57 89.69 51.06 66.23 90.93 49.63 66.27 90.42 2 0 24.78-999 ?-999 ?-999 ? CA CA E1135 mASP~D 18 51.41 68.60 91.25 50.71 68.45 91.95 53.52 69.85 91.21 54.30 70.40 90.42 52.02 69.89 90.95 51.37 70.98 91.81 2 0 23.53-999 ?-999 ?-999 ? CA CA B1122 mALA~D 19 53.88 69.19 92.30 53.12 68.81 92.83 56.05 68.18 91.66 57.24 68.42 91.42 55.29 69.04 92.67 55.42 68.46 94.06 2 0 21.35-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 20 55.36 67.19 91.08 54.44 67.04 91.44 55.99 67.27 88.73 56.94 67.27 87.96 55.96 66.41 90.00 55.23 65.11 89.73 2 0 21.38-999 ?-999 ?-999 ? CA CA E1135 mTHR~D 21 54.92 68.04 88.53 54.18 67.92 89.18 56.13 69.89 87.43 56.83 70.06 86.42 54.92 68.96 87.40 53.62 69.78 87.36 2 0 23.71-999 ?-999 ?-999 ? CA CA E1135 mLEU~D 22 56.42 70.48 88.59 55.78 70.28 89.34 58.88 70.57 88.46 59.84 71.08 87.89 57.60 71.34 88.72 57.63 71.99 90.11 3 0 20.05-999 ?-999 ?-999 ? CA CA B1122 mARG~D 23 58.94 69.32 88.92 58.12 69.01 89.41 60.35 68.31 87.20 61.49 68.37 86.73 60.13 68.49 88.70 59.97 67.13 89.36 2 0 20.68-999 ?-999 ?-999 ? CA CA E1135 mLYS~D 24 59.26 68.12 86.47 58.40 68.13 87.00 59.94 69.10 84.32 60.71 68.94 83.37 59.32 67.91 85.03 57.92 67.62 84.47 2 0 20.41-999 ?-999 ?-999 ? CA CA E1135 mALA~D 25 59.57 70.31 84.74 58.97 70.31 85.54 61.53 71.75 84.23 62.18 72.34 83.37 60.04 71.51 84.05 59.24 72.72 84.53 2 0 21.69-999 ?-999 ?-999 ? CA CA B1122 mMET~D 26 62.09 71.28 85.33 61.49 70.73 85.91 64.43 70.43 85.24 65.60 70.68 84.95 63.49 71.56 85.65 63.65 71.78 87.16 2 0 19.38-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 27 63.87 69.23 85.25 62.90 69.28 85.50 65.26 68.00 83.61 64.61 68.06 82.57 64.53 67.97 84.95 63.50 66.85 84.94 2 0 18.08-999 ?-999 ?-999 ? CA CA B1132 mGLY.D 28 66.58 67.98 83.67 66.92 67.99 84.61 67.82 69.27 81.91 67.64 70.34 82.50 67.47 67.94 82.54-999.99-999.99-999.99 1 0 14.37-999 ?-999 ?-999 ? CA CA B1132 mILE.D 29 68.34 69.20 80.69 68.45 68.26 80.35 67.54 71.33 79.78 66.43 70.92 79.46 68.72 70.37 79.92 69.17 70.00 78.49 3 0 12.79-999 ?-999 ?-999 ? CA CA B1132 mGLY.D 30 67.79 72.62 80.02 68.72 72.82 80.31 65.75 73.68 81.01 65.65 72.79 81.86 66.74 73.61 79.87-999.99-999.99-999.99 1 0 15.84-999 ?-999 ?-999 ? CA CA B1132 mTHR.D 31 64.99 74.77 81.03 65.20 75.41 80.30 62.65 75.36 81.31 62.65 76.23 80.44 63.95 75.00 82.03 64.30 76.18 82.96 2 0 19.44-999 ?-999 ?-999 ? CA CA B1132 mASP~D 32 61.58 74.69 81.71 61.77 73.96 82.36 59.62 76.08 82.10 58.70 75.83 82.87 60.24 75.00 81.21 59.39 73.74 81.19 2 0 21.99-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 33 60.19 77.28 82.04 60.93 77.36 81.37 58.24 78.59 82.77 57.54 78.85 83.75 59.74 78.39 82.88 60.48 79.68 82.51 2 0 19.56-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 34 57.73 78.44 81.55 58.41 78.26 80.84 55.54 77.61 82.23 54.49 78.00 82.74 56.30 78.54 81.30 55.98 78.18 79.84 2 0 22.54-999 ?-999 ?-999 ? CA CA B1122 mSER~D 35 56.10 76.42 82.44 56.95 76.23 81.94 55.58 75.98 84.78 54.60 76.00 85.53 55.44 75.49 83.35 55.96 74.05 83.24 2 0 22.48-999 ?-999 ?-999 ? CA CA B1122 mILE~D 36 56.78 76.45 85.12 57.48 76.40 84.41 56.02 78.14 86.73 55.29 78.15 87.72 56.98 76.99 86.47 58.44 77.41 86.68 3 0 18.79-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 37 55.97 79.09 85.80 56.56 78.93 85.01 53.66 79.90 86.12 52.95 80.47 86.96 55.12 80.27 85.97 55.29 81.22 84.77 2 0 19.37-999 ?-999 ?-999 ? CA CA B1122 mHIS~D 38 53.21 78.92 85.34 53.90 78.54 84.71 51.47 77.97 86.81 50.45 78.39 87.37 51.83 78.45 85.41 51.55 77.31 84.42 3 0 22.53-999 ?-999 ?-999 ? CA CA B1122 mILE~D 39 52.27 77.05 87.35 53.08 76.78 86.81 51.96 77.59 89.74 51.04 77.65 90.56 51.92 76.51 88.65 52.82 75.35 89.09 3 0 21.27-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 40 53.03 78.38 89.82 53.69 78.29 89.07 52.12 80.40 90.93 51.55 80.77 91.96 53.17 79.29 90.95 54.57 79.90 91.01 3 0 18.24-999 ?-999 ?-999 ? CA CA B1122 mALA~D 41 51.86 80.93 89.74 52.39 80.53 89.00 49.45 81.53 89.75 48.61 82.35 90.16 50.89 81.99 89.56 51.07 82.61 88.18 2 0 20.33-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 42 49.13 80.27 89.44 49.89 79.66 89.21 47.32 79.14 90.70 46.14 78.86 90.93 47.72 79.89 89.44 47.28 79.10 88.20 2 0 23.50-999 ?-999 ?-999 ? CA CA B1122 mARG~D 43 48.28 78.88 91.57 49.21 79.10 91.26 48.14 79.41 93.93 49.03 80.26 93.80 47.97 78.30 92.88 48.92 77.16 93.18 2 0 22.43-999 ?-999 ?-999 ? CA CA B1122 mSER~D 44 47.34 79.37 94.98 46.67 78.62 94.93 48.66 80.04 96.95 49.22 78.94 96.92 47.42 80.30 96.09 46.18 80.08 96.97 2 0 21.79-999 ?-999 ?-999 ? CA CA B1122 mASN~D 45 49.04 81.01 97.77 48.51 81.85 97.70 50.01 79.57 99.54 50.94 78.76 99.63 50.15 80.83 98.70 50.25 82.05 99.63 2 0 18.79-999 ?-999 ?-999 ? CA CA B1122 mALA~D 46 48.86 79.37 100.19 48.17 80.08 100.06 48.93 76.88 100.26 49.49 75.93 100.81 48.68 78.18 101.03 47.29 78.16 101.64 2 0 20.93-999 ?-999 ?-999 ? CA CA B1122 mGLN~D 47 48.50 76.82 99.00 48.01 77.64 98.70 50.22 75.54 97.81 50.82 74.47 97.85 48.74 75.65 98.17 47.86 75.70 96.91 2 0 21.71-999 ?-999 ?-999 ? CA CA B1122 mARG~D 48 50.83 76.68 97.52 50.24 77.49 97.49 53.01 76.12 98.45 54.02 75.43 98.31 52.27 76.71 97.26 52.75 78.14 97.01 2 0 18.15-999 ?-999 ?-999 ? CA CA B1122 mGLN~D 49 52.49 76.36 99.66 51.65 76.89 99.70 53.13 74.30 100.85 54.03 73.58 101.28 53.21 75.82 100.81 52.68 76.46 102.09 2 0 17.67-999 ?-999 ?-999 ? CA CA B1122 mGLN~D 50 52.01 73.74 100.39 51.32 74.38 100.05 52.69 71.68 99.25 53.27 70.61 99.40 51.87 72.28 100.39 50.39 71.96 100.18 2 0 20.67-999 ?-999 ?-999 ? CA CA B1122 mILE~D 51 52.74 72.40 98.13 52.16 73.22 98.13 55.03 71.91 97.44 55.74 70.96 97.14 53.57 71.97 97.01 53.42 72.89 95.78 3 0 19.62-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 52 55.47 72.91 98.20 54.79 73.62 98.39 57.13 71.71 99.56 58.16 71.04 99.47 56.85 72.93 98.69 57.09 74.23 99.47 2 0 16.41-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 53 56.18 71.43 100.45 55.40 72.06 100.47 56.46 68.99 100.47 57.41 68.22 100.68 56.33 70.25 101.31 55.15 70.15 102.27 2 0 18.82-999 ?-999 ?-999 ? CA CA B1122 mASP~D 54 55.59 68.77 99.50 54.93 69.51 99.39 56.86 67.45 97.81 57.37 66.35 97.55 55.61 67.57 98.66 54.35 67.53 97.80 2 0 21.24-999 ?-999 ?-999 ? CA CA B1122 mTYR~D 55 57.41 68.57 97.33 56.92 69.41 97.55 59.79 68.02 97.41 60.68 67.27 97.01 58.64 68.52 96.55 58.99 69.90 95.96 3 0 18.92-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 56 59.88 68.59 98.62 59.16 69.23 98.88 60.93 66.73 99.81 61.91 65.98 99.76 61.02 68.20 99.43 61.07 69.07 100.70 2 0 17.86-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 57 59.73 66.29 100.20 59.01 66.98 100.22 59.77 63.98 99.35 60.36 62.91 99.50 59.54 64.89 100.55 58.15 64.63 101.14 2 0 21.52-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 58 59.32 64.40 98.17 58.87 65.29 98.21 60.96 63.51 96.55 61.37 62.45 96.09 59.49 63.64 96.95 58.73 64.26 95.79 3 0 19.87-999 ?-999 ?-999 ? CA CA E1135 mPHE~D 59 61.71 64.61 96.64 61.31 65.37 97.16 64.17 64.94 96.92 65.35 64.77 96.60 63.02 64.64 96.00 62.95 65.57 94.78 3 0 18.62-999 ?-999 ?-999 ? CA CA E1135 mGLY~D 60 63.93 65.29 98.19 62.97 65.41 98.44 65.80 66.76 98.86 66.85 67.00 99.44 65.06 65.46 99.10-999.99-999.99-999.99 1 0 19.25-999 ?-999 ?-999 ? CA CA B1122 mLYS.D 61 65.24 67.61 98.00 64.43 67.24 97.54 64.67 69.98 97.98 63.54 69.74 97.54 65.77 68.94 97.75 66.28 69.08 96.32 2 0 15.76-999 ?-999 ?-999 ? CA CA B1122 mHIS~D 62 64.96 71.12 98.58 65.90 71.22 98.91 63.64 72.86 97.43 64.57 73.22 96.71 63.92 72.14 98.74 64.33 73.15 99.82 3 0 13.11-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 63 62.37 73.09 97.12 61.71 72.74 97.79 62.70 75.14 95.77 63.11 75.54 94.68 61.99 73.80 95.90 60.48 74.03 95.90 3 0 12.91-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 64 62.84 75.90 96.86 62.46 75.52 97.70 64.93 77.02 96.21 65.38 77.75 95.32 63.51 77.19 96.75 63.59 77.88 98.11 2 0 9.15-999 ?-999 ?-999 ? CA CA B1122 mASP~D 65 65.66 76.05 96.77 65.21 75.52 97.49 67.08 75.47 94.82 67.95 75.92 94.07 67.02 75.85 96.29 67.72 74.80 97.16 2 0 9.17-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 66 66.14 74.66 94.35 65.47 74.34 95.02 65.97 75.56 92.10 66.60 75.75 91.06 66.15 74.30 92.93 65.01 73.31 92.63 2 0 12.15-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 67 65.07 76.44 92.57 64.61 76.20 93.42 66.03 78.61 91.89 66.37 79.29 90.93 64.85 77.67 91.79 63.54 78.35 92.21 3 0 10.72-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 68 66.73 78.63 93.03 66.40 78.03 93.75 68.93 79.11 92.07 69.63 79.93 91.49 67.89 79.51 93.12 68.51 79.48 94.51 2 0 7.87-999 ?-999 ?-999 ? CA CA B1122 mSER~D 69 68.99 77.81 91.81 68.39 77.23 92.36 69.38 77.47 89.38 70.11 77.90 88.48 69.90 77.29 90.80 70.14 75.79 91.05 2 0 11.11-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 70 68.12 77.14 89.13 67.56 76.96 89.95 67.10 78.34 87.18 67.02 78.44 85.96 67.62 77.04 87.77 66.50 75.98 87.71 2 0 13.67-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 71 66.68 79.28 88.02 66.75 79.04 88.99 67.17 81.68 87.82 68.09 81.49 88.61 66.17 80.56 87.53 64.82 80.92 88.14 3 0 12.57-999 ?-999 ?-999 ? CA CA B1122 mSER~D 72 66.99 82.84 87.19 66.22 82.90 86.55 67.24 85.28 87.41 66.19 85.44 86.79 67.92 83.92 87.49 69.12 83.88 86.54 2 0 11.80-999 ?-999 ?-999 ? CA CA B1122 mGLY~D 73 67.86 86.28 88.03 68.67 86.02 88.55 65.98 87.84 88.52 65.60 87.22 89.52 67.36 87.64 87.94-999.99-999.99-999.99 1 0 11.85-999 ?-999 ?-999 ? CA CA B1122 mASN~D 74 65.24 88.78 87.93 65.65 89.17 87.11 62.96 88.04 88.45 62.13 87.91 89.35 63.95 89.19 88.45 63.41 90.39 87.66 2 0 12.71-999 ?-999 ?-999 ? CA CA B1122 mTYR~D 75 63.08 87.19 87.43 63.77 87.42 86.74 62.44 85.15 88.61 61.50 84.76 89.30 62.21 86.01 87.38 62.49 85.19 86.13 3 0 13.59-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 76 63.72 84.88 88.88 64.38 85.25 88.23 63.46 84.75 91.31 62.71 84.10 92.02 64.08 84.12 90.06 65.60 84.04 90.25 2 0 10.25-999 ?-999 ?-999 ? CA CA B1122 mALA~D 77 63.82 86.01 91.55 64.40 86.44 90.86 61.86 86.63 92.88 61.29 86.41 93.94 63.37 86.67 92.77 63.86 88.12 92.80 2 0 8.64-999 ?-999 ?-999 ? CA CA B1122 mALA~D 78 61.18 86.85 91.75 61.72 86.94 90.91 59.10 85.60 92.10 58.05 85.48 92.73 59.72 86.96 91.84 59.18 87.59 90.57 2 0 11.86-999 ?-999 ?-999 ? CA CA B1122 mALA~D 79 59.78 84.55 91.60 60.59 84.76 91.07 59.44 82.90 93.36 58.55 82.39 94.05 59.27 83.21 91.88 60.01 82.17 91.05 2 0 11.95-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 80 60.61 83.24 93.89 61.25 83.70 93.27 60.00 83.75 96.23 59.53 83.27 97.27 60.89 82.93 95.30 62.36 83.11 95.61 3 0 8.78-999 ?-999 ?-999 ? CA CA B1122 mALA~D 81 59.72 84.99 95.82 60.19 85.28 94.99 57.44 85.13 96.78 56.88 85.11 97.88 58.79 85.82 96.59 58.60 87.16 95.87 2 0 10.26-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 82 56.90 84.55 95.71 57.46 84.60 94.88 55.60 82.65 96.66 54.58 82.30 97.24 55.60 83.89 95.77 55.11 83.50 94.37 3 0 13.47-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 83 56.76 82.03 96.79 57.50 82.44 96.25 57.00 81.21 99.11 56.68 80.38 99.96 56.93 80.85 97.63 58.19 80.09 97.21 3 0 12.29-999 ?-999 ?-999 ? CA CA B1122 mARG~D 84 57.39 82.44 99.42 57.62 83.03 98.65 56.09 82.85 101.49 55.09 83.25 100.90 57.46 82.85 100.83 58.05 84.27 100.93 2 0 11.35-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 85 55.99 82.44 102.75 56.78 81.98 103.16 54.62 84.21 103.57 55.68 84.84 103.62 54.70 82.69 103.42 54.67 82.01 104.78 2 0 14.60-999 ?-999 ?-999 ? CA CA B1122 mPRO~D 86 53.44 84.81 103.57 52.67 84.18 103.59 54.17 87.00 104.56 54.89 87.92 104.17 53.31 86.27 103.54 51.83 86.50 103.85 3 0 15.98-999 ?-999 ?-999 ? CA CA B1122 mASP~D 87 54.04 86.64 105.82 53.41 85.87 105.94 56.24 87.18 106.79 56.95 88.15 107.01 54.72 87.29 106.93 54.30 86.69 108.28 2 0 16.12-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 88 56.67 85.99 106.39 55.95 85.30 106.29 58.60 86.60 104.99 59.72 87.08 105.01 58.08 85.72 106.12 58.26 84.25 105.74 2 0 12.63-999 ?-999 ?-999 ? CA CA B1122 mPHE~D 89 57.77 86.76 103.96 56.88 86.31 104.06 58.46 89.00 103.21 59.45 89.60 102.81 58.17 87.56 102.81 57.05 87.50 101.76 3 0 11.47-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 90 57.56 89.56 104.02 56.78 88.98 104.25 58.89 91.05 105.46 59.63 92.04 105.38 57.72 90.92 104.50 56.41 91.41 105.13 3 0 13.74-999 ?-999 ?-999 ? CA CA B1122 mALA~D 91 59.08 90.08 106.33 58.38 89.37 106.30 61.54 90.08 106.46 62.43 90.88 106.75 60.22 90.06 107.24 60.15 88.83 108.13 2 0 12.88-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 92 61.67 89.22 105.45 60.87 88.63 105.34 63.00 90.42 103.79 64.11 90.86 103.49 62.84 89.14 104.60 62.76 87.96 103.63 2 0 9.18-999 ?-999 ?-999 ? CA CA B1122 mGLN~D 93 61.87 91.02 103.41 61.02 90.54 103.66 62.56 93.37 103.57 63.35 94.17 103.07 61.94 92.29 102.68 60.56 92.69 102.16 2 0 10.89-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 94 62.23 93.39 104.85 61.57 92.69 105.13 64.30 94.08 106.00 65.15 94.97 106.04 62.82 94.38 105.76 62.11 94.36 107.11 3 0 10.74-999 ?-999 ?-999 ? CA CA D1124 mHIS~D 95 64.58 92.80 106.18 63.80 92.18 106.23 66.79 92.87 105.14 67.85 93.47 105.33 65.97 92.37 106.32 66.08 90.84 106.40 3 0 9.10-999 ?-999 ?-999 ? CA CA D1124 mALA~D 96 66.32 92.64 103.92 65.45 92.15 103.88 67.17 94.62 102.69 68.18 95.18 102.25 67.08 93.10 102.76 66.48 92.56 101.47 2 0 8.09-999 ?-999 ?-999 ? CA CA D1124 mALA~D 97 66.11 95.31 103.12 65.36 94.75 103.46 67.10 97.39 104.02 67.53 98.53 103.84 66.08 96.77 103.07 64.67 97.25 103.38 2 0 7.23-999 ?-999 ?-999 ? CA CA D1124 mMET~D 98 67.48 96.66 105.06 67.10 95.73 105.07 69.82 96.77 105.94 70.71 97.56 106.27 68.36 97.17 106.10 67.92 96.63 107.47 2 0 -4.68-999 ?-999 ?-999 ? CA CA D1124smLYS~D 99 70.03 95.52 105.55 69.21 95.05 105.21 72.00 94.69 104.28 73.11 94.16 104.21 71.34 94.91 105.63 71.22 93.62 106.44 2 0 -3.67-999 ?-999 ?-999 ? CA CA D1124smGLY~D 100 71.39 95.17 103.19 70.46 95.49 103.31 73.08 96.37 101.93 73.28 96.95 103.00 72.14 95.17 101.92-999.99-999.99-999.99 1 0 -4.56-999 ?-999 ?-999 ? CA CA D1124smLEU.D 101 73.61 96.78 100.79 73.44 96.13 100.04 73.41 99.21 100.86 72.45 99.39 100.12 74.35 98.03 100.64 74.95 98.12 99.23 3 0 4.83-999 ?-999 ?-999 ? CA CA D1124 mGLY.D 102 73.65 100.01 101.90 74.44 99.75 102.46 71.42 100.76 102.67 71.14 99.56 102.81 72.80 101.16 102.17-999.99-999.99-999.99 1 0 -4.22-999 ?-999 ?-999 ? CA CA D1124smTHR.D 103 70.57 101.74 102.96 70.94 102.65 102.76 68.15 101.82 102.48 68.06 102.92 101.94 69.24 101.53 103.51 68.99 102.38 104.76 2 0 5.15-999 ?-999 ?-999 ? CA CA D1124 mASP~D 104 67.32 100.83 102.17 67.55 99.95 102.58 65.02 101.63 102.11 64.18 100.89 102.63 66.17 101.06 101.28 65.75 99.76 100.60 2 0 8.23-999 ?-999 ?-999 ? CA CA D1124 mLYS~D 105 65.04 102.94 102.32 65.73 103.45 101.80 62.67 103.59 102.80 61.75 103.56 103.62 64.11 103.54 103.27 64.67 104.91 103.65 2 0 10.38-999 ?-999 ?-999 ? CA CA D1124 mASN~D 106 62.45 103.67 101.49 63.27 103.80 100.94 60.49 102.22 101.27 59.29 102.13 101.53 61.11 103.57 100.93 61.12 103.72 99.41 2 0 13.56-999 ?-999 ?-999 ? CA CA D1124 mALA~D 107 61.29 101.17 101.24 62.24 101.38 101.00 60.30 99.73 102.96 59.25 99.14 103.20 60.78 99.82 101.52 61.91 98.82 101.30 2 0 12.69-999 ?-999 ?-999 ? CA CA D1124 mLEU~D 108 61.07 100.28 103.88 61.91 100.68 103.50 59.44 101.07 105.52 58.61 100.71 106.35 60.75 100.31 105.30 61.86 101.01 106.09 3 0 12.25-999 ?-999 ?-999 ? CA CA D1124 mILE~D 109 59.27 102.16 104.78 60.03 102.40 104.17 56.83 102.11 104.36 55.79 102.03 105.02 58.02 102.92 104.89 58.16 104.24 104.09 3 0 15.53-999 ?-999 ?-999 ? CA CA D1124 mASP~D 110 56.96 101.49 103.20 57.86 101.61 102.77 55.38 99.65 103.61 54.17 99.42 103.72 55.88 100.69 102.61 56.36 99.93 101.37 2 0 17.31-999 ?-999 ?-999 ? CA CA D1124 mILE~D 111 56.33 99.02 104.28 57.24 99.38 104.11 55.69 98.29 106.58 54.80 97.67 107.17 56.06 97.90 105.17 57.30 96.96 105.19 3 0 16.76-999 ?-999 ?-999 ? CA CA D1124 mLEU~D 112 56.32 99.30 107.18 56.96 99.81 106.60 55.12 100.75 108.83 54.63 100.95 109.95 56.07 99.59 108.59 57.41 99.86 109.30 3 0 17.14-999 ?-999 ?-999 ? CA CA D1124 mCYH~D 113 54.85 101.56 107.81 55.30 101.34 106.94 52.53 102.45 107.52 51.74 103.40 107.49 53.94 102.68 108.04 54.54 103.93 107.38 2 0 19.60-999 ?-999 ?-999 ? CA CA D1124 mTHR.D 114 52.18 101.23 107.14 52.88 100.54 107.32 50.18 99.72 107.14 49.21 99.19 106.58 50.90 100.91 106.52 51.14 100.53 105.03 2 0 22.12-999 ?-999 ?-999 ? CA CA D1124 mGLN.D 115 50.64 99.22 108.28 51.40 99.73 108.69 49.17 98.30 110.04 49.33 99.34 110.68 50.07 98.00 108.85 51.20 97.08 109.34 2 0 23.04-999 ?-999 ?-999 ? CA CA D1124 mSER~D 116 48.30 97.35 110.35 48.23 96.63 109.65 48.39 96.81 112.71 49.50 96.32 112.49 47.51 97.36 111.58 46.27 96.48 111.41 2 0 26.11-999 ?-999 ?-999 ? CA CA D1124 mASN~D 117 47.94 96.93 113.94 47.06 97.40 113.99 49.03 94.96 114.90 50.17 94.51 115.07 48.69 96.43 115.09 47.80 96.61 116.33 2 0 26.14-999 ?-999 ?-999 ? CA CA D1124 mALA~D 118 47.99 94.22 114.54 47.15 94.74 114.38 49.04 92.39 113.26 49.77 91.40 113.32 48.10 92.77 114.39 46.71 92.19 114.17 2 0 26.82-999 ?-999 ?-999 ? CA CA B1122 mGLN~D 119 49.05 93.16 112.18 48.44 93.95 112.23 51.36 93.09 111.40 52.26 92.33 111.05 49.90 92.84 111.04 49.49 93.70 109.84 2 0 23.66-999 ?-999 ?-999 ? CA CA B1122 mILE~D 120 51.55 94.20 112.11 50.71 94.73 112.28 53.40 93.52 113.53 54.55 93.09 113.44 52.86 94.60 112.60 52.75 95.94 113.37 3 0 21.59-999 ?-999 ?-999 ? CA CA D1124 mHIS~D 121 52.54 93.03 114.43 51.61 93.39 114.41 53.35 90.71 114.61 54.39 90.09 114.88 53.04 92.00 115.34 52.06 91.83 116.49 3 0 23.09-999 ?-999 ?-999 ? CA CA D1124 mALA~D 122 52.54 90.29 113.64 51.73 90.84 113.47 54.24 89.24 112.18 55.08 88.35 112.17 52.90 89.07 112.90 51.81 88.65 111.93 2 0 21.31-999 ?-999 ?-999 ? CA CA B1122 mILE~D 123 54.47 90.41 111.60 53.74 91.10 111.68 56.93 90.59 111.86 58.00 90.08 111.52 55.74 90.61 110.90 55.73 91.90 110.07 3 0 18.43-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 124 56.77 91.13 113.07 55.87 91.54 113.22 58.18 89.69 114.50 59.35 89.36 114.69 57.83 91.11 114.07 57.43 91.91 115.32 2 0 18.82-999 ?-999 ?-999 ? CA CA D1124 mALA~D 125 57.15 88.86 114.67 56.26 89.28 114.52 58.00 86.66 113.93 58.87 85.83 114.18 57.36 87.47 115.05 56.06 86.84 115.51 2 0 19.62-999 ?-999 ?-999 ? CA CA B1122 mALA~D 126 57.62 86.89 112.66 56.88 87.55 112.53 59.75 86.61 111.45 60.64 85.84 111.06 58.30 86.17 111.58 57.56 86.35 110.27 2 0 16.16-999 ?-999 ?-999 ? CA CA B1122 mPHE~D 127 60.01 87.88 111.77 59.23 88.42 112.07 62.25 87.71 112.74 63.38 87.29 112.49 61.39 88.37 111.66 61.42 89.89 111.80 3 0 14.89-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 128 61.74 87.68 113.96 60.85 88.12 114.07 62.77 85.59 114.67 63.87 85.06 114.78 62.49 87.04 115.05 61.68 87.11 116.34 2 0 17.14-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 129 61.71 84.94 114.20 60.88 85.49 114.15 62.85 83.35 112.71 63.63 82.40 112.82 61.78 83.55 113.78 60.41 83.09 113.28 3 0 16.06-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 130 62.87 84.21 111.70 62.21 84.96 111.78 65.21 84.34 110.94 66.13 83.60 110.58 63.77 84.06 110.57 63.38 84.98 109.42 3 0 12.30-999 ?-999 ?-999 ? CA CA B1122 mTYR~D 131 65.45 85.43 111.67 64.63 85.89 112.02 67.26 85.77 113.36 68.41 86.06 113.68 66.82 85.87 111.92 66.93 87.34 111.45 3 0 12.87-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 132 66.35 85.45 114.26 65.43 85.31 113.89 67.13 86.64 116.29 67.78 86.67 117.35 66.69 85.32 115.67 67.80 84.27 115.85 2 0 16.55-999 ?-999 ?-999 ? CA CA B1122 mGLU.D 133 66.75 87.76 115.68 66.24 87.61 114.82 65.77 89.87 116.37 64.77 89.46 115.78 67.06 89.07 116.23 68.05 89.82 115.35 2 0 15.45-999 ?-999 ?-999 ? CA CA D1124 mASP~D 134 65.78 90.94 117.15 66.65 91.11 117.60 64.53 92.81 116.18 65.53 93.44 115.83 64.60 91.78 117.31 64.63 92.50 118.66 2 0 15.99-999 ?-999 ?-999 ? CA CA D1124 mLEU~D 135 63.35 92.95 115.57 62.60 92.43 115.97 63.56 95.27 114.75 64.24 95.96 113.99 63.24 93.82 114.41 61.84 93.66 113.80 3 0 14.00-999 ?-999 ?-999 ? CA CA D1124 mGLU~D 136 63.11 95.74 115.90 62.62 95.05 116.44 64.79 97.40 116.62 65.27 98.46 116.23 63.31 97.11 116.36 62.50 97.37 117.64 2 0 14.70-999 ?-999 ?-999 ? CA CA D1124 mLYS~D 137 65.49 96.44 117.22 64.94 95.67 117.55 67.64 96.74 116.05 68.53 97.57 115.92 66.93 96.54 117.39 67.48 95.28 118.06 2 0 13.63-999 ?-999 ?-999 ? CA CA D1124 mGLU~D 138 67.28 95.98 115.03 66.57 95.31 115.25 67.49 97.45 113.06 68.33 98.09 112.43 67.87 96.13 113.71 67.46 94.94 112.82 2 0 10.06-999 ?-999 ?-999 ? CA CA D1124 mILE~D 139 66.23 97.88 113.16 65.60 97.30 113.68 66.66 100.30 113.14 67.07 101.26 112.49 65.88 99.16 112.50 64.38 99.45 112.62 3 0 10.11-999 ?-999 ?-999 ? CA CA D1124 mILE~D 140 66.85 100.27 114.46 66.50 99.46 114.92 69.01 101.45 114.76 69.67 102.47 114.90 67.53 101.38 115.13 67.39 101.23 116.65 3 0 11.66-999 ?-999 ?-999 ? CA CA D1124 mSER~D 141 69.58 100.33 114.31 68.98 99.53 114.29 71.10 100.80 112.43 72.21 101.10 112.00 70.97 100.33 113.87 71.55 98.91 114.03 2 0 9.10-999 ?-999 ?-999 ? CA CA D1124 mGLU~D 142 69.99 100.88 111.69 69.14 100.63 112.16 69.32 102.63 110.03 69.20 103.05 108.86 70.04 101.32 110.30 69.45 100.25 109.38 2 0 6.56-999 ?-999 ?-999 ? CA CA D1124 mTHR~D 143 68.77 103.28 111.05 68.88 102.86 111.94 68.40 105.50 111.93 68.98 105.04 112.91 68.06 104.55 110.79 66.54 104.37 110.69 2 0 9.67-999 ?-999 ?-999 ? CA CA D1124 mSER~D 144 68.07 106.79 111.85 67.65 107.08 110.99 67.41 108.84 113.07 66.65 109.11 112.14 68.34 107.64 113.00 69.80 108.10 112.98 2 0 13.00-999 ?-999 ?-999 ? CA CA D1124 mGLY~D 145 67.43 109.59 114.17 68.00 109.24 114.92 65.16 110.62 114.17 64.61 109.64 114.67 66.66 110.81 114.25-999.99-999.99-999.99 1 0 16.66-999 ?-999 ?-999 ? CA CA D1124 mASN~D 146 64.44 111.59 113.59 64.98 112.34 113.20 62.50 110.27 112.81 61.49 109.66 113.18 62.98 111.50 113.56 62.38 112.75 112.92 2 0 15.63-999 ?-999 ?-999 ? CA CA D1134 mPHE~D 147 63.17 109.95 111.71 63.94 110.55 111.48 62.78 107.56 111.81 61.79 106.82 111.88 62.74 108.79 110.92 63.58 108.62 109.66 3 0 15.66-999 ?-999 ?-999 ? CA CA D1124 mGLN~D 148 63.89 107.38 112.51 64.60 108.07 112.39 62.87 106.18 114.39 62.28 105.13 114.66 64.02 106.22 113.39 65.35 106.23 114.16 2 0 14.42-999 ?-999 ?-999 ? CA CA D1124 mARG~D 149 62.55 107.34 114.96 63.06 108.14 114.63 60.17 107.02 115.44 59.38 106.35 116.11 61.53 107.38 116.00 61.52 108.75 116.70 2 0 18.09-999 ?-999 ?-999 ? CA CA D1124 mLEU~D 150 59.90 107.44 114.21 60.61 107.97 113.75 58.52 105.58 113.46 57.47 104.98 113.70 58.60 107.10 113.64 58.38 107.79 112.29 3 0 18.75-999 ?-999 ?-999 ? CA CA D1124 mLEU~D 151 59.61 104.98 112.99 60.38 105.59 112.80 59.48 102.81 114.11 58.71 101.85 114.24 59.62 103.53 112.78 60.89 103.07 112.07 3 0 16.11-999 ?-999 ?-999 ? CA CA D1124 mVAL~D 152 60.18 103.30 115.14 60.78 104.06 114.91 58.59 102.79 116.96 58.07 101.83 117.52 60.03 102.72 116.47 60.98 103.38 117.48 3 0 17.62-999 ?-999 ?-999 ? CA CA D1124 mSER~D 153 57.92 103.92 116.76 58.46 104.65 116.36 55.67 102.98 116.36 54.85 102.30 116.97 56.50 104.04 117.10 55.97 105.43 116.71 2 0 21.01-999 ?-999 ?-999 ? CA CA D1124 mMET~D 154 55.88 102.85 115.06 56.58 103.46 114.69 55.29 100.48 114.75 54.37 99.69 114.58 55.13 101.91 114.25 55.57 101.97 112.78 2 0 20.20-999 ?-999 ?-999 ? CA CA D1124 mLEU~D 155 56.44 100.11 115.28 57.08 100.88 115.36 56.17 98.38 117.04 56.25 97.21 117.44 56.78 98.77 115.71 58.31 98.60 115.79 3 0 19.18-999 ?-999 ?-999 ? CA CA D1124 mGLN.D 156 55.60 99.31 117.80 55.61 100.24 117.45 53.64 98.25 118.86 53.08 97.67 119.79 55.00 98.90 119.07 54.78 100.13 119.98 2 0 21.42-999 ?-999 ?-999 ? CA CA C1123 mGLY.D 157 53.08 98.44 117.67 53.67 98.89 117.00 50.77 98.52 118.47 50.03 97.78 119.12 51.71 97.99 117.40-999.99-999.99-999.99 1 0 24.38-999 ?-999 ?-999 ? CA CA D1124 mGLY.D 158 50.88 99.82 118.74 51.48 100.33 118.13 49.10 101.41 119.40 48.62 102.19 120.22 50.14 100.41 119.85-999.99-999.99-999.99 1 0 24.81-999 ?-999 ?-999 ? CA CA C1123 mARG.D 159 48.73 101.38 118.12 49.25 100.75 117.54 46.37 101.94 118.46 46.05 100.78 118.74 47.64 102.25 117.67 47.39 102.08 116.16 2 0 25.84-999 ?-999 ?-999 ? CA CA D1134 mLYS.D 160 45.68 102.99 118.88 46.10 103.88 118.66 43.30 102.63 118.56 42.56 103.54 118.18 44.42 102.85 119.59 44.07 104.04 120.47 2 0 27.14-999 ?-999 ?-999 ? CA CA D1134 mGLU.D 161 43.27 101.39 118.10 43.89 100.76 118.57 40.94 100.98 117.43 40.03 101.01 116.59 42.40 101.00 117.00 42.87 99.65 116.45 2 0 29.01-999 ?-999 ?-999 ? CA CA D1134 mASP.D 162 40.72 101.00 118.74 41.52 100.99 119.33 38.81 102.45 119.43 37.68 102.63 119.90 39.33 101.03 119.21 39.20 100.23 120.52 2 0 31.10-999 ?-999 ?-999 ? CA CA D1134 mGLU.D 163 39.61 103.47 119.13 40.50 103.20 118.76 38.13 105.25 118.32 38.34 105.21 117.10 39.18 104.86 119.36 40.39 105.79 119.34 2 0 28.30-999 ?-999 ?-999 ? CA CA D1134 mPRO.D 164 36.93 105.61 118.78 36.83 105.61 119.77 36.09 107.39 117.29 36.63 108.23 118.02 35.88 105.98 117.82 34.60 105.93 118.64 3 0 29.32-999 ?-999 ?-999 ? CA CA D1134 mVAL.D 165 35.56 107.63 116.10 35.23 106.81 115.64 34.84 109.93 116.49 33.86 109.62 117.17 35.48 108.96 115.51 34.65 108.93 114.22 3 0 27.27-999 ?-999 ?-999 ? CA CA D1134 mASN~D 166 35.46 111.10 116.64 36.27 111.23 116.06 35.40 113.46 117.09 36.56 113.85 117.26 34.97 112.09 117.60 35.46 111.82 119.01 2 0 26.33-999 ?-999 ?-999 ? CA CA D1134 mALA~D 167 34.48 114.11 116.38 33.60 113.64 116.32 35.41 116.35 116.75 36.37 117.03 116.37 34.77 115.39 115.76 33.51 115.99 115.15 2 0 24.56-999 ?-999 ?-999 ? CA CA D1134 mALA~D 168 34.92 116.43 117.98 34.21 115.77 118.20 36.92 117.24 119.21 37.76 118.14 119.20 35.46 117.46 118.89 34.68 117.48 120.21 2 0 23.94-999 ?-999 ?-999 ? CA CA D1134 mHIS~D 169 37.29 116.01 119.56 36.56 115.33 119.62 39.51 115.86 118.53 40.66 116.29 118.57 38.69 115.74 119.82 38.89 114.34 120.39 3 0 22.19-999 ?-999 ?-999 ? CA CA D1134 mALA~D 170 38.91 115.40 117.43 38.00 115.03 117.56 40.01 116.93 115.86 41.06 117.21 115.31 39.62 115.49 116.16 38.76 114.93 115.04 2 0 20.40-999 ?-999 ?-999 ? CA CA D1134 mALA~D 171 39.10 117.86 116.13 38.27 117.51 116.55 40.49 119.77 116.71 41.31 120.59 116.30 39.35 119.27 115.83 38.06 120.06 116.09 2 0 18.98-999 ?-999 ?-999 ? CA CA D1134 mGLU~D 172 40.54 119.21 117.91 39.81 118.55 118.09 42.95 119.05 118.38 43.94 119.78 118.39 41.60 119.54 118.87 41.27 118.93 120.24 2 0 17.91-999 ?-999 ?-999 ? CA CA D1134 mASP~D 173 43.01 117.81 117.90 42.15 117.30 117.96 44.66 118.09 116.12 45.84 118.35 115.88 44.25 117.29 117.35 44.10 115.80 117.00 2 0 16.11-999 ?-999 ?-999 ? CA CA D1134 mALA~D 174 43.69 118.46 115.28 42.76 118.21 115.53 44.70 120.54 114.45 45.71 120.95 113.89 44.07 119.20 114.06 42.87 119.42 113.16 2 0 14.40-999 ?-999 ?-999 ? CA CA D1134 mALA~D 175 44.08 121.21 115.42 43.25 120.78 115.78 46.03 122.28 116.48 46.92 123.10 116.27 44.63 122.48 115.90 43.71 123.09 116.95 2 0 13.24-999 ?-999 ?-999 ? CA CA D1134 mALA~D 176 46.24 121.18 117.21 45.46 120.57 117.34 48.60 120.69 116.63 49.78 121.04 116.73 47.59 120.95 117.74 47.54 119.81 118.75 2 0 12.04-999 ?-999 ?-999 ? CA CA D1134 mILE~D 177 48.16 120.06 115.53 47.20 119.80 115.56 49.42 121.07 113.66 50.58 121.33 113.33 49.05 119.79 114.41 48.40 118.77 113.45 3 0 10.06-999 ?-999 ?-999 ? CA CA D1134 mTYR~D 178 48.40 121.90 113.45 47.51 121.55 113.73 49.65 124.00 113.65 50.60 124.52 113.06 48.59 123.22 112.87 47.28 124.01 112.93 3 0 8.56-999 ?-999 ?-999 ? CA CA D1134 mGLN~D 179 49.49 124.03 114.97 48.70 123.51 115.30 51.81 124.24 115.84 52.78 124.99 116.01 50.39 124.77 115.85 49.84 124.74 117.28 2 0 7.77-999 ?-999 ?-999 ? CA CA D1134 mALA~D 180 51.92 122.92 115.69 51.04 122.45 115.60 53.94 122.44 114.37 55.15 122.19 114.30 53.19 122.23 115.68 53.01 120.73 115.90 2 0 6.50-999 ?-999 ?-999 ? CA CA D1134 mGLY~D 181 53.23 122.86 113.32 52.27 123.04 113.50 53.64 124.39 111.40 54.33 125.35 111.71 53.87 123.02 112.02-999.99-999.99-999.99 1 0 -3.87-999 ?-999 ?-999 ? CA CA D1134smGLU.D 182 52.67 124.50 110.51 52.20 123.62 110.36 52.27 126.95 110.72 52.65 128.04 110.30 52.28 125.71 109.82 50.84 125.54 109.31 2 0 4.64-999 ?-999 ?-999 ? CA CA D1134 mGLY.D 183 51.73 126.81 111.92 51.57 125.86 112.21 52.60 128.53 113.44 52.49 129.37 114.32 51.40 127.98 112.72-999.99-999.99-999.99 1 0 5.93-999 ?-999 ?-999 ? CA CA D1134 mGLN.D 184 53.79 128.02 113.10 53.80 127.32 112.39 56.17 128.45 112.87 56.13 127.74 111.87 54.97 128.52 113.81 55.23 127.75 115.09 2 0 -4.16-999 ?-999 ?-999 ? CA CA D1134smILE.D 185 57.20 129.20 113.22 57.07 129.73 114.06 59.15 127.90 112.46 59.54 127.32 111.45 58.41 129.23 112.39 59.33 130.39 112.81 3 0 -4.14-999 ?-999 ?-999 ? CA CA D1134smGLY.D 186 59.32 127.39 113.67 58.98 127.97 114.42 58.95 124.97 113.68 57.95 125.17 113.00 59.96 126.09 113.88-999.99-999.99-999.99 1 0 -4.18-999 ?-999 ?-999 ? CA CA D1134smTHR.D 187 59.22 123.80 114.24 60.04 123.81 114.81 58.38 121.81 115.33 59.45 121.61 115.92 58.38 122.63 114.05 58.92 121.75 112.90 2 0 4.39-999 ?-999 ?-999 ? CA CA D1134 mASP~D 188 57.24 121.32 115.78 56.43 121.69 115.31 56.91 118.98 116.20 55.78 118.50 116.20 57.20 120.33 116.85 56.20 120.68 117.95 2 0 7.66-999 ?-999 ?-999 ? CA CA D1134 mGLU~D 189 57.94 118.38 115.62 58.81 118.86 115.75 57.13 116.06 115.74 56.44 115.18 115.22 57.78 117.13 114.88 59.15 116.68 114.36 2 0 9.26-999 ?-999 ?-999 ? CA CA D1134 mSER~D 190 57.44 116.02 117.03 58.00 116.77 117.37 55.42 114.95 117.92 54.76 113.94 118.19 56.94 114.90 117.83 57.61 114.86 119.19 2 0 12.54-999 ?-999 ?-999 ? CA CA D1134 mARG~D 191 54.81 116.11 117.65 55.40 116.88 117.42 52.74 115.52 116.48 51.65 114.96 116.54 53.35 116.15 117.73 52.80 117.56 117.91 2 0 11.90-999 ?-999 ?-999 ? CA CA D1134 mPHE~D 192 53.47 115.61 115.36 54.31 116.16 115.42 53.15 113.40 114.36 52.25 112.66 113.99 53.01 114.92 114.15 53.78 115.29 112.89 3 0 11.65-999 ?-999 ?-999 ? CA CA D1134 mASN~D 193 54.31 113.01 114.90 54.96 113.74 115.07 53.46 111.07 116.12 52.86 110.03 115.84 54.56 111.60 115.19 55.91 111.42 115.89 2 0 14.70-999 ?-999 ?-999 ? CA CA D1134 mALA~D 194 53.23 111.78 117.21 53.76 112.62 117.26 50.88 111.14 117.68 50.28 110.07 117.87 52.28 111.36 118.24 52.27 112.34 119.40 2 0 16.44-999 ?-999 ?-999 ? CA CA D1134 mVAL~D 195 50.33 112.12 116.96 50.91 112.92 116.82 48.86 110.86 115.43 47.91 110.05 115.49 48.97 111.97 116.46 48.44 113.28 115.82 3 0 16.49-999 ?-999 ?-999 ? CA CA D1134 mLEU~D 196 49.79 110.85 114.48 50.54 111.50 114.62 49.96 108.49 113.70 49.55 107.56 112.99 49.68 109.93 113.35 50.60 110.39 112.22 3 0 17.29-999 ?-999 ?-999 ? CA CA D1134 mALA~D 197 50.65 108.26 114.82 50.93 109.07 115.33 49.91 106.29 116.15 49.80 105.06 116.29 50.95 106.88 115.21 52.33 106.84 115.87 2 0 19.98-999 ?-999 ?-999 ? CA CA D1134 mTHR~D 198 49.15 107.11 116.89 49.22 108.08 116.66 46.81 106.61 117.65 46.07 105.83 118.27 48.30 106.58 117.94 48.48 107.36 119.26 2 0 21.81-999 ?-999 ?-999 ? CA CA D1134 mARG~D 199 46.34 107.54 116.83 47.03 108.11 116.40 44.41 106.61 115.65 45.10 106.30 114.68 44.90 107.69 116.61 44.58 109.09 116.07 2 0 22.08-999 ?-999 ?-999 ? CA CA D1134 mSER~D 200 43.23 106.08 115.91 42.80 106.44 116.74 42.48 105.60 113.64 42.40 106.82 113.46 42.63 105.06 115.05 41.26 104.64 115.59 2 0 25.17-999 ?-999 ?-999 ? CA CA D1134 mTYR~D 201 42.46 104.70 112.65 42.57 103.75 112.91 41.01 106.00 111.12 41.09 107.05 110.45 42.28 105.18 111.29 42.35 104.04 110.27 3 0 25.00-999 ?-999 ?-999 ? CA CA D1134 mPRO~D 202 39.86 105.58 111.62 39.90 104.69 112.09 38.85 107.80 112.05 38.43 108.78 111.44 38.65 106.40 111.47 37.58 105.69 112.32 3 0 26.35-999 ?-999 ?-999 ? CA CA D1134 mGLN~D 203 39.45 107.88 113.22 39.73 107.01 113.61 40.71 110.02 113.15 40.62 111.25 113.15 39.66 109.18 113.86 39.94 108.99 115.35 2 0 23.79-999 ?-999 ?-999 ? CA CA D1134 mLEU~D 204 41.71 109.41 112.51 41.75 108.42 112.64 41.95 110.76 110.47 42.21 111.89 110.07 42.65 110.18 111.70 43.85 109.35 111.24 3 0 20.86-999 ?-999 ?-999 ? CA CA D1134 mHIS~D 205 41.07 109.97 109.86 40.98 109.04 110.23 39.57 111.77 109.15 39.57 112.77 108.44 40.31 110.50 108.72 39.30 109.49 108.19 3 0 22.43-999 ?-999 ?-999 ? CA CA D1134 mGLN~D 206 38.96 111.71 110.32 39.06 110.84 110.80 39.17 114.02 111.13 38.92 115.20 110.92 38.21 112.87 110.83 37.44 112.47 112.09 2 0 22.43-999 ?-999 ?-999 ? CA CA D1134 mILE~D 207 40.35 113.66 111.64 40.48 112.68 111.80 41.74 115.41 110.64 41.85 116.64 110.57 41.34 114.70 111.92 42.57 114.14 112.67 3 0 18.83-999 ?-999 ?-999 ? CA CA D1134 mPHE~D 208 41.94 114.67 109.55 41.79 113.69 109.66 41.26 116.24 107.77 41.53 117.31 107.21 42.36 115.32 108.31 42.74 114.25 107.28 3 0 17.89-999 ?-999 ?-999 ? CA CA D1134 mHIS~D 209 40.01 115.85 107.98 39.92 114.96 108.43 38.81 117.93 108.41 38.58 119.03 107.92 38.87 116.67 107.57 37.56 115.89 107.68 3 0 20.28-999 ?-999 ?-999 ? CA CA D1134 mGLU~D 210 39.02 117.81 109.72 39.14 116.88 110.05 40.23 119.90 110.16 40.09 121.13 110.15 39.06 119.00 110.56 39.19 118.60 112.03 2 0 18.82-999 ?-999 ?-999 ? CA CA D1134 mTYR~D 211 41.35 119.31 109.77 41.33 118.31 109.74 42.21 121.03 108.22 42.58 122.20 108.20 42.51 120.13 109.41 43.75 119.26 109.11 3 0 15.30-999 ?-999 ?-999 ? CA CA D1134 mSER~D 212 41.53 120.49 107.21 41.27 119.53 107.35 40.30 122.45 106.35 40.25 123.46 105.64 41.19 121.26 106.02 40.50 120.37 104.98 2 0 16.93-999 ?-999 ?-999 ? CA CA D1134 mLYS~D 213 39.59 122.36 107.48 39.69 121.51 107.98 39.55 124.62 108.49 39.06 125.75 108.60 38.75 123.48 107.90 37.76 122.98 108.96 2 0 18.37-999 ?-999 ?-999 ? CA CA D1134 mILE~D 214 40.77 124.37 108.98 41.13 123.45 108.79 42.70 125.94 109.03 43.47 126.74 109.56 41.46 125.41 109.73 41.83 124.89 111.13 3 0 15.29-999 ?-999 ?-999 ? CA CA D1134 mSER~D 215 42.99 125.47 107.82 42.37 124.76 107.48 43.78 126.10 105.62 42.77 125.51 105.23 44.14 126.00 107.09 45.36 125.11 107.32 2 0 13.23-999 ?-999 ?-999 ? CA CA D1134 mASN.D 216 44.57 126.79 104.78 45.33 127.30 105.19 45.04 125.59 102.69 44.98 125.43 101.48 44.26 126.73 103.36 44.41 128.04 102.61 2 0 14.80-999 ?-999 ?-999 ? CA CA D1134 mLYS.D 217 45.76 124.81 103.50 45.81 125.10 104.46 45.80 122.34 103.51 45.37 122.27 104.66 46.42 123.63 102.95 47.91 123.60 103.27 2 0 13.40-999 ?-999 ?-999 ? CA CA D1134 mTHR~D 218 45.85 121.26 102.73 46.15 121.42 101.79 46.57 119.48 104.23 47.69 120.00 104.18 45.47 119.96 103.29 45.30 118.90 102.18 2 0 14.91-999 ?-999 ?-999 ? CA CA D1134 mILE~D 219 46.29 118.51 105.08 45.34 118.19 105.07 48.51 117.50 105.11 49.67 117.58 105.49 47.34 117.97 105.96 46.78 116.81 106.81 3 0 13.21-999 ?-999 ?-999 ? CA CA D1134 mLEU~D 220 48.21 116.96 103.93 47.22 116.94 103.76 50.16 117.57 102.61 51.38 117.45 102.65 49.19 116.46 102.99 48.47 115.95 101.73 3 0 14.48-999 ?-999 ?-999 ? CA CA D1134 mGLN~D 221 49.59 118.70 102.21 48.59 118.69 102.19 51.17 120.40 103.03 52.33 120.82 102.92 50.41 119.85 101.84 49.53 120.94 101.22 2 0 12.76-999 ?-999 ?-999 ? CA CA D1134 mALA~D 222 50.53 120.42 104.20 49.59 120.08 104.19 52.48 120.10 105.68 53.56 120.63 105.98 51.23 120.94 105.38 50.29 120.94 106.57 2 0 9.33-999 ?-999 ?-999 ? CA CA D1134 mILE~D 223 52.32 118.77 105.63 51.39 118.45 105.41 54.52 118.01 104.79 55.71 118.12 105.10 53.46 117.89 105.88 52.97 116.43 106.00 3 0 10.00-999 ?-999 ?-999 ? CA CA D1134 mGLU~D 224 54.11 117.97 103.52 53.13 117.82 103.42 55.88 119.38 102.61 57.10 119.36 102.42 55.02 118.12 102.40 54.26 118.26 101.09 2 0 11.79-999 ?-999 ?-999 ? CA CA D1134 mASN~D 225 55.24 120.45 103.06 54.26 120.32 103.24 56.71 121.77 104.53 57.73 122.46 104.60 55.91 121.72 103.25 54.88 122.86 103.22 2 0 9.02-999 ?-999 ?-999 ? CA CA D1134 mGLU~D 226 56.25 121.11 105.59 55.42 120.57 105.44 58.19 120.35 106.94 59.12 120.74 107.66 56.95 121.23 106.87 55.98 120.91 108.00 2 0 -6.28-999 ?-999 ?-999 ? CA CA D1134smPHE~D 227 58.23 119.18 106.29 57.43 119.02 105.70 60.03 117.94 105.11 59.53 118.24 104.03 59.34 118.24 106.43 58.79 116.89 106.94 3 0 9.27-999 ?-999 ?-999 ? CA CA D1134 mSER~D 228 61.14 117.20 105.16 61.50 117.05 106.08 62.34 115.29 104.19 62.42 114.86 105.35 61.75 116.67 103.94 62.85 117.62 103.44 2 0 12.68-999 ?-999 ?-999 ? CA CA D1134 mGLY~D 229 62.76 114.60 103.15 62.55 115.03 102.27 62.62 112.24 103.90 61.39 112.21 103.79 63.46 113.34 103.28-999.99-999.99-999.99 1 0 16.20-999 ?-999 ?-999 ? CA CA D1134 mASP~D 230 63.26 111.28 104.54 64.24 111.43 104.66 61.38 110.39 105.93 60.38 109.69 105.90 62.56 110.09 105.01 63.57 109.21 105.77 2 0 15.68-999 ?-999 ?-999 ? CA CA D1124 mILE~D 231 61.53 111.33 106.86 62.39 111.84 106.81 59.24 112.13 107.17 58.10 111.75 107.46 60.47 111.54 107.84 60.97 112.37 109.03 3 0 15.00-999 ?-999 ?-999 ? CA CA D1134 mLYS~D 232 59.42 113.01 106.19 60.37 113.28 106.05 57.58 112.37 104.69 56.36 112.19 104.78 58.29 113.52 105.41 58.83 114.53 104.39 2 0 13.58-999 ?-999 ?-999 ? CA CA D1134 mASN~D 233 58.35 111.57 103.94 59.32 111.80 103.91 57.00 109.50 104.19 55.94 108.93 103.87 57.72 110.45 103.25 58.80 109.68 102.48 2 0 17.24-999 ?-999 ?-999 ? CA CA D1134 mGLY~D 234 57.56 109.26 105.38 58.41 109.76 105.55 55.65 108.91 106.88 54.65 108.20 107.06 56.93 108.34 106.32-999.99-999.99-999.99 1 0 18.01-999 ?-999 ?-999 ? CA CA D1134 mLEU~D 235 55.63 110.21 107.15 56.49 110.69 107.01 53.35 110.84 106.52 52.18 110.50 106.74 54.39 110.82 107.63 54.65 112.22 108.20 3 0 15.43-999 ?-999 ?-999 ? CA CA D1134 mLEU~D 236 53.76 111.17 105.30 54.73 111.40 105.22 52.20 109.78 103.97 51.05 109.60 103.60 52.80 111.17 104.19 53.48 111.63 102.89 3 0 16.59-999 ?-999 ?-999 ? CA CA D1134 mALA~D 237 53.03 108.75 104.13 53.95 108.97 104.45 51.40 106.98 104.76 50.44 106.29 104.41 52.53 107.39 103.83 53.67 106.39 103.91 2 0 20.15-999 ?-999 ?-999 ? CA CA D1134 mILE~D 238 51.52 107.43 106.01 52.36 107.93 106.23 49.17 107.89 106.54 48.11 107.27 106.50 50.44 107.16 106.96 50.82 107.49 108.41 3 0 19.98-999 ?-999 ?-999 ? CA CA D1134 mVAL~D 239 49.26 109.18 106.20 50.17 109.59 106.26 47.39 109.17 104.59 46.18 108.91 104.59 48.05 109.88 105.77 48.34 111.35 105.37 3 0 18.79-999 ?-999 ?-999 ? CA CA D1134 mLYS~D 240 48.18 108.86 103.57 49.14 109.11 103.72 47.10 106.84 102.66 46.13 106.44 102.00 47.68 108.21 102.37 48.78 108.09 101.31 2 0 21.55-999 ?-999 ?-999 ? CA CA D1134 mSER~D 241 47.70 106.10 103.60 48.46 106.53 104.08 45.83 104.84 104.56 44.98 103.97 104.40 47.18 104.75 103.86 48.17 103.85 104.58 2 0 24.12-999 ?-999 ?-999 ? CA CA D1134 mVAL~D 242 45.63 105.92 105.30 46.41 106.54 105.35 43.27 106.60 105.01 42.16 106.08 105.14 44.37 106.16 105.99 44.52 107.22 107.09 3 0 23.64-999 ?-999 ?-999 ? CA CA D1134 mGLU~D 243 43.56 107.53 104.11 44.52 107.81 104.15 42.29 107.14 102.02 41.13 107.01 101.62 42.61 108.09 103.17 43.15 109.39 102.55 2 0 23.92-999 ?-999 ?-999 ? CA CA D1134 mASN~D 244 43.32 106.52 101.44 44.22 106.78 101.79 44.33 104.64 100.21 45.25 105.00 99.48 43.10 105.53 100.39 42.74 106.20 99.07 2 0 26.61-999 ?-999 ?-999 ? CA CA D1134 mARG~D 245 44.34 103.49 100.88 43.52 103.32 101.43 45.64 102.05 99.37 46.75 101.83 98.89 45.47 102.58 100.78 45.38 101.43 101.80 2 0 27.71-999 ?-999 ?-999 ? CA CA D1134 mPHE~D 246 44.53 101.87 98.66 43.67 102.07 99.14 45.49 102.36 96.45 46.38 101.93 95.71 44.62 101.41 97.27 43.23 101.31 96.63 3 0 29.47-999 ?-999 ?-999 ? CA CA D1124 mALA~D 247 45.19 103.65 96.60 44.44 103.84 97.23 47.39 104.74 96.29 48.26 104.96 95.45 45.92 104.69 95.87 45.27 106.05 96.09 2 0 28.17-999 ?-999 ?-999 ? CA CA D1134 mTYR~D 248 47.63 104.57 97.60 46.82 104.49 98.18 49.79 103.49 97.27 50.75 103.84 96.58 49.01 104.52 98.08 49.10 104.15 99.56 3 0 25.64-999 ?-999 ?-999 ? CA CA D1124 mPHE~D 249 49.34 102.24 97.31 48.53 102.09 97.87 50.05 101.53 95.06 51.13 101.50 94.47 50.03 101.20 96.55 49.44 99.82 96.82 3 0 24.56-999 ?-999 ?-999 ? CA CA D1124 mALA~D 250 48.90 101.88 94.49 48.12 101.85 95.12 49.87 103.27 92.72 50.71 103.03 91.84 48.79 102.26 93.08 47.40 102.76 92.73 2 0 27.22-999 ?-999 ?-999 ? CA CA D1124 mGLU~D 251 49.92 104.36 93.49 49.18 104.42 94.16 52.36 104.72 93.48 53.32 105.10 92.79 50.98 105.35 93.35 50.78 106.44 94.42 2 0 25.85-999 ?-999 ?-999 ? CA CA D1124 mARG~D 252 52.56 103.80 94.42 51.76 103.52 94.96 54.31 102.46 93.35 55.45 102.51 92.89 53.92 103.28 94.58 54.04 102.39 95.82 2 0 22.26-999 ?-999 ?-999 ? CA CA D1124 mLEU~D 253 53.34 101.69 92.88 52.50 101.77 93.41 53.86 101.63 90.49 54.73 101.22 89.72 53.48 100.82 91.72 52.15 100.10 91.46 3 0 23.58-999 ?-999 ?-999 ? CA CA B1122 mHIS~D 254 53.19 102.77 90.32 52.48 102.95 91.00 54.94 104.12 89.27 55.69 104.07 88.30 53.49 103.66 89.20 52.54 104.87 89.22 3 0 25.68-999 ?-999 ?-999 ? CA CA D1124 mHIS~D 255 55.35 104.63 90.43 54.65 104.60 91.15 57.75 104.09 90.46 58.84 104.34 89.95 56.69 105.17 90.62 56.77 105.85 91.99 3 0 22.83-999 ?-999 ?-999 ? CA CA D1124 mALA~D 256 57.47 102.86 90.89 56.57 102.76 91.33 58.73 101.58 89.21 59.86 101.30 88.81 58.43 101.79 90.70 57.89 100.50 91.31 2 0 20.75-999 ?-999 ?-999 ? CA CA D1124 mMET~D 257 57.69 101.74 88.40 56.86 102.05 88.86 58.12 102.71 86.13 58.10 102.66 84.89 57.78 101.49 86.97 56.42 100.94 86.50 2 0 23.69-999 ?-999 ?-999 ? CA CA B1122 mLYS.D 258 58.38 103.85 86.77 58.38 103.81 87.77 59.85 104.81 85.03 60.66 103.91 85.25 58.67 105.04 85.97 58.90 106.26 86.85 2 0 24.84-999 ?-999 ?-999 ? CA CA D1124 mGLY.D 259 59.89 105.62 83.99 59.08 106.21 83.96 61.43 104.43 82.39 60.75 103.41 82.38 60.90 105.72 82.97-999.99-999.99-999.99 1 0 26.32-999 ?-999 ?-999 ? CA CA D1124 mLEU.D 260 62.65 104.51 81.89 63.04 105.42 81.99 64.18 102.62 82.29 65.41 102.61 82.24 63.38 103.42 81.26 64.36 103.97 80.21 3 0 26.27-999 ?-999 ?-999 ? CA CA D1124 mGLY.D 261 63.46 101.99 83.21 62.47 102.11 83.09 63.05 100.96 85.41 62.27 101.83 85.78 64.04 101.21 84.29-999.99-999.99-999.99 1 0 22.89-999 ?-999 ?-999 ? CA CA D1124 mTHR.D 262 63.07 99.74 85.95 63.78 99.13 85.61 62.73 99.21 88.35 63.72 98.49 88.51 62.10 99.38 86.98 61.41 98.04 86.63 2 0 20.45-999 ?-999 ?-999 ? CA CA B1122 mSER~D 263 62.09 99.79 89.38 61.40 100.48 89.14 61.77 98.02 90.97 60.62 97.93 91.40 62.45 99.37 90.73 62.03 100.39 91.79 2 0 17.85-999 ?-999 ?-999 ? CA CA D1124 mASP~D 264 62.46 96.97 90.55 63.40 97.18 90.29 61.58 95.07 91.86 60.57 94.37 92.00 61.90 95.63 90.48 62.83 94.71 89.68 2 0 15.76-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 265 62.39 95.40 92.86 63.18 95.95 92.58 60.75 95.48 94.67 59.97 94.73 95.26 62.13 95.00 94.23 63.16 95.58 95.19 2 0 13.41-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 266 60.49 96.76 94.40 61.24 97.21 93.91 58.04 96.80 94.10 57.05 96.43 94.72 59.25 97.42 94.77 59.36 98.92 94.39 2 0 16.66-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 267 58.14 96.67 92.78 58.99 97.02 92.39 56.78 94.63 92.46 55.63 94.25 92.65 57.08 96.05 91.99 57.51 96.03 90.52 3 0 17.94-999 ?-999 ?-999 ? CA CA B1122 mILE~D 268 57.83 93.82 92.61 58.73 94.21 92.41 56.96 92.43 94.45 56.01 91.68 94.69 57.59 92.44 93.06 58.91 91.63 93.10 3 0 14.98-999 ?-999 ?-999 ? CA CA B1122 mARG~D 269 57.47 93.24 95.37 58.19 93.86 95.04 55.51 93.53 96.84 54.77 92.88 97.58 56.99 93.20 96.75 57.80 94.11 97.68 2 0 14.79-999 ?-999 ?-999 ? CA CA B1122 mILE~D 270 55.10 94.58 96.14 55.80 95.01 95.57 52.76 94.06 95.54 51.67 93.78 96.04 53.71 95.03 96.22 53.51 96.42 95.57 3 0 18.55-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 271 53.12 93.59 94.35 54.02 93.88 94.01 52.04 91.39 94.40 50.95 90.87 94.60 52.21 92.70 93.64 52.70 92.46 92.21 3 0 19.22-999 ?-999 ?-999 ? CA CA B1122 mVAL~D 272 53.15 90.86 94.90 53.99 91.38 94.74 52.36 89.75 96.95 51.40 89.03 97.27 53.08 89.59 95.62 54.50 89.04 95.85 3 0 16.77-999 ?-999 ?-999 ? CA CA B1122 mSER~D 273 52.79 90.72 97.77 53.49 91.32 97.38 50.78 91.25 99.12 50.06 91.00 100.10 52.25 90.87 99.11 53.03 91.91 99.92 2 0 17.59-999 ?-999 ?-999 ? CA CA B1122 mARG~D 274 50.31 91.90 98.06 50.98 92.09 97.35 48.11 91.35 97.10 46.91 91.52 96.86 48.90 92.29 98.01 48.76 93.73 97.52 2 0 21.27-999 ?-999 ?-999 ? CA CA B1122 mSER.D 275 48.80 90.33 96.59 49.74 90.27 96.90 46.92 88.76 96.16 46.03 88.49 95.35 48.19 89.40 95.64 49.21 88.31 95.26 2 0 21.32-999 ?-999 ?-999 ? CA CA B1122 mGLU.D 276 46.82 88.48 97.46 47.58 88.78 98.04 44.86 88.61 98.99 44.17 88.08 99.86 45.63 87.79 97.97 46.04 86.43 98.56 2 0 23.25-999 ?-999 ?-999 ? CA CA B1122 mILE.D 277 44.99 89.93 98.93 45.57 90.26 98.18 43.48 91.86 99.22 42.28 91.96 99.48 44.34 90.80 99.91 45.37 91.52 100.80 3 0 25.10-999 ?-999 ?-999 ? CA CA B1122 mASP~D 278 44.10 92.68 98.38 45.06 92.49 98.21 43.94 94.24 96.47 43.74 95.39 96.08 43.35 93.78 97.78 43.28 94.97 98.75 2 0 26.98-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 279 44.66 93.37 95.76 44.77 92.47 96.19 44.15 94.04 93.42 44.44 94.64 92.38 45.22 93.74 94.47 46.15 92.63 93.96 3 0 25.63-999 ?-999 ?-999 ? CA CA B1122 mALA~D 280 42.94 93.54 93.63 42.86 92.98 94.46 41.47 95.28 92.75 41.43 95.94 91.71 41.84 93.80 92.71 40.63 92.94 93.05 2 0 29.11-999 ?-999 ?-999 ? CA CA B1122 mASN~D 281 41.23 95.78 93.96 41.24 95.10 94.69 42.19 98.03 93.79 42.07 99.09 93.17 40.98 97.20 94.18 40.63 97.44 95.64 2 0 30.87-999 ?-999 ?-999 ? CA CA B1122 mILE~D 282 43.40 97.53 94.09 43.42 96.66 94.58 44.61 98.47 92.16 44.92 99.56 91.68 44.57 98.30 93.68 45.90 97.70 94.16 3 0 28.32-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 283 44.23 97.42 91.44 44.03 96.60 91.98 43.08 98.51 89.55 43.31 99.32 88.65 44.13 97.48 89.99 43.73 96.11 89.43 2 0 29.26-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 284 41.91 98.45 90.17 41.85 97.71 90.84 41.26 100.83 90.13 41.03 101.70 89.28 40.81 99.38 89.90 39.60 99.08 90.78 2 0 32.93-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 285 41.92 101.07 91.26 42.06 100.26 91.84 43.47 102.89 90.65 43.44 104.04 90.19 42.38 102.41 91.61 42.89 102.51 93.05 2 0 32.72-999 ?-999 ?-999 ? CA CA B1122 mPHE~D 286 44.45 102.05 90.34 44.39 101.15 90.76 44.94 102.90 88.10 45.53 103.70 87.36 45.52 102.48 89.44 46.51 101.33 89.22 3 0 30.93-999 ?-999 ?-999 ? CA CA B1122 mGLN~D 287 43.82 102.26 87.72 43.42 101.61 88.37 42.81 104.02 86.39 43.34 104.89 85.70 43.31 102.57 86.38 42.21 101.61 85.97 2 0 33.71-999 ?-999 ?-999 ? CA CA B1122 mALA~D 288 41.83 104.24 87.24 41.53 103.42 87.72 42.31 106.63 87.64 42.16 107.75 87.15 41.24 105.55 87.46 40.31 105.48 88.66 2 0 34.80-999 ?-999 ?-999 ? CA CA D1134 mMET~D 289 43.42 106.29 88.31 43.48 105.33 88.58 45.33 107.62 87.41 45.90 108.71 87.32 44.43 107.31 88.58 45.28 106.89 89.79 2 0 31.67-999 ?-999 ?-999 ? CA CA D1134 mTYR~D 290 45.51 106.68 86.49 44.95 105.85 86.60 45.89 106.63 84.03 46.56 106.87 83.03 46.47 106.89 85.41 47.69 105.98 85.66 3 0 33.58-999 ?-999 ?-999 ? CA CA D1134 mGLY~D 291 44.66 106.13 83.99 44.24 106.01 84.88 44.48 104.52 82.10 43.79 103.96 81.24 43.98 105.79 82.75-999.99-999.99-999.99 1 0 36.57-999 ?-999 ?-999 ? CA CA B1122 mLYS.D 292 45.67 104.06 82.47 46.12 104.62 83.17 46.09 101.67 82.83 46.13 101.82 84.05 46.27 102.86 81.90 47.76 103.10 81.63 2 0 33.79-999 ?-999 ?-999 ? CA CA B1122 mSER~D 293 45.89 100.47 82.29 45.83 100.44 81.29 47.12 99.04 83.86 48.19 99.31 83.30 45.78 99.31 83.18 45.35 98.08 82.38 2 0 31.66-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 294 47.06 98.49 85.07 46.14 98.37 85.44 49.09 97.15 84.85 50.26 97.38 84.52 48.31 98.11 85.75 47.94 97.43 87.07 3 0 27.97-999 ?-999 ?-999 ? CA CA B1122 mTYR~D 295 48.38 96.14 84.37 47.45 96.14 84.74 49.72 95.74 82.32 50.90 95.42 82.19 48.86 95.14 83.43 47.64 94.44 82.83 3 0 27.50-999 ?-999 ?-999 ? CA CA B1122 mGLU~D 296 49.12 96.61 81.52 48.16 96.79 81.73 51.08 97.98 80.95 52.16 98.02 80.35 49.86 97.24 80.42 48.94 98.20 79.65 2 0 29.52-999 ?-999 ?-999 ? CA CA B1122 mPHE~D 297 50.92 98.55 82.15 50.01 98.50 82.56 53.20 98.18 82.95 54.36 98.40 82.58 52.09 99.20 82.73 51.73 99.88 84.05 3 0 27.66-999 ?-999 ?-999 ? CA CA B1122 mILE~D 298 52.82 97.07 83.57 51.86 97.05 83.84 54.28 95.43 82.49 55.49 95.34 82.28 53.78 96.00 83.82 53.13 94.89 84.67 3 0 24.35-999 ?-999 ?-999 ? CA CA B1122 mALA~D 299 53.36 95.09 81.60 52.42 95.27 81.90 54.78 95.28 79.57 55.69 94.71 78.96 53.70 94.50 80.31 52.45 94.39 79.44 2 0 26.14-999 ?-999 ?-999 ? CA CA B1122 mASP~D 300 54.67 96.60 79.65 53.92 96.93 80.23 56.79 97.88 79.79 57.70 98.58 79.34 55.60 97.48 78.95 54.85 98.72 78.44 2 0 27.44-999 ?-999 ?-999 ? CA CA B1122 mASP.D 301 56.85 97.42 81.04 56.07 96.88 81.35 58.88 96.53 82.12 60.09 96.63 82.38 58.03 97.75 81.84 57.65 98.45 83.15 2 0 24.38-999 ?-999 ?-999 ? CA CA B1122 mCYH.D 302 58.28 95.35 82.07 57.31 95.35 81.82 59.26 93.28 81.16 58.49 93.35 80.20 59.07 94.16 82.38 58.42 93.37 83.52 2 0 21.71-999 ?-999 ?-999 ? CA CA B1122 mSER~D 303 60.30 92.45 81.21 60.85 92.47 82.04 60.65 90.12 80.44 60.79 89.78 81.62 60.53 91.59 80.05 61.76 92.07 79.28 2 0 22.05-999 ?-999 ?-999 ? CA CA B1122 mGLY~D 304 60.54 89.25 79.44 60.34 89.70 78.57 59.72 87.11 80.46 58.53 87.40 80.52 60.68 87.82 79.54-999.99-999.99-999.99 1 0 21.53-999 ?-999 ?-999 ? CA CA B1122 mASP~D 305 60.25 86.12 81.17 61.24 86.00 81.04 58.98 86.05 83.28 57.86 85.89 83.75 59.44 85.28 82.05 60.29 84.06 82.45 2 0 19.52-999 ?-999 ?-999 ? CA CA B1122 mTYR~D 306 59.89 86.90 83.75 60.78 86.84 83.30 58.28 88.55 84.57 57.32 88.49 85.34 59.59 87.82 84.85 60.73 88.80 85.00 3 0 17.34-999 ?-999 ?-999 ? CA CA B1122 mLYS~D 307 58.27 89.21 83.41 59.11 89.16 82.88 55.86 89.04 82.89 54.75 89.40 83.30 57.08 89.95 82.98 57.35 90.63 81.64 2 0 20.71-999 ?-999 ?-999 ? CA CA B1122 mASP~D 308 56.07 87.84 82.36 57.02 87.67 82.08 54.46 86.44 83.56 53.26 86.24 83.78 54.98 86.88 82.20 55.47 85.70 81.37 2 0 21.97-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 309 55.36 86.25 84.52 56.31 86.40 84.28 54.11 86.97 86.51 53.08 86.75 87.16 54.87 85.83 85.84 56.06 85.41 86.71 3 0 19.25-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 310 54.65 88.19 86.41 55.50 88.26 85.89 52.60 89.50 86.45 51.59 89.64 87.15 53.98 89.32 87.07 54.78 90.60 86.96 3 0 19.66-999 ?-999 ?-999 ? CA CA B1122 mLEU~D 311 52.57 89.45 85.12 53.46 89.32 84.67 50.27 88.57 84.93 49.12 88.95 85.14 51.30 89.57 84.42 51.45 89.43 82.90 3 0 23.38-999 ?-999 ?-999 ? CA CA B1122 mGLN~D 312 50.67 87.32 85.14 51.65 87.16 85.02 49.22 86.39 86.93 48.08 86.03 87.23 49.70 86.29 85.50 50.24 84.89 85.22 2 0 23.45-999 ?-999 ?-999 ? CA CA B1122 mILE~D 313 50.04 86.89 87.85 50.98 87.08 87.55 48.52 88.26 89.19 47.44 88.17 89.77 49.51 87.09 89.20 50.64 87.41 90.19 3 0 21.75-999 ?-999 ?-999 ? CA CA B1122 mTHR~D 314 48.92 89.36 88.57 49.80 89.27 88.11 46.76 90.45 87.92 45.77 90.84 88.53 48.13 90.60 88.57 48.85 91.75 87.83 2 0 23.91-999 ?-999 ?-999 ? CA CA B1122 mGLY~D 315 46.71 89.97 86.68 47.58 89.66 86.30 45.28 91.12 85.06 46.02 92.10 85.22 45.43 89.91 85.97-999.99-999.99-999.99 1 0 27.27-999 ?-999 ?-999 ? CA CA B1122 mHIS.D 316 44.36 91.04 84.10 43.85 90.18 84.09 43.40 93.30 83.74 43.72 94.43 83.33 44.13 92.11 83.13 43.37 91.60 81.90 3 0 30.30-999 ?-999 ?-999 ? CA CA B1122 mVAL.E 2 47.73 42.53 120.41 47.51 41.66 119.98 49.50 44.20 120.84 50.40 43.37 120.99 48.04 43.81 121.05 47.79 43.78 122.57 3 0 36.45-999 ?-999 ?-999 ? CA CA A1121 mVAL.E 3 49.73 45.47 120.53 48.91 46.02 120.34 51.40 46.72 121.77 50.60 47.50 122.28 51.10 45.96 120.48 51.41 46.82 119.25 3 0 32.99-999 ?-999 ?-999 ? CA CA A1121 mGLN.E 4 52.55 46.42 122.37 53.14 45.77 121.90 54.29 46.75 124.06 54.92 45.83 123.55 52.86 47.06 123.65 51.89 46.53 124.72 2 0 30.20-999 ?-999 ?-999 ? CA CA A1121 mGLY.E 5 54.83 47.55 124.98 54.25 48.30 125.30 56.17 46.46 126.69 55.14 45.87 127.04 56.19 47.31 125.44-999.99-999.99-999.99 1 0 27.04-999 ?-999 ?-999 ? CA CA A1121 mTHR.E 6 57.31 46.42 127.37 58.00 47.04 127.01 57.65 46.38 129.81 57.75 45.82 130.90 57.53 45.58 128.53 58.81 44.74 128.33 2 0 26.73-999 ?-999 ?-999 ? CA CA A1121 mVAL.E 7 57.65 47.71 129.70 57.62 48.08 128.77 56.38 49.24 131.14 55.87 49.85 130.21 57.71 48.51 130.92 58.85 49.54 130.91 3 0 24.73-999 ?-999 ?-999 ? CA CA A1121 mLYS.E 8 55.83 49.13 132.34 56.37 48.58 132.97 54.71 50.54 133.98 55.58 50.23 134.79 54.55 49.73 132.69 53.45 48.69 132.88 2 0 26.83-999 ?-999 ?-999 ? CA CA A1121 mPRO.E 9 53.85 51.53 134.19 53.17 51.66 133.47 53.88 51.49 136.65 53.00 50.64 136.73 53.96 52.36 135.39 52.72 53.25 135.34 3 0 26.58-999 ?-999 ?-999 ? CA CA A1121 mHIS.E 10 54.77 51.76 137.60 55.45 52.44 137.34 53.60 51.61 139.76 53.33 52.81 139.83 54.75 51.10 138.91 56.07 51.35 139.64 3 0 27.36-999 ?-999 ?-999 ? CA CA A1121 mALA.E 11 52.89 50.68 140.43 53.21 49.74 140.32 52.24 51.62 142.58 53.41 51.44 142.90 51.75 51.10 141.24 50.74 49.98 141.40 2 0 30.69-999 ?-999 ?-999 ? CA CA A1121 mSER.E 12 51.35 52.28 143.31 50.44 52.32 142.88 52.94 53.70 144.48 53.84 53.64 145.31 51.67 52.87 144.60 51.78 51.75 145.63 2 0 31.52-999 ?-999 ?-999 ? CA CA A1121 mPHE.E 13 53.02 54.45 143.39 52.21 54.43 142.81 54.42 56.40 144.07 53.52 57.22 144.25 54.22 55.24 143.10 54.13 55.78 141.67 3 0 27.99-999 ?-999 ?-999 ? CA CA A1121 mASN~E 14 55.61 56.49 144.64 56.21 55.70 144.49 57.34 58.18 144.98 58.36 57.57 145.29 55.97 57.66 145.43 55.96 57.35 146.92 2 0 27.17-999 ?-999 ?-999 ? CA CA A1121 mSER~E 15 57.33 59.28 144.22 56.43 59.69 144.11 59.56 60.25 144.64 60.76 60.03 144.49 58.55 59.80 143.61 58.21 60.97 142.68 2 0 23.70-999 ?-999 ?-999 ? CA CA A1121 mARG~E 16 59.10 60.88 145.72 58.11 61.03 145.75 60.79 60.12 147.35 62.01 60.14 147.53 60.03 61.30 146.76 59.28 62.02 147.89 2 0 24.40-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 17 60.06 59.06 147.70 59.08 59.13 147.49 61.76 57.31 147.42 62.87 56.96 147.84 60.70 57.91 148.33 59.63 56.87 148.68 2 0 25.52-999 ?-999 ?-999 ? CA CA A1121 mASP~E 18 61.39 57.20 146.15 60.45 57.51 145.98 63.52 57.49 144.94 64.60 56.95 144.71 62.25 56.67 145.11 61.47 56.56 143.80 2 0 22.54-999 ?-999 ?-999 ? CA CA A1121 mALA~E 19 63.42 58.81 145.07 62.49 59.16 145.20 65.48 59.41 146.24 66.71 59.37 146.20 64.62 59.65 145.01 64.21 61.11 144.92 2 0 20.20-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 20 64.84 59.30 147.41 63.85 59.41 147.40 66.34 57.66 148.47 67.52 57.47 148.80 65.68 59.03 148.59 64.85 59.15 149.87 2 0 22.52-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 21 65.63 56.69 147.90 64.69 56.92 147.66 67.51 55.51 146.81 68.58 54.98 147.14 66.26 55.38 147.67 65.29 54.38 147.02 2 0 22.43-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 22 67.40 56.21 145.68 66.49 56.58 145.50 69.71 57.06 145.52 70.88 56.74 145.30 68.56 56.38 144.80 68.16 57.15 143.54 3 0 18.66-999 ?-999 ?-999 ? CA CA A1121 mARG~E 23 69.42 58.00 146.41 68.44 58.18 146.53 71.25 57.72 148.01 72.49 57.66 148.03 70.48 58.70 147.13 69.85 59.78 148.02 2 0 19.12-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 24 70.46 56.96 148.75 69.49 57.15 148.61 71.94 55.02 148.96 73.02 54.76 149.49 70.96 55.96 149.66 69.79 55.16 150.25 2 0 22.01-999 ?-999 ?-999 ? CA CA A1121 mALA~E 25 71.58 54.56 147.77 70.72 54.93 147.43 73.73 54.19 146.60 74.58 53.45 146.10 72.39 53.60 147.03 71.64 53.13 145.80 2 0 20.25-999 ?-999 ?-999 ? CA CA A1121 mMET.E 26 73.89 55.51 146.74 73.11 55.98 147.15 75.88 56.82 147.46 77.10 56.99 147.37 75.11 56.18 146.31 74.79 57.28 145.27 2 0 17.95-999 ?-999 ?-999 ? CA CA A1121 mLYS.E 27 75.22 57.23 148.53 74.24 57.01 148.54 76.79 57.01 150.42 76.38 55.88 150.71 75.91 57.95 149.60 74.94 58.69 150.52 2 0 18.02-999 ?-999 ?-999 ? CA CA A1131 mGLY.E 28 77.97 57.48 150.77 78.14 58.42 150.49 79.75 55.76 150.61 79.42 55.59 149.43 78.94 56.68 151.51-999.99-999.99-999.99 1 0 14.67-999 ?-999 ?-999 ? CA CA A1131 mILE.E 29 80.81 55.16 151.14 81.00 55.37 152.10 80.72 53.13 149.76 79.88 52.58 150.47 81.61 54.25 150.32 82.80 53.64 151.11 3 0 13.07-999 ?-999 ?-999 ? CA CA A1131 mGLY.E 30 80.92 52.83 148.48 81.64 53.37 148.03 79.02 52.37 146.96 78.56 53.48 147.22 80.15 51.80 147.79-999.99-999.99-999.99 1 0 16.22-999 ?-999 ?-999 ? CA CA A1131 mTHR.E 31 78.57 51.61 145.98 79.11 50.78 145.85 76.51 50.71 145.03 76.96 49.69 144.52 77.41 51.94 145.16 77.79 52.41 143.74 2 0 18.88-999 ?-999 ?-999 ? CA CA A1121 mASP~E 32 75.28 50.84 145.49 75.08 51.75 145.86 73.62 49.71 144.09 72.47 50.12 143.94 74.30 49.76 145.45 73.28 49.94 146.57 2 0 20.74-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 33 74.35 49.22 143.08 75.26 48.87 143.31 72.46 48.44 141.71 71.56 48.78 140.95 73.77 49.23 141.74 74.75 48.68 140.71 2 0 18.64-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 34 72.36 47.39 142.52 73.14 47.24 143.13 69.89 47.38 142.72 68.93 47.19 141.99 71.16 46.56 142.50 71.21 45.43 143.52 2 0 21.78-999 ?-999 ?-999 ? CA CA A1121 mSER~E 35 69.92 48.26 143.72 70.77 48.25 144.24 68.63 50.19 142.90 67.50 50.54 142.56 68.80 49.14 144.00 69.02 49.86 145.34 2 0 21.71-999 ?-999 ?-999 ? CA CA A1121 mILE~E 36 69.71 50.71 142.34 70.58 50.40 142.71 68.88 51.07 140.04 67.96 51.67 139.48 69.56 51.69 141.26 70.92 52.29 140.87 3 0 18.00-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 37 69.31 49.88 139.63 70.09 49.54 140.16 67.20 48.97 138.76 66.34 49.18 137.90 68.70 49.16 138.52 69.34 47.76 138.36 2 0 18.67-999 ?-999 ?-999 ? CA CA A1121 mHIS~E 38 66.89 48.53 139.98 67.65 48.49 140.62 64.60 49.36 140.19 63.51 49.35 139.62 65.51 48.15 140.30 65.48 47.54 141.70 3 0 21.87-999 ?-999 ?-999 ? CA CA A1121 mILE~E 39 65.07 50.50 140.69 65.96 50.46 141.15 64.07 52.06 139.06 62.97 52.31 138.57 64.25 51.70 140.52 64.88 52.88 141.27 3 0 20.53-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 40 65.19 52.12 138.33 66.04 51.86 138.80 64.33 51.59 136.10 63.59 51.98 135.19 65.11 52.57 136.95 66.50 52.78 136.35 3 0 17.82-999 ?-999 ?-999 ? CA CA A1121 mALA~E 41 64.52 50.28 136.32 65.09 50.03 137.11 62.41 49.13 135.67 61.65 48.77 134.76 63.88 49.35 135.38 64.64 48.04 135.32 2 0 20.21-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 42 61.96 49.37 136.90 62.61 49.78 137.54 59.67 50.24 137.36 58.51 50.12 137.73 60.57 49.02 137.20 60.46 48.11 138.44 2 0 23.30-999 ?-999 ?-999 ? CA CA A1121 mARG~E 43 60.22 51.42 137.08 61.20 51.39 136.90 59.35 53.11 135.59 60.32 52.94 134.85 59.42 52.64 137.05 59.99 53.73 137.94 2 0 22.19-999 ?-999 ?-999 ? CA CA A1121 mSER~E 44 58.19 53.61 135.20 57.50 53.69 135.92 58.73 55.31 133.51 59.21 55.97 134.45 57.99 54.01 133.81 56.49 54.17 133.54 2 0 22.00-999 ?-999 ?-999 ? CA CA A1121 mASN~E 45 58.82 55.66 132.23 58.36 55.05 131.58 58.94 58.07 132.54 59.72 58.82 133.15 59.53 56.86 131.84 59.61 57.09 130.33 2 0 19.25-999 ?-999 ?-999 ? CA CA A1121 mALA~E 46 57.63 58.24 132.49 57.13 57.54 131.98 57.31 59.42 134.64 57.57 60.48 135.22 57.01 59.39 133.16 55.51 59.41 132.93 2 0 21.19-999 ?-999 ?-999 ? CA CA A1121 mGLN~E 47 57.28 58.25 135.29 57.03 57.45 134.75 59.06 58.63 136.96 59.36 59.37 137.90 57.62 58.22 136.72 57.32 56.83 137.29 2 0 21.69-999 ?-999 ?-999 ? CA CA A1121 mARG~E 48 59.98 58.19 136.12 59.63 57.59 135.39 61.57 60.07 136.17 62.48 60.66 136.74 61.39 58.55 136.25 62.24 57.91 135.16 2 0 18.01-999 ?-999 ?-999 ? CA CA A1121 mGLN~E 49 60.73 60.74 135.39 60.02 60.21 134.93 60.56 62.87 136.59 61.16 63.85 137.03 60.93 62.20 135.27 60.06 62.72 134.13 2 0 17.55-999 ?-999 ?-999 ? CA CA A1121 mGLN~E 50 59.57 62.28 137.26 59.14 61.50 136.81 60.24 62.49 139.60 60.57 63.24 140.52 59.17 62.81 138.57 57.81 62.24 138.96 2 0 20.37-999 ?-999 ?-999 ? CA CA A1121 mILE~E 51 60.89 61.34 139.40 60.60 60.78 138.62 63.10 62.01 140.20 63.75 62.38 141.18 61.96 61.01 140.35 62.46 59.57 140.12 3 0 18.92-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 52 63.36 62.44 138.96 62.75 62.11 138.24 64.21 64.70 139.36 65.04 65.34 140.01 64.50 63.34 138.75 64.82 63.49 137.27 2 0 15.80-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 53 62.96 65.14 139.18 62.35 64.56 138.65 62.77 66.40 141.28 63.32 67.31 141.88 62.59 66.43 139.77 61.12 66.76 139.44 2 0 18.25-999 ?-999 ?-999 ? CA CA A1121 mASP~E 54 62.26 65.31 141.88 61.85 64.63 141.28 63.79 65.08 143.82 64.14 65.72 144.81 62.35 65.20 143.33 61.49 64.01 143.81 2 0 20.41-999 ?-999 ?-999 ? CA CA A1121 mTYR~E 55 64.61 64.28 143.15 64.18 63.77 142.40 66.68 65.56 143.55 67.40 65.91 144.49 66.02 64.18 143.53 66.79 63.26 142.57 3 0 17.89-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 56 66.52 66.32 142.47 65.94 65.91 141.76 66.65 68.59 143.45 67.39 69.43 143.96 67.16 67.63 142.38 66.91 68.26 141.00 2 0 16.85-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 57 65.35 68.50 143.75 64.84 67.80 143.24 65.24 68.97 146.14 65.61 69.80 146.97 64.76 69.38 144.76 63.22 69.36 144.72 2 0 20.58-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 58 65.30 67.64 146.37 65.02 67.04 145.63 67.26 67.47 147.88 67.71 67.76 148.99 65.78 67.20 147.68 65.57 65.70 147.85 3 0 21.70-999 ?-999 ?-999 ? CA CA A1121 mPHE~E 59 68.07 67.29 146.82 67.64 67.13 145.93 70.24 68.51 146.47 71.39 68.78 146.87 69.50 67.35 147.09 70.14 66.00 146.71 3 0 19.42-999 ?-999 ?-999 ? CA CA A1121 mGLY~E 60 69.67 69.24 145.52 68.74 68.94 145.27 71.44 69.93 143.94 72.33 70.70 143.61 70.36 70.37 144.92-999.99-999.99-999.99 1 0 18.13-999 ?-999 ?-999 ? CA CA A1121 mLYS.E 61 71.31 68.70 143.46 70.55 68.20 143.89 71.25 67.26 141.50 70.28 66.68 142.00 72.13 68.10 142.43 73.20 67.18 143.01 2 0 14.50-999 ?-999 ?-999 ? CA CA A1121 mHIS~E 62 71.57 67.20 140.21 72.40 67.69 139.95 71.06 64.95 139.34 72.24 64.62 139.44 70.72 66.44 139.30 70.87 66.96 137.86 3 0 12.07-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 63 70.04 64.10 139.21 69.14 64.53 139.12 71.31 62.29 138.12 72.20 61.48 138.35 70.28 62.65 139.20 69.01 61.86 138.93 3 0 11.81-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 64 71.15 62.87 136.93 70.41 63.54 136.87 73.49 62.73 136.20 74.36 61.93 135.88 72.03 62.49 135.83 71.72 63.33 134.58 2 0 8.13-999 ?-999 ?-999 ? CA CA A1121 mASP~E 65 73.74 63.87 136.85 72.94 64.44 137.06 75.63 63.21 138.25 76.79 62.80 138.17 75.11 64.18 137.20 75.26 65.64 137.63 2 0 7.73-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 66 74.78 62.79 139.18 73.88 63.22 139.14 75.52 60.46 139.50 76.49 59.77 139.84 75.18 61.79 140.18 74.11 61.59 141.25 2 0 10.59-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 67 74.76 60.06 138.48 74.01 60.66 138.23 76.34 58.90 136.98 77.22 58.04 137.02 75.08 58.79 137.82 73.90 58.33 136.97 3 0 9.34-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 68 76.47 60.00 136.24 75.67 60.59 136.27 78.92 60.18 136.29 79.99 59.82 135.80 77.66 60.30 135.45 77.57 61.73 134.89 2 0 -6.18-999 ?-999 ?-999 ? CA CA A1121smSER~E 69 78.81 60.49 137.58 77.91 60.82 137.86 80.06 58.92 139.05 81.16 58.39 139.17 79.94 60.33 138.48 79.81 61.33 139.64 2 0 9.26-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 70 78.94 58.33 139.46 78.10 58.81 139.19 78.97 55.85 139.38 79.40 54.78 139.84 78.97 57.10 140.24 77.75 57.08 141.18 2 0 12.00-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 71 78.46 55.96 138.15 78.12 56.87 137.92 79.43 54.94 136.12 80.00 56.01 135.90 78.42 54.82 137.24 77.03 54.64 136.62 3 0 11.09-999 ?-999 ?-999 ? CA CA A1121 mSER~E 72 79.62 53.85 135.39 79.03 53.08 135.66 80.14 52.90 133.15 79.27 52.05 133.28 80.59 53.79 134.30 81.93 53.25 134.83 2 0 10.73-999 ?-999 ?-999 ? CA CA A1121 mGLY~E 73 80.81 53.08 132.01 81.45 53.85 132.03 79.18 52.02 130.45 78.34 52.90 130.64 80.62 52.25 130.84-999.99-999.99-999.99 1 0 11.34-999 ?-999 ?-999 ? CA CA A1121 mASN~E 74 78.89 50.86 129.88 79.66 50.22 129.84 76.45 50.72 130.37 75.38 51.20 130.01 77.57 50.55 129.35 77.54 49.13 128.78 2 0 12.61-999 ?-999 ?-999 ? CA CA A1121 mTYR~E 75 76.68 50.30 131.61 77.58 49.88 131.76 75.31 51.96 132.81 74.16 52.31 133.04 75.67 50.47 132.65 76.16 49.91 133.97 3 0 13.10-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 76 76.32 52.81 132.71 77.21 52.39 132.54 75.23 54.77 131.74 74.25 55.48 131.95 76.11 54.25 132.86 77.45 54.98 132.84 2 0 9.48-999 ?-999 ?-999 ? CA CA A1121 mALA~E 77 75.57 54.37 130.52 76.35 53.74 130.48 73.41 54.35 129.38 72.46 55.07 129.06 74.85 54.84 129.35 75.56 54.38 128.08 2 0 8.78-999 ?-999 ?-999 ? CA CA A1121 mALA~E 78 73.24 53.09 129.77 74.07 52.61 130.04 71.03 53.12 130.85 69.84 53.35 130.60 71.91 52.50 129.77 71.99 50.99 129.92 2 0 12.09-999 ?-999 ?-999 ? CA CA A1121 mALA~E 79 71.61 53.38 132.02 72.54 53.04 132.09 70.52 55.51 132.64 69.40 55.98 132.83 70.92 54.10 133.10 71.86 54.21 134.29 2 0 11.69-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 80 71.48 56.22 132.05 72.35 55.74 131.98 70.22 57.56 130.43 69.32 58.40 130.40 71.26 57.57 131.54 72.56 58.16 131.02 3 0 8.61-999 ?-999 ?-999 ? CA CA A1121 mALA~E 81 70.33 56.62 129.50 71.13 56.02 129.61 67.93 56.32 128.96 66.96 56.79 128.37 69.35 56.49 128.43 69.72 55.31 127.55 2 0 10.73-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 82 67.77 55.65 130.10 68.61 55.29 130.52 65.94 56.73 131.35 64.73 56.89 131.57 66.43 55.48 130.65 66.40 54.31 131.63 3 0 13.59-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 83 66.84 57.63 131.72 67.80 57.41 131.53 65.86 59.89 131.38 65.06 60.75 131.75 66.38 58.86 132.37 67.49 59.46 133.25 3 0 12.28-999 ?-999 ?-999 ? CA CA A1121 mARG~E 84 66.29 59.82 130.13 66.88 59.03 129.94 64.46 60.74 128.76 63.90 59.65 128.64 65.93 60.81 129.13 66.78 60.61 127.87 2 0 11.96-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 85 63.82 61.88 128.49 64.29 62.72 128.74 62.65 61.16 126.49 63.72 61.26 125.89 62.49 61.81 127.86 61.87 63.20 127.75 2 0 15.34-999 ?-999 ?-999 ? CA CA A1121 mPRO~E 86 61.63 60.45 126.02 60.78 60.54 126.55 62.17 60.38 123.58 63.00 59.91 122.80 61.78 59.61 124.84 60.41 58.96 124.66 3 0 17.03-999 ?-999 ?-999 ? CA CA A1121 mASP~E 87 61.56 61.54 123.33 60.87 61.82 124.00 63.34 62.91 122.29 64.05 63.06 121.29 61.95 62.30 122.14 60.90 63.38 121.86 2 0 17.54-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 88 63.70 63.25 123.52 62.96 63.13 124.18 66.08 62.69 123.64 67.18 62.99 123.18 65.01 63.75 123.89 65.01 64.09 125.38 2 0 14.01-999 ?-999 ?-999 ? CA CA A1121 mPHE~E 89 65.75 61.46 124.06 64.83 61.39 124.45 67.11 60.17 122.48 68.30 60.10 122.17 66.69 60.35 123.93 66.02 59.08 124.49 3 0 12.80-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 90 66.17 60.13 121.56 65.24 60.24 121.92 67.14 61.18 119.53 67.92 61.08 118.58 66.46 59.95 120.14 65.16 59.64 119.38 3 0 15.21-999 ?-999 ?-999 ? CA CA A1121 mALA~E 91 66.82 62.35 120.09 66.13 62.30 120.81 68.97 63.50 119.92 69.78 63.68 119.01 67.47 63.58 119.65 66.89 64.78 120.39 2 0 14.48-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 92 69.30 63.17 121.16 68.53 63.04 121.79 71.37 61.88 120.79 72.55 61.97 120.41 70.70 63.02 121.55 70.79 62.81 123.06 2 0 10.90-999 ?-999 ?-999 ? CA CA A1121 mGLN~E 93 70.62 60.81 120.54 69.69 60.84 120.92 71.45 60.15 118.35 72.47 59.82 117.74 71.15 59.69 119.77 70.16 58.52 119.75 2 0 12.56-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 94 70.55 60.95 117.78 69.72 61.14 118.31 72.09 62.33 116.47 73.02 62.21 115.67 70.83 61.47 116.43 69.64 62.28 115.94 3 0 11.56-999 ?-999 ?-999 ? CA CA E1125 mHIS~E 95 72.11 63.19 117.49 71.31 63.14 118.09 74.54 63.36 117.71 75.46 63.70 116.98 73.21 64.11 117.68 73.03 64.92 118.97 3 0 9.44-999 ?-999 ?-999 ? CA CA E1125 mALA~E 96 74.61 62.34 118.56 73.76 62.15 119.07 76.19 60.77 117.47 77.35 60.43 117.25 75.84 61.58 118.71 75.78 60.67 119.93 2 0 8.21-999 ?-999 ?-999 ? CA CA E1125 mALA~E 97 75.20 60.45 116.65 74.29 60.78 116.91 76.21 60.53 114.42 76.80 60.04 113.46 75.50 59.65 115.45 74.23 59.07 114.87 2 0 7.88-999 ?-999 ?-999 ? CA CA E1125 mMET~E 98 76.11 61.84 114.64 75.68 62.10 115.50 77.87 63.51 114.09 78.77 63.73 113.28 76.60 62.79 113.65 75.54 63.87 113.39 2 0 -5.29-999 ?-999 ?-999 ? CA CA E1125smLYS~E 99 77.90 63.96 115.34 77.18 63.62 115.94 80.06 64.27 116.56 80.93 64.94 117.13 78.95 64.90 115.75 78.29 66.06 116.50 2 0 -3.59-999 ?-999 ?-999 ? CA CA E1125smGLY~E 100 80.07 62.94 116.64 79.26 62.49 116.27 82.22 61.94 116.15 82.20 62.63 115.12 81.20 62.24 117.24-999.99-999.99-999.99 1 0 -4.15-999 ?-999 ?-999 ? CA CA E1125smLEU.E 101 83.09 60.95 116.33 83.01 60.48 117.21 83.41 59.80 114.21 82.90 58.70 114.42 84.08 60.61 115.31 85.26 59.83 115.87 3 0 4.58-999 ?-999 ?-999 ? CA CA E1125 mGLY.E 102 83.41 60.37 113.00 83.87 61.25 112.94 81.24 59.78 112.00 80.68 60.32 112.95 82.75 59.69 111.90-999.99-999.99-999.99 1 0 4.86-999 ?-999 ?-999 ? CA CA E1125 mTHR.E 103 80.56 59.22 111.01 81.13 58.79 110.31 78.55 57.83 111.19 78.89 56.93 110.42 79.10 59.24 110.99 78.61 59.81 109.65 2 0 6.13-999 ?-999 ?-999 ? CA CA E1125 mASP~E 104 77.75 57.68 112.24 77.67 58.51 112.78 75.75 56.36 111.74 74.66 56.63 112.24 77.03 56.45 112.56 76.68 56.45 114.05 2 0 9.05-999 ?-999 ?-999 ? CA CA E1125 mLYS~E 105 75.87 56.01 110.47 76.78 55.68 110.20 73.67 55.07 109.79 72.48 55.34 109.54 74.74 56.11 109.56 75.28 56.10 108.13 2 0 11.37-999 ?-999 ?-999 ? CA CA E1125 mASN~E 106 74.00 53.89 110.32 74.98 53.75 110.47 72.02 53.50 111.67 70.81 53.33 111.62 72.96 52.91 110.62 73.57 51.61 111.18 2 0 14.54-999 ?-999 ?-999 ? CA CA E1125 mALA~E 107 72.62 54.24 112.60 73.62 54.28 112.54 70.90 55.94 112.96 69.71 55.96 113.25 71.85 54.95 113.61 72.73 55.62 114.64 2 0 13.48-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 108 71.41 56.76 112.04 72.39 56.67 111.87 69.38 56.97 110.66 68.23 57.41 110.60 70.52 57.70 111.36 71.29 58.51 110.30 3 0 13.11-999 ?-999 ?-999 ? CA CA E1125 mILE~E 109 69.71 55.81 110.08 70.65 55.50 110.20 67.63 54.49 110.28 66.42 54.62 110.08 68.66 55.09 109.34 69.33 54.00 108.48 3 0 16.44-999 ?-999 ?-999 ? CA CA E1125 mASP~E 110 68.08 53.86 111.36 69.08 53.81 111.44 66.20 54.37 112.86 65.03 54.08 113.06 67.15 53.29 112.33 67.89 52.68 113.52 2 0 18.20-999 ?-999 ?-999 ? CA CA E1125 mILE~E 111 66.73 55.57 113.08 67.69 55.66 112.82 65.11 57.42 112.64 63.94 57.72 112.93 65.94 56.66 113.65 66.80 57.68 114.43 3 0 17.45-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 112 65.65 57.77 111.47 66.57 57.40 111.30 64.20 57.89 109.44 63.49 58.53 108.65 64.94 58.62 110.54 65.88 59.65 109.88 3 0 17.92-999 ?-999 ?-999 ? CA CA E1125 mCYH~E 113 64.34 56.56 109.29 64.92 56.09 109.95 62.38 55.16 108.60 61.74 54.49 107.78 63.62 55.94 108.17 64.59 55.04 107.40 2 0 20.59-999 ?-999 ?-999 ? CA CA E1125 mTHR.E 114 62.07 55.18 109.89 62.55 55.88 110.41 60.04 54.96 111.28 59.33 54.33 112.06 61.11 54.25 110.46 61.87 53.33 111.45 2 0 23.07-999 ?-999 ?-999 ? CA CA E1125 mGLN.E 115 59.99 56.28 111.15 60.61 56.66 110.46 57.85 57.48 111.17 57.84 57.41 109.94 59.09 57.08 111.96 59.81 58.34 112.46 2 0 23.75-999 ?-999 ?-999 ? CA CA E1125 mSER~E 116 56.82 57.89 111.90 56.97 57.78 112.88 55.79 59.96 111.21 56.67 60.48 111.91 55.60 58.45 111.33 54.45 58.21 112.33 2 0 26.83-999 ?-999 ?-999 ? CA CA E1125 mASN~E 117 54.96 60.64 110.43 54.29 60.07 109.96 55.15 62.79 111.65 56.15 63.39 112.03 55.07 62.10 110.30 53.85 62.61 109.53 2 0 26.93-999 ?-999 ?-999 ? CA CA E1125 mALA~E 118 54.11 62.62 112.47 53.37 62.06 112.10 55.30 62.74 114.61 55.89 63.50 115.38 54.11 63.23 113.79 52.81 62.92 114.53 2 0 27.62-999 ?-999 ?-999 ? CA CA E1125 mGLN~E 119 55.65 61.47 114.46 55.11 60.91 113.83 58.04 61.82 114.88 58.79 62.25 115.75 56.80 61.00 115.24 57.08 59.52 114.99 2 0 25.16-999 ?-999 ?-999 ? CA CA E1125 mILE~E 120 58.25 62.00 113.57 57.57 61.62 112.94 59.41 64.15 113.72 60.40 64.66 114.26 59.44 62.73 113.17 59.75 62.81 111.67 3 0 22.32-999 ?-999 ?-999 ? CA CA E1125 mHIS~E 121 58.24 64.77 113.58 57.51 64.23 113.17 58.44 66.28 115.50 59.21 67.15 115.91 58.09 66.15 114.04 56.69 66.69 113.73 3 0 23.72-999 ?-999 ?-999 ? CA CA E1125 mALA~E 122 57.94 65.38 116.34 57.30 64.72 115.93 59.85 65.28 117.93 60.46 65.94 118.78 58.35 65.39 117.75 57.63 64.25 118.47 2 0 22.94-999 ?-999 ?-999 ? CA CA A1121 mILE~E 123 60.51 64.41 117.17 59.96 63.89 116.52 62.67 65.58 116.94 63.61 66.04 117.59 61.96 64.28 117.33 62.54 63.15 116.46 3 0 20.11-999 ?-999 ?-999 ? CA CA E1125 mLYS~E 124 62.24 66.18 115.84 61.48 65.74 115.36 62.68 68.53 116.44 63.54 69.36 116.70 62.90 67.42 115.42 62.38 67.85 114.05 2 0 19.19-999 ?-999 ?-999 ? CA CA E1125 mALA~E 125 61.49 68.52 117.05 60.88 67.78 116.77 62.06 69.37 119.27 62.62 70.35 119.77 61.17 69.54 118.04 59.70 69.49 118.41 2 0 21.30-999 ?-999 ?-999 ? CA CA A1121 mALA~E 126 62.23 68.12 119.70 61.71 67.43 119.20 64.56 68.14 120.50 65.33 68.59 121.35 63.10 67.84 120.83 62.93 66.39 121.26 2 0 17.79-999 ?-999 ?-999 ? CA CA A1121 mPHE~E 127 64.99 67.91 119.26 64.31 67.55 118.63 66.70 69.70 119.07 67.74 70.10 119.59 66.39 68.21 118.93 66.71 67.76 117.51 3 0 16.54-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 128 65.80 70.53 118.56 65.04 70.06 118.13 66.02 72.45 120.07 66.91 73.18 120.48 65.92 71.99 118.62 64.69 72.60 117.93 2 0 18.34-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 129 65.07 71.95 120.85 64.40 71.41 120.35 66.34 71.85 122.97 66.73 72.55 123.91 65.00 72.14 122.28 63.94 71.18 122.85 3 0 17.29-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 130 67.01 70.79 122.53 66.60 70.35 121.73 69.48 71.03 122.66 70.44 71.25 123.40 68.23 70.32 123.17 68.43 68.83 122.89 3 0 13.64-999 ?-999 ?-999 ? CA CA A1121 mTYR~E 131 69.54 71.25 121.35 68.70 71.06 120.83 70.63 73.11 120.14 71.62 73.70 119.68 70.79 71.74 120.76 71.29 70.72 119.72 3 0 14.32-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 132 69.41 73.64 120.13 68.68 73.03 120.46 69.71 75.13 118.24 70.29 76.13 117.84 69.19 75.01 119.67 69.89 76.04 120.55 2 0 17.67-999 ?-999 ?-999 ? CA CA E1125 mGLU.E 133 69.58 74.04 117.50 69.13 73.29 117.99 69.02 73.13 115.33 68.15 72.48 115.92 70.04 73.93 116.13 71.42 73.26 116.03 2 0 15.45-999 ?-999 ?-999 ? CA CA E1125 mASP~E 134 69.13 73.19 114.01 69.87 73.78 113.67 68.80 71.08 112.83 69.92 70.97 112.35 68.20 72.45 113.17 67.85 73.23 111.91 2 0 15.87-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 135 68.03 70.06 113.17 67.17 70.33 113.61 68.78 68.46 111.47 69.77 67.80 111.18 68.41 68.67 112.94 67.25 67.74 113.32 3 0 14.08-999 ?-999 ?-999 ? CA CA E1125 mGLU~E 136 68.00 69.08 110.59 67.26 69.62 111.01 69.54 69.57 108.74 70.24 69.01 107.90 68.20 68.96 109.15 67.06 69.63 108.38 2 0 15.03-999 ?-999 ?-999 ? CA CA E1125 mLYS~E 137 69.86 70.72 109.33 69.18 71.05 109.98 72.30 70.60 109.52 73.35 70.52 108.88 71.11 71.42 109.04 71.14 72.78 109.72 2 0 13.65-999 ?-999 ?-999 ? CA CA E1125 mGLU~E 138 72.15 69.97 110.69 71.29 70.12 111.18 73.35 67.89 110.29 74.42 67.40 109.94 73.26 69.13 111.16 73.06 68.75 112.62 2 0 10.12-999 ?-999 ?-999 ? CA CA E1125 mILE~E 139 72.18 67.40 109.86 71.37 67.90 110.14 72.90 66.44 107.71 73.72 65.62 107.29 72.17 66.20 109.02 70.74 65.71 108.77 3 0 10.78-999 ?-999 ?-999 ? CA CA E1125 mILE~E 140 72.63 67.57 107.08 71.98 68.17 107.56 74.74 68.14 105.94 75.54 68.06 105.00 73.25 67.90 105.79 72.54 69.12 105.18 3 0 12.11-999 ?-999 ?-999 ? CA CA E1125 mSER~E 141 75.21 68.40 107.16 74.54 68.40 107.90 77.43 67.37 107.49 78.66 67.39 107.39 76.64 68.66 107.31 76.88 69.62 108.47 2 0 9.26-999 ?-999 ?-999 ? CA CA E1125 mGLU~E 142 76.75 66.26 107.79 75.76 66.35 107.79 77.22 63.92 107.07 77.78 62.82 107.20 77.48 65.02 108.08 77.11 64.56 109.49 2 0 7.01-999 ?-999 ?-999 ? CA CA E1125 mTHR~E 143 76.38 64.15 106.07 75.97 65.06 106.13 76.02 63.95 103.66 76.05 65.18 103.63 76.06 63.22 105.01 74.70 62.51 105.21 2 0 10.32-999 ?-999 ?-999 ? CA CA E1125 mSER~E 144 75.89 63.23 102.56 75.83 62.25 102.71 75.21 62.95 100.21 74.87 61.80 100.51 75.84 63.87 101.24 77.25 64.28 100.81 2 0 13.68-999 ?-999 ?-999 ? CA CA E1125 mGLY~E 145 75.02 63.43 98.98 75.28 64.39 98.89 73.08 62.14 98.08 72.25 62.76 98.74 74.49 62.67 97.88-999.99-999.99-999.99 1 0 17.35-999 ?-999 ?-999 ? CA CA E1125 mASN~E 146 72.80 60.98 97.48 73.57 60.58 96.99 71.09 59.98 98.97 69.90 59.96 99.29 71.49 60.37 97.56 71.44 59.12 96.67 2 0 15.49-999 ?-999 ?-999 ? CA CA E1135 mPHE~E 147 72.04 59.66 99.84 72.97 59.66 99.45 71.26 60.55 102.01 70.26 60.52 102.74 71.73 59.33 101.23 72.96 58.75 101.93 3 0 16.59-999 ?-999 ?-999 ? CA CA E1125 mGLN~E 148 71.98 61.67 101.91 72.83 61.58 101.39 70.08 63.24 102.14 69.29 63.60 103.01 71.51 62.90 102.53 72.43 64.07 102.10 2 0 15.10-999 ?-999 ?-999 ? CA CA E1125 mARG~E 149 69.75 63.17 100.86 70.50 62.83 100.29 67.33 62.64 100.81 66.17 63.08 100.90 68.46 63.52 100.29 68.48 63.44 98.76 2 0 18.79-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 150 67.64 61.37 101.08 68.58 61.09 100.87 66.31 60.96 103.08 65.17 60.98 103.52 66.62 60.49 101.66 67.09 59.03 101.74 3 0 18.84-999 ?-999 ?-999 ? CA CA E1135 mLEU~E 151 67.39 61.29 103.79 68.27 61.19 103.32 66.48 63.10 105.17 65.56 63.30 105.96 67.25 61.78 105.16 68.61 61.93 105.82 3 0 16.91-999 ?-999 ?-999 ? CA CA E1125 mVAL~E 152 66.79 63.97 104.22 67.54 63.71 103.60 64.56 64.99 103.93 63.72 65.62 104.57 66.04 65.23 104.15 66.61 66.13 103.04 3 0 18.33-999 ?-999 ?-999 ? CA CA E1125 mSER~E 153 64.22 64.11 102.99 65.00 63.75 102.49 62.16 63.15 103.95 61.01 63.45 104.24 62.85 63.71 102.71 62.82 62.64 101.61 2 0 21.73-999 ?-999 ?-999 ? CA CA B1122 mMET~E 154 62.86 62.29 104.69 63.76 62.08 104.32 62.04 62.82 106.95 61.11 62.69 107.74 62.33 61.73 105.92 63.33 60.74 106.55 2 0 20.98-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 155 62.89 63.85 106.99 63.58 63.84 106.27 61.64 65.85 107.74 61.23 66.63 108.60 62.79 64.90 108.00 64.09 65.69 108.09 3 0 19.75-999 ?-999 ?-999 ? CA CA E1125 mGLN~E 156 61.04 65.79 106.55 61.41 65.14 105.89 58.67 66.20 107.11 57.81 66.97 107.57 59.89 66.67 106.35 59.60 66.79 104.84 2 0 20.96-999 ?-999 ?-999 ? CA CA B1122 mGLY~E 157 58.53 64.88 107.29 59.28 64.29 106.98 56.14 64.67 106.93 55.07 65.14 107.28 57.28 64.42 107.91-999.99-999.99-999.99 1 0 24.52-999 ?-999 ?-999 ? CA CA B1122 mGLY.E 158 56.41 64.35 105.66 57.29 63.89 105.52 54.87 63.47 103.91 54.35 63.58 102.79 55.49 64.66 104.59-999.99-999.99-999.99 1 0 24.27-999 ?-999 ?-999 ? CA CA B1122 mARG.E 159 54.90 62.31 104.56 55.34 62.31 105.46 52.79 61.33 103.82 52.20 61.79 104.79 54.30 61.13 103.91 54.62 59.87 104.71 2 0 25.70-999 ?-999 ?-999 ? CA CA E1135 mLYS.E 160 52.18 61.02 102.68 52.77 60.72 101.93 50.09 59.93 103.31 49.73 58.95 102.67 50.72 61.13 102.60 50.22 61.23 101.17 2 0 27.12-999 ?-999 ?-999 ? CA CA E1135 mGLU.E 161 50.02 60.03 104.64 50.29 60.93 104.98 48.11 58.62 105.33 47.63 57.65 105.91 49.59 58.95 105.50 49.93 59.25 106.97 2 0 28.97-999 ?-999 ?-999 ? CA CA E1135 mASP.E 162 47.38 59.39 104.52 47.88 60.13 104.08 45.69 58.58 102.92 44.56 58.43 102.46 45.97 59.12 104.31 45.11 60.34 104.61 2 0 30.88-999 ?-999 ?-999 ? CA CA E1135 mGLU.E 163 46.76 58.25 102.21 47.64 58.39 102.67 46.03 56.31 100.95 46.61 55.47 101.65 46.60 57.72 100.86 47.96 57.73 100.18 2 0 28.06-999 ?-999 ?-999 ? CA CA E1135 mPRO.E 164 44.89 56.05 100.32 44.54 56.79 99.75 44.86 53.67 99.62 45.41 53.96 98.56 44.23 54.75 100.50 42.80 55.04 100.02 3 0 29.21-999 ?-999 ?-999 ? CA CA E1135 mVAL.E 165 44.72 52.42 100.03 44.29 52.29 100.92 44.39 51.34 97.85 43.16 51.28 97.85 45.18 51.34 99.15 45.06 49.96 99.81 3 0 27.39-999 ?-999 ?-999 ? CA CA E1135 mASN~E 166 45.13 51.40 96.75 46.11 51.44 96.93 45.47 50.65 94.46 46.58 51.10 94.16 44.56 51.43 95.40 44.40 52.87 94.92 2 0 26.40-999 ?-999 ?-999 ? CA CA E1135 mALA~E 167 45.01 49.48 94.05 44.07 49.29 94.35 46.26 49.19 91.94 47.40 49.03 91.50 45.79 48.56 93.24 44.99 47.29 92.98 2 0 24.56-999 ?-999 ?-999 ? CA CA E1135 mALA~E 168 45.36 49.91 91.29 44.46 49.96 91.72 46.84 51.56 90.26 47.88 51.51 89.61 45.71 50.57 90.03 44.49 51.30 89.47 2 0 23.88-999 ?-999 ?-999 ? CA CA E1135 mHIS~E 169 46.61 52.49 91.20 45.73 52.45 91.66 48.93 52.78 91.94 50.03 53.26 91.68 47.66 53.47 91.46 47.18 54.51 92.48 3 0 22.50-999 ?-999 ?-999 ? CA CA E1135 mALA~E 170 48.79 51.65 92.64 47.85 51.36 92.79 50.80 50.44 91.92 52.03 50.47 91.97 49.99 50.95 93.10 49.63 49.84 94.06 2 0 20.50-999 ?-999 ?-999 ? CA CA E1135 mALA~E 171 50.12 50.02 90.86 49.13 50.13 90.94 51.44 50.52 88.84 52.49 50.33 88.23 50.78 49.45 89.69 49.81 48.62 88.86 2 0 18.83-999 ?-999 ?-999 ? CA CA E1135 mGLU~E 172 50.79 51.69 88.79 49.89 51.72 89.23 52.80 53.05 88.79 53.84 53.15 88.15 51.45 52.81 88.11 50.57 54.05 88.17 2 0 18.11-999 ?-999 ?-999 ? CA CA E1135 mASP~E 173 52.78 53.09 90.12 51.86 52.95 90.50 54.95 52.16 90.87 56.15 52.40 90.91 53.95 53.30 90.94 53.53 53.55 92.39 2 0 16.35-999 ?-999 ?-999 ? CA CA E1135 mALA~E 174 54.47 50.92 90.76 53.47 50.86 90.74 56.18 49.81 89.38 57.37 49.51 89.35 55.38 49.79 90.68 54.60 48.48 90.79 2 0 14.60-999 ?-999 ?-999 ? CA CA E1135 mALA~E 175 55.51 50.18 88.29 54.54 50.34 88.47 57.13 51.46 86.96 58.21 51.35 86.38 56.11 50.33 86.98 55.04 50.60 85.93 2 0 13.17-999 ?-999 ?-999 ? CA CA E1135 mALA~E 176 56.77 52.58 87.60 55.86 52.57 88.01 59.04 53.27 88.23 60.13 53.58 87.73 57.70 53.70 87.64 57.08 54.82 88.47 2 0 12.20-999 ?-999 ?-999 ? CA CA E1135 mILE~E 177 58.95 52.54 89.33 58.02 52.33 89.62 60.91 51.04 89.26 62.14 51.03 89.25 60.14 52.09 90.05 59.75 51.54 91.43 3 0 10.11-999 ?-999 ?-999 ? CA CA E1135 mTYR~E 178 60.18 50.21 88.53 59.19 50.31 88.65 61.62 49.95 86.56 62.78 49.63 86.33 60.80 49.24 87.63 59.73 48.38 86.94 3 0 8.63-999 ?-999 ?-999 ? CA CA E1135 mGLN~E 179 60.98 50.90 85.88 60.05 51.09 86.21 62.82 52.38 85.22 63.80 52.49 84.49 61.61 51.58 84.75 60.62 52.48 84.01 2 0 7.92-999 ?-999 ?-999 ? CA CA E1135 mALA~E 180 62.73 52.89 86.44 61.88 52.67 86.91 64.97 52.85 87.51 66.06 53.39 87.75 63.79 53.69 87.05 63.22 54.45 88.25 2 0 6.60-999 ?-999 ?-999 ? CA CA E1135 mGLY~E 181 64.79 51.55 87.68 63.88 51.20 87.44 66.15 49.52 87.32 67.15 49.49 86.60 65.88 50.73 88.19-999.99-999.99-999.99 1 0 -4.00-999 ?-999 ?-999 ? CA CA E1135smGLU.E 182 65.29 48.51 87.39 64.50 48.65 87.98 65.52 47.54 85.11 66.40 47.05 84.39 65.53 47.30 86.61 64.51 46.22 86.97 2 0 4.70-999 ?-999 ?-999 ? CA CA E1135 mGLY.E 183 64.52 48.27 84.64 63.94 48.63 85.37 65.28 49.35 82.51 65.10 49.63 81.31 64.26 48.53 83.25-999.99-999.99-999.99 1 0 6.00-999 ?-999 ?-999 ? CA CA E1135 mGLN.E 184 66.37 49.79 83.16 66.45 49.55 84.13 68.76 50.25 82.79 69.00 49.56 83.79 67.34 50.57 82.39 67.04 52.07 82.47 2 0 -4.26-999 ?-999 ?-999 ? CA CA E1135smILE.E 185 69.72 50.73 82.00 69.38 51.23 81.21 71.55 51.33 83.52 72.18 50.81 84.44 71.14 50.53 82.29 72.04 50.94 81.11 3 0 -4.32-999 ?-999 ?-999 ? CA CA E1135smGLY.E 186 71.19 52.61 83.54 70.74 52.94 82.70 70.25 53.44 85.66 69.32 52.63 85.55 71.42 53.45 84.69-999.99-999.99-999.99 1 0 -4.24-999 ?-999 ?-999 ? CA CA E1135smTHR.E 187 70.27 54.36 86.62 71.03 55.01 86.58 68.61 55.77 87.81 69.32 56.78 87.75 69.25 54.40 87.65 69.88 54.02 89.01 2 0 4.54-999 ?-999 ?-999 ? CA CA E1135 mASP~E 188 67.32 55.81 88.07 66.82 54.97 87.88 66.44 56.82 90.10 65.36 56.39 90.51 66.70 57.03 88.61 65.40 57.40 87.92 2 0 7.77-999 ?-999 ?-999 ? CA CA E1135 mGLU~E 189 67.45 57.05 90.93 68.31 57.35 90.50 66.11 57.76 92.83 65.35 57.36 93.71 67.25 56.86 92.36 68.53 57.17 93.13 2 0 9.38-999 ?-999 ?-999 ? CA CA E1135 mSER~E 190 66.02 58.94 92.24 66.69 59.09 91.51 63.63 59.34 92.66 62.79 59.66 93.52 65.03 59.94 92.64 65.13 61.18 91.77 2 0 12.51-999 ?-999 ?-999 ? CA CA E1135 mARG~E 191 63.35 58.43 91.73 64.09 58.22 91.09 61.85 56.87 92.87 60.75 56.76 93.41 62.02 57.82 91.70 61.75 57.13 90.38 2 0 11.94-999 ?-999 ?-999 ? CA CA E1135 mPHE~E 192 62.93 56.20 93.28 63.75 56.34 92.72 62.55 56.22 95.69 61.77 55.88 96.58 62.85 55.35 94.47 64.15 54.59 94.69 3 0 11.73-999 ?-999 ?-999 ? CA CA E1135 mASN~E 193 63.22 57.37 95.72 63.83 57.51 94.94 61.63 58.83 96.90 61.00 58.77 97.94 63.06 58.31 96.82 64.03 59.49 96.66 2 0 14.81-999 ?-999 ?-999 ? CA CA E1135 mALA~E 194 61.15 59.35 95.78 61.79 59.35 95.01 58.77 58.89 96.26 57.94 59.19 97.12 59.79 59.88 95.71 59.43 60.20 94.26 2 0 16.62-999 ?-999 ?-999 ? CA CA E1135 mVAL~E 195 58.84 57.66 95.74 59.61 57.46 95.14 57.88 56.25 97.53 56.89 56.18 98.26 57.77 56.72 96.09 57.77 55.53 95.12 3 0 16.56-999 ?-999 ?-999 ? CA CA E1135 mLEU~E 196 59.09 55.92 97.96 59.83 56.08 97.31 59.08 56.38 100.40 58.92 55.99 101.57 59.27 55.36 99.29 60.66 54.72 99.41 3 0 17.32-999 ?-999 ?-999 ? CA CA E1135 mALA~E 197 59.11 57.66 100.07 59.21 57.85 99.09 57.59 59.23 101.25 57.19 59.76 102.29 59.00 58.67 101.12 59.97 59.81 100.83 2 0 20.06-999 ?-999 ?-999 ? CA CA E1135 mTHR~E 198 56.81 59.14 100.18 57.16 58.57 99.44 54.32 58.92 100.27 53.32 59.31 100.87 55.53 59.83 100.15 55.41 60.65 98.85 2 0 21.88-999 ?-999 ?-999 ? CA CA E1135 mARG~E 199 54.39 57.70 99.71 55.26 57.44 99.28 52.90 56.46 101.20 53.80 56.24 102.02 53.19 56.87 99.77 53.25 55.64 98.88 2 0 22.12-999 ?-999 ?-999 ? CA CA E1135 mSER~E 200 51.62 56.29 101.54 50.92 56.54 100.87 51.81 54.31 102.93 51.88 53.65 101.88 51.37 55.77 102.89 49.88 55.88 103.24 2 0 25.14-999 ?-999 ?-999 ? CA CA E1135 mTYR~E 201 52.10 53.81 104.11 52.05 54.49 104.85 51.49 51.45 103.70 51.93 50.57 102.95 52.47 52.42 104.34 52.58 52.13 105.84 3 0 24.86-999 ?-999 ?-999 ? CA CA E1135 mPRO~E 202 50.19 51.53 103.93 49.90 52.26 104.56 49.39 50.59 101.75 49.34 49.54 101.11 49.28 50.58 103.27 47.89 51.01 103.74 3 0 26.31-999 ?-999 ?-999 ? CA CA E1135 mGLN~E 203 49.54 51.74 101.11 49.59 52.57 101.67 50.98 51.17 99.17 51.06 50.57 98.09 49.63 51.70 99.64 49.36 53.09 99.07 2 0 23.87-999 ?-999 ?-999 ? CA CA E1135 mLEU~E 204 52.02 51.38 99.96 51.79 51.88 100.80 53.43 49.39 99.67 53.92 48.75 98.74 53.38 50.92 99.65 54.38 51.48 100.66 3 0 20.86-999 ?-999 ?-999 ? CA CA E1135 mHIS~E 205 52.89 48.83 100.75 52.63 49.47 101.47 52.02 46.87 99.58 52.51 45.98 98.90 52.70 47.38 100.84 51.85 47.05 102.07 3 0 22.30-999 ?-999 ?-999 ? CA CA E1135 mGLN~E 206 50.95 47.56 99.16 50.65 48.29 99.77 51.28 47.35 96.72 51.21 46.58 95.76 50.31 47.22 97.90 49.08 48.10 97.66 2 0 22.48-999 ?-999 ?-999 ? CA CA E1135 mILE~E 207 52.14 48.36 96.78 52.12 48.89 97.63 54.08 47.54 95.49 54.37 47.11 94.37 53.04 48.63 95.66 53.72 50.01 95.79 3 0 18.86-999 ?-999 ?-999 ? CA CA E1135 mPHE~E 208 54.66 47.05 96.58 54.33 47.44 97.44 55.10 44.74 95.88 55.77 43.92 95.27 55.69 46.02 96.47 56.26 45.70 97.85 3 0 17.53-999 ?-999 ?-999 ? CA CA E1135 mHIS~E 209 53.79 44.59 96.11 53.37 45.33 96.64 52.92 43.48 94.11 53.23 42.54 93.39 53.08 43.42 95.63 51.72 43.33 96.33 3 0 19.91-999 ?-999 ?-999 ? CA CA E1135 mGLU~E 210 52.45 44.63 93.64 52.20 45.30 94.35 53.68 44.81 91.54 53.77 44.45 90.36 52.31 44.88 92.21 51.70 46.26 91.96 2 0 18.74-999 ?-999 ?-999 ? CA CA E1135 mTYR~E 211 54.72 45.17 92.29 54.50 45.48 93.21 56.44 43.64 91.40 56.89 43.33 90.29 56.07 45.09 91.74 57.09 45.68 92.72 3 0 15.18-999 ?-999 ?-999 ? CA CA E1135 mSER~E 212 56.21 42.74 92.35 55.87 43.12 93.20 55.64 40.75 90.97 56.07 39.76 90.37 56.45 41.31 92.13 56.12 40.52 93.40 2 0 16.66-999 ?-999 ?-999 ? CA CA E1135 mLYS~E 213 54.53 41.39 90.60 54.28 42.15 91.19 54.44 41.37 88.12 54.14 40.77 87.08 53.76 40.98 89.43 52.36 41.60 89.43 2 0 18.28-999 ?-999 ?-999 ? CA CA E1135 mILE~E 214 55.28 42.40 88.12 55.44 42.83 89.01 57.38 42.51 86.79 58.00 42.66 85.74 55.89 42.83 86.86 55.66 44.32 86.57 3 0 15.24-999 ?-999 ?-999 ? CA CA E1135 mSER~E 215 57.97 42.01 87.87 57.39 41.88 88.68 59.69 40.32 88.40 58.85 39.78 89.13 59.41 41.70 87.81 60.20 42.79 88.53 2 0 13.06-999 ?-999 ?-999 ? CA CA E1135 mASN.E 216 60.85 39.75 88.08 61.41 40.29 87.45 61.98 38.61 89.93 62.13 37.66 90.69 61.25 38.46 88.61 62.12 37.66 87.64 2 0 14.36-999 ?-999 ?-999 ? CA CA E1135 mLYS.E 217 62.40 39.85 90.21 62.29 40.52 89.48 61.91 40.71 92.43 60.92 41.27 91.95 62.98 40.13 91.52 64.12 41.14 91.40 2 0 12.96-999 ?-999 ?-999 ? CA CA E1135 mTHR~E 218 62.10 40.62 93.75 62.86 40.04 94.05 61.65 42.84 94.67 62.68 43.20 94.09 61.21 41.37 94.63 61.21 40.82 96.06 2 0 14.60-999 ?-999 ?-999 ? CA CA E1135 mILE~E 219 60.93 43.71 95.36 60.08 43.35 95.75 62.72 45.07 96.30 63.61 45.89 96.06 61.41 45.08 95.52 60.38 45.97 96.25 3 0 13.22-999 ?-999 ?-999 ? CA CA E1135 mLEU~E 220 62.78 44.13 97.23 61.97 43.55 97.26 65.17 43.64 97.30 66.25 44.16 97.57 63.92 43.94 98.12 63.63 42.79 99.07 3 0 14.48-999 ?-999 ?-999 ? CA CA E1135 mGLN~E 221 65.00 42.78 96.31 64.05 42.50 96.17 66.58 43.40 94.54 67.78 43.63 94.37 66.11 42.32 95.50 65.73 41.07 94.70 2 0 12.57-999 ?-999 ?-999 ? CA CA E1135 mALA~E 222 65.60 44.04 93.90 64.67 43.74 94.12 66.74 46.19 93.65 67.88 46.52 93.32 65.93 45.11 92.95 64.67 45.65 92.32 2 0 9.07-999 ?-999 ?-999 ? CA CA E1135 mILE~E 223 66.18 46.69 94.74 65.26 46.35 94.93 68.25 47.19 96.00 69.23 47.94 95.91 66.88 47.68 95.57 65.99 48.08 96.75 3 0 10.01-999 ?-999 ?-999 ? CA CA E1135 mGLU~E 224 68.37 45.92 96.37 67.51 45.41 96.39 70.61 45.41 95.51 71.80 45.72 95.60 69.67 45.34 96.72 69.55 43.87 97.11 2 0 11.60-999 ?-999 ?-999 ? CA CA E1135 mASN~E 225 70.03 45.06 94.36 69.05 44.88 94.45 71.04 46.32 92.49 72.03 46.50 91.77 70.77 44.97 93.11 69.97 44.08 92.15 2 0 8.79-999 ?-999 ?-999 ? CA CA E1135 mGLU~E 226 70.17 47.30 92.72 69.43 47.08 93.35 71.28 49.54 92.79 71.92 50.37 92.13 70.34 48.59 92.08 68.97 49.24 91.86 2 0 -6.21-999 ?-999 ?-999 ? CA CA E1135smPHE~E 227 71.41 49.48 94.11 70.88 48.75 94.55 73.37 49.80 95.66 73.50 48.58 95.77 72.26 50.42 94.84 71.38 51.24 95.82 3 0 9.19-999 ?-999 ?-999 ? CA CA E1135 mSER~E 228 74.13 50.68 96.31 73.95 51.63 96.07 75.12 51.20 98.50 74.61 52.32 98.44 75.14 50.28 97.28 76.53 50.26 96.65 2 0 12.59-999 ?-999 ?-999 ? CA CA E1135 mGLY~E 229 75.66 50.71 99.60 75.94 49.75 99.49 74.61 52.04 101.44 73.49 51.57 101.26 75.85 51.40 100.84-999.99-999.99-999.99 1 0 16.15-999 ?-999 ?-999 ? CA CA E1135 mASP~E 230 74.84 53.11 102.20 75.80 53.39 102.17 72.53 54.00 102.24 71.46 53.75 102.79 73.84 53.81 102.98 74.41 55.18 103.41 2 0 16.76-999 ?-999 ?-999 ? CA CA E1125 mILE~E 231 72.59 54.47 100.99 73.51 54.62 100.62 70.60 53.40 100.11 69.38 53.31 100.26 71.34 54.72 100.29 71.53 55.43 98.94 3 0 15.01-999 ?-999 ?-999 ? CA CA E1135 mLYS~E 232 71.36 52.33 99.85 72.34 52.48 99.72 70.01 50.72 101.09 68.82 50.43 101.21 70.67 51.03 99.76 71.71 49.95 99.40 2 0 13.71-999 ?-999 ?-999 ? CA CA E1135 mASN~E 233 70.79 50.81 102.17 71.72 51.15 101.99 69.08 51.26 103.89 68.15 50.74 104.50 70.30 50.45 103.49 71.41 50.62 104.53 2 0 17.37-999 ?-999 ?-999 ? CA CA E1135 mGLY~E 234 69.09 52.56 103.61 69.89 52.90 103.11 66.68 53.01 103.32 65.65 52.87 103.97 67.97 53.39 104.02-999.99-999.99-999.99 1 0 18.21-999 ?-999 ?-999 ? CA CA E1135 mLEU~E 235 66.71 52.84 102.00 67.60 53.00 101.58 65.03 51.08 101.71 63.83 50.87 101.88 65.51 52.46 101.26 65.75 52.46 99.75 3 0 15.74-999 ?-999 ?-999 ? CA CA E1135 mLEU~E 236 65.96 50.15 101.92 66.90 50.44 101.74 64.90 48.92 103.75 63.83 48.36 103.98 65.57 48.81 102.39 66.78 47.88 102.47 3 0 16.70-999 ?-999 ?-999 ? CA CA E1135 mALA~E 237 65.50 49.71 104.64 66.34 50.14 104.31 63.51 50.36 105.96 62.73 50.01 106.84 64.97 49.91 105.99 65.82 50.93 106.72 2 0 20.29-999 ?-999 ?-999 ? CA CA E1135 mILE~E 238 63.17 51.14 104.94 63.94 51.36 104.33 60.90 50.48 104.29 59.79 50.30 104.79 61.81 51.61 104.74 61.79 52.72 103.66 3 0 20.08-999 ?-999 ?-999 ? CA CA E1135 mVAL~E 239 61.37 49.70 103.31 62.27 49.93 102.93 60.28 47.63 104.03 59.16 47.18 104.26 60.52 48.59 102.88 61.10 47.82 101.68 3 0 18.93-999 ?-999 ?-999 ? CA CA E1135 mLYS~E 240 61.34 47.35 104.80 62.20 47.79 104.54 60.25 47.02 107.00 59.38 46.31 107.50 61.17 46.45 105.94 62.51 46.07 106.56 2 0 21.69-999 ?-999 ?-999 ? CA CA E1135 mSER~E 241 60.40 48.28 107.38 61.16 48.77 106.95 58.04 48.76 107.93 57.13 48.63 108.75 59.49 48.86 108.37 59.82 50.34 108.62 2 0 24.30-999 ?-999 ?-999 ? CA CA E1135 mVAL~E 242 57.80 48.86 106.63 58.61 48.96 106.05 55.83 47.42 106.29 54.70 47.29 106.76 56.43 48.82 106.13 56.38 49.22 104.64 3 0 23.78-999 ?-999 ?-999 ? CA CA E1135 mGLU~E 243 56.58 46.42 105.84 57.48 46.69 105.50 56.04 44.51 107.28 55.03 43.90 107.64 56.10 45.04 105.86 56.96 44.14 104.97 2 0 24.23-999 ?-999 ?-999 ? CA CA E1135 mASN~E 244 57.07 44.76 108.09 57.83 45.24 107.65 58.09 45.11 110.32 59.26 44.70 110.40 57.06 44.35 109.49 57.27 42.84 109.63 2 0 26.96-999 ?-999 ?-999 ? CA CA E1135 mARG~E 245 57.66 46.18 110.99 56.71 46.40 110.81 59.14 46.03 112.96 60.31 46.16 113.32 58.53 46.94 111.89 57.71 48.04 112.57 2 0 28.07-999 ?-999 ?-999 ? CA CA E1135 mPHE~E 246 58.34 45.12 113.48 57.40 45.14 113.13 60.01 43.38 113.95 61.02 43.22 114.63 58.82 44.17 114.48 57.68 43.24 114.91 3 0 30.39-999 ?-999 ?-999 ? CA CA E1125 mALA~E 247 59.88 42.93 112.70 59.01 43.13 112.25 62.24 43.09 112.03 63.32 42.66 112.46 60.99 42.21 112.09 60.66 41.74 110.69 2 0 28.35-999 ?-999 ?-999 ? CA CA E1135 mTYR~E 248 62.05 44.28 111.48 61.11 44.47 111.19 63.88 45.39 112.65 65.06 45.08 112.76 63.16 45.21 111.32 62.72 46.56 110.75 3 0 26.36-999 ?-999 ?-999 ? CA CA E1135 mPHE~E 249 63.17 45.81 113.70 62.20 45.99 113.52 64.46 44.68 115.47 65.54 44.66 116.08 63.82 45.98 114.99 62.80 46.44 116.04 3 0 25.53-999 ?-999 ?-999 ? CA CA E1125 mALA~E 250 63.74 43.58 115.27 62.88 43.74 114.78 65.59 42.00 115.19 66.50 41.54 115.88 64.19 42.27 115.73 63.19 41.22 115.29 2 0 28.10-999 ?-999 ?-999 ? CA CA E1125 mGLU~E 251 65.74 42.37 113.92 64.93 42.81 113.54 68.13 42.96 113.73 69.20 42.43 114.03 66.96 42.16 113.16 66.75 42.57 111.70 2 0 26.47-999 ?-999 ?-999 ? CA CA E1125 mARG~E 252 67.94 44.27 113.86 67.03 44.59 113.59 69.44 44.69 115.77 70.61 44.76 116.15 69.00 45.13 114.38 68.53 46.58 114.37 2 0 22.88-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 253 68.48 44.15 116.53 67.55 44.16 116.16 69.86 42.46 117.63 70.96 42.45 118.18 68.87 43.60 117.83 67.63 43.13 118.59 3 0 24.59-999 ?-999 ?-999 ? CA CA E1125 mHIS~E 254 69.44 41.51 116.80 68.52 41.64 116.43 71.66 40.81 116.00 72.69 40.44 116.57 70.29 40.36 116.48 69.59 39.47 115.46 3 0 26.53-999 ?-999 ?-999 ? CA CA E1125 mHIS~E 255 71.71 41.65 114.96 70.83 41.88 114.57 73.80 42.83 115.59 75.01 42.63 115.73 72.99 42.17 114.48 72.80 43.15 113.33 3 0 23.65-999 ?-999 ?-999 ? CA CA E1125 mALA~E 256 73.14 43.64 116.42 72.16 43.73 116.24 74.56 43.33 118.40 75.71 43.52 118.81 73.86 44.32 117.49 72.91 45.19 118.30 2 0 21.67-999 ?-999 ?-999 ? CA CA E1125 mMET~E 257 73.86 42.25 118.75 72.94 42.21 118.36 75.22 40.21 118.85 75.81 39.30 119.43 74.43 41.25 119.64 73.34 40.54 120.44 2 0 24.42-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 258 75.19 40.35 117.52 74.62 41.09 117.16 77.44 39.88 116.72 77.75 41.04 117.03 75.98 39.43 116.71 75.45 39.30 115.29 2 0 25.55-999 ?-999 ?-999 ? CA CA E1125 mGLY.E 259 78.32 38.94 116.40 77.90 38.08 116.10 80.27 38.77 117.87 79.50 38.71 118.84 79.76 39.13 116.48-999.99-999.99-999.99 1 0 25.25-999 ?-999 ?-999 ? CA CA E1125 mLEU.E 260 81.57 38.50 118.00 82.10 38.54 117.15 82.34 39.43 120.17 83.34 39.53 120.90 82.16 38.17 119.29 83.52 37.48 119.10 3 0 26.59-999 ?-999 ?-999 ? CA CA E1125 mGLY.E 261 81.33 40.30 120.04 80.59 39.93 119.48 79.93 42.28 120.25 79.34 41.93 119.23 81.25 41.62 120.62-999.99-999.99-999.99 1 0 23.59-999 ?-999 ?-999 ? CA CA E1125 mTHR.E 262 79.47 43.22 121.08 80.10 43.52 121.79 78.06 45.22 120.53 78.69 46.07 121.16 78.13 43.75 120.91 77.34 43.57 122.24 2 0 21.41-999 ?-999 ?-999 ? CA CA A1121 mSER~E 263 77.21 45.54 119.54 76.82 44.77 119.02 76.04 47.45 120.45 74.81 47.42 120.39 76.91 46.95 119.30 76.24 47.19 117.96 2 0 18.74-999 ?-999 ?-999 ? CA CA E1125 mASP~E 264 76.72 47.83 121.52 77.71 47.84 121.41 75.20 49.45 122.56 74.07 49.51 123.05 76.04 48.20 122.76 77.03 48.30 123.91 2 0 16.67-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 265 75.70 50.38 121.75 76.62 50.18 121.41 73.57 51.24 120.82 72.55 51.72 121.29 74.94 51.58 121.40 75.72 52.44 120.40 2 0 14.64-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 266 73.55 50.45 119.76 74.46 50.17 119.45 71.41 49.24 120.05 70.19 49.37 119.93 72.32 50.02 119.11 72.61 49.15 117.87 2 0 17.83-999 ?-999 ?-999 ? CA CA E1125 mLEU~E 267 71.97 48.44 120.95 72.97 48.48 120.95 70.37 48.43 122.81 69.15 48.33 122.94 71.17 47.59 121.83 72.10 46.62 122.58 3 0 18.70-999 ?-999 ?-999 ? CA CA A1121 mILE~E 268 71.08 49.30 123.53 72.06 49.25 123.38 69.36 51.06 123.77 68.29 51.31 124.32 70.43 50.22 124.46 71.49 51.13 125.09 3 0 15.79-999 ?-999 ?-999 ? CA CA A1121 mARG~E 269 69.64 51.50 122.54 70.49 51.15 122.16 67.40 51.78 121.55 66.36 52.42 121.70 68.75 52.41 121.84 69.34 52.90 120.51 2 0 16.12-999 ?-999 ?-999 ? CA CA A1121 mILE~E 270 67.45 50.53 121.06 68.36 50.13 120.97 65.49 49.40 121.95 64.27 49.56 122.10 66.20 49.87 120.69 66.46 48.71 119.72 3 0 19.82-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 271 66.24 48.86 122.91 67.22 48.83 122.74 64.87 49.52 124.83 63.69 49.41 125.16 65.58 48.37 124.12 66.57 47.70 125.07 3 0 19.94-999 ?-999 ?-999 ? CA CA A1121 mVAL~E 272 65.58 50.63 125.02 66.51 50.61 124.64 63.90 52.46 124.98 62.84 52.77 125.52 65.01 51.76 125.74 66.10 52.82 126.04 3 0 17.51-999 ?-999 ?-999 ? CA CA A1121 mSER~E 273 64.15 52.77 123.71 64.99 52.39 123.34 61.96 52.87 122.56 60.95 53.50 122.24 63.23 53.61 122.95 63.95 54.19 121.73 2 0 18.64-999 ?-999 ?-999 ? CA CA A1121 mARG~E 274 61.95 51.54 122.62 62.81 51.12 122.91 60.05 50.24 123.51 58.96 49.68 123.39 60.74 50.81 122.27 61.06 49.68 121.30 2 0 22.29-999 ?-999 ?-999 ? CA CA A1121 mSER~E 275 60.71 50.37 124.65 61.54 50.92 124.54 58.87 50.08 126.30 58.22 49.29 126.99 60.31 49.80 125.93 61.26 50.25 127.04 2 0 22.23-999 ?-999 ?-999 ? CA CA A1121 mGLU.E 276 58.30 51.21 125.88 58.87 51.82 125.33 56.03 51.57 125.00 54.94 52.13 125.05 56.91 51.46 126.24 56.77 52.71 127.13 2 0 24.07-999 ?-999 ?-999 ? CA CA A1121 mILE.E 277 56.49 50.99 123.90 57.39 50.55 123.98 55.36 49.63 122.17 54.18 49.26 122.15 55.68 51.02 122.69 56.35 51.89 121.61 3 0 26.11-999 ?-999 ?-999 ? CA CA A1121 mASP~E 278 56.36 48.85 121.76 57.26 49.25 121.91 57.26 46.55 121.43 57.47 45.67 120.60 56.14 47.55 121.15 56.02 47.71 119.62 2 0 27.98-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 279 57.99 46.66 122.53 57.72 47.40 123.15 58.61 44.33 123.10 59.33 43.35 122.90 59.10 45.74 122.76 60.06 46.22 123.85 3 0 26.42-999 ?-999 ?-999 ? CA CA A1121 mALA~E 280 57.39 44.21 123.62 56.90 45.07 123.81 56.74 42.15 122.53 57.32 41.08 122.32 56.88 42.86 123.87 55.56 42.94 124.61 2 0 29.64-999 ?-999 ?-999 ? CA CA A1121 mASN~E 281 56.04 42.80 121.61 55.66 43.67 121.93 57.15 41.99 119.55 57.33 40.95 118.92 55.83 42.31 120.25 55.03 43.32 119.43 2 0 31.68-999 ?-999 ?-999 ? CA CA A1121 mILE~E 282 58.10 42.91 119.70 57.84 43.73 120.20 60.01 41.38 119.75 60.63 40.58 119.04 59.43 42.66 119.14 60.37 43.85 119.41 3 0 29.46-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 283 59.80 41.20 121.04 59.31 41.96 121.48 59.60 38.76 121.15 60.26 37.75 120.91 60.24 40.01 121.76 59.85 40.09 123.24 2 0 30.09-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 284 58.28 38.83 120.96 57.88 39.71 121.23 58.03 37.38 119.01 58.08 36.22 118.62 57.51 37.74 120.40 56.03 38.14 120.30 2 0 33.79-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 285 58.39 38.42 118.27 58.32 39.32 118.71 60.26 37.67 116.83 60.57 36.80 116.01 58.84 38.21 116.90 58.69 39.52 116.10 2 0 33.84-999 ?-999 ?-999 ? CA CA A1121 mPHE~E 286 61.15 38.15 117.68 60.77 38.82 118.32 62.65 36.23 117.82 63.20 35.54 116.97 62.56 37.75 117.69 63.26 38.43 118.86 3 0 31.98-999 ?-999 ?-999 ? CA CA A1121 mGLN~E 287 62.04 35.74 118.90 61.62 36.45 119.47 61.56 33.52 118.00 62.09 32.45 117.71 62.00 34.32 119.22 61.08 34.11 120.42 2 0 34.51-999 ?-999 ?-999 ? CA CA A1121 mALA~E 288 60.61 34.08 117.27 60.26 34.94 117.64 61.21 33.37 114.99 61.41 32.32 114.38 60.11 33.48 116.04 58.95 34.32 115.49 2 0 35.40-999 ?-999 ?-999 ? CA CA E1135 mMET~E 289 61.92 34.47 114.76 61.69 35.25 115.34 64.21 33.76 114.17 65.00 33.38 113.31 62.95 34.51 113.74 63.33 35.96 113.42 2 0 32.32-999 ?-999 ?-999 ? CA CA E1135 mTYR~E 290 64.42 33.61 115.47 63.65 33.86 116.07 65.62 31.93 116.90 66.63 31.34 117.30 65.71 33.10 115.94 66.49 34.25 116.59 3 0 34.48-999 ?-999 ?-999 ? CA CA E1135 mGLY~E 291 64.40 31.59 117.31 63.68 32.18 116.95 64.51 30.73 119.63 63.79 30.36 120.56 64.15 30.46 118.19-999.99-999.99-999.99 1 0 37.26-999 ?-999 ?-999 ? CA CA A1121 mLYS.E 292 65.64 31.39 119.85 66.13 31.60 119.00 65.32 32.99 121.66 64.87 33.81 120.84 66.10 31.78 121.18 67.58 32.13 121.07 2 0 34.55-999 ?-999 ?-999 ? CA CA A1121 mSER~E 293 65.06 33.14 122.96 65.41 32.43 123.57 65.20 35.53 123.46 66.40 35.37 123.71 64.28 34.32 123.34 63.47 34.09 124.61 2 0 32.45-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 294 64.64 36.72 123.24 63.65 36.71 123.09 66.24 38.03 124.54 67.45 38.25 124.56 65.48 37.91 123.23 64.64 39.16 122.93 3 0 28.81-999 ?-999 ?-999 ? CA CA A1121 mTYR~E 295 65.54 37.81 125.65 64.56 37.63 125.49 67.40 36.96 127.04 68.47 37.39 127.48 66.17 37.85 126.96 65.14 37.46 128.00 3 0 27.93-999 ?-999 ?-999 ? CA CA A1121 mGLU~E 296 67.27 35.69 126.65 66.37 35.42 126.31 69.59 35.35 125.95 70.73 35.33 126.40 68.42 34.79 126.76 68.11 33.37 126.31 2 0 29.98-999 ?-999 ?-999 ? CA CA A1121 mPHE~E 297 69.30 35.86 124.75 68.33 35.81 124.51 71.07 37.56 124.62 72.29 37.72 124.55 70.35 36.43 123.91 69.76 36.94 122.59 3 0 28.35-999 ?-999 ?-999 ? CA CA A1121 mILE~E 298 70.31 38.38 125.33 69.32 38.19 125.32 71.68 38.92 127.29 72.82 39.28 127.57 70.94 39.47 126.07 69.94 40.56 126.50 3 0 24.91-999 ?-999 ?-999 ? CA CA A1121 mALA~E 299 71.03 38.00 128.01 70.11 37.77 127.68 73.00 36.77 128.81 73.94 36.70 129.60 71.67 37.40 129.18 70.76 36.36 129.81 2 0 26.44-999 ?-999 ?-999 ? CA CA A1121 mASP~E 300 73.07 36.28 127.57 72.26 36.42 127.01 75.33 36.59 126.61 76.52 36.26 126.68 74.28 35.61 127.12 73.93 34.59 126.04 2 0 27.88-999 ?-999 ?-999 ? CA CA A1121 mASP~E 301 74.92 37.75 126.11 73.94 37.94 126.23 76.32 39.84 126.24 77.30 40.49 125.82 75.84 38.66 125.43 75.25 39.17 124.11 2 0 24.97-999 ?-999 ?-999 ? CA CA A1121 mCYH~E 302 75.73 40.19 127.37 74.91 39.69 127.62 76.65 40.82 129.54 76.25 39.73 129.95 76.35 41.29 128.13 75.44 42.53 128.16 2 0 21.97-999 ?-999 ?-999 ? CA CA A1121 mSER~E 303 77.32 41.62 130.37 77.65 42.49 129.99 77.32 42.28 132.76 77.16 43.44 132.39 77.50 41.16 131.74 78.89 40.53 131.91 2 0 22.06-999 ?-999 ?-999 ? CA CA A1121 mGLY~E 304 77.38 41.92 134.03 77.45 40.93 134.14 76.04 43.57 135.29 75.01 43.10 134.79 77.35 42.81 135.16-999.99-999.99-999.99 1 0 20.99-999 ?-999 ?-999 ? CA CA A1121 mASP~E 305 76.09 44.73 135.93 77.01 44.96 136.26 74.26 45.97 134.83 73.03 46.00 134.74 74.94 45.60 136.14 75.38 46.86 136.90 2 0 18.79-999 ?-999 ?-999 ? CA CA A1121 mTYR~E 306 75.08 46.17 133.81 76.05 46.11 134.04 73.58 45.36 132.04 72.39 45.65 131.85 74.57 46.44 132.46 75.74 46.53 131.49 3 0 17.17-999 ?-999 ?-999 ? CA CA A1121 mLYS~E 307 74.04 44.12 131.95 75.02 44.04 132.12 71.90 42.97 132.48 70.77 42.94 131.98 73.17 42.98 131.65 73.97 41.69 131.86 2 0 20.72-999 ?-999 ?-999 ? CA CA A1121 mASP~E 308 72.03 43.05 133.80 72.98 43.11 134.10 69.93 44.18 134.40 68.71 44.00 134.42 70.89 43.05 134.71 71.38 43.09 136.15 2 0 21.72-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 309 70.45 45.37 134.07 71.45 45.44 134.08 68.74 46.07 132.48 67.51 46.10 132.45 69.52 46.44 133.73 70.27 47.76 133.52 3 0 18.95-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 310 69.46 45.73 131.41 70.45 45.72 131.55 67.78 44.28 130.35 66.65 44.29 129.87 68.80 45.40 130.14 69.82 44.95 129.10 3 0 19.83-999 ?-999 ?-999 ? CA CA A1121 mLEU~E 311 68.20 43.29 131.15 69.12 43.39 131.54 66.01 42.56 132.04 64.94 42.15 131.59 67.32 42.15 131.39 68.07 41.10 132.23 3 0 23.44-999 ?-999 ?-999 ? CA CA A1121 mGLN~E 312 66.08 43.37 133.09 67.01 43.63 133.34 63.99 44.65 132.90 62.76 44.58 132.93 64.89 43.81 133.80 65.29 44.59 135.06 2 0 23.47-999 ?-999 ?-999 ? CA CA A1121 mILE~E 313 64.59 45.48 132.04 65.59 45.49 132.03 63.00 45.39 130.17 61.90 45.68 129.72 63.71 46.28 131.18 64.52 47.33 130.40 3 0 21.90-999 ?-999 ?-999 ? CA CA A1121 mTHR~E 314 63.74 44.38 129.71 64.61 44.23 130.18 62.19 42.59 129.04 61.19 42.38 128.35 63.25 43.58 128.59 64.41 42.81 127.92 2 0 24.32-999 ?-999 ?-999 ? CA CA A1121 mGLY~E 315 62.44 41.96 130.19 63.28 42.25 130.65 61.78 39.60 130.07 62.44 39.48 129.03 61.54 40.94 130.72-999.99-999.99-999.99 1 0 27.43-999 ?-999 ?-999 ? CA CA A1121 mHIS.E 316 61.28 38.54 130.70 60.81 38.73 131.56 60.58 37.06 128.86 61.12 36.55 127.85 61.44 37.21 130.11 61.10 36.13 131.13 3 0 30.58-999 ?-999 ?-999 ? CA CA A1121 mVAL.F 2 42.58 90.04 155.82 42.40 90.06 156.81 44.27 90.39 154.07 44.85 91.27 154.70 42.83 90.00 154.39 41.90 90.97 153.63 3 0 36.02-999 ?-999 ?-999 ? CA CA C1123 mVAL.F 3 44.84 89.72 153.07 44.27 89.03 152.63 46.24 90.84 151.40 45.62 90.50 150.40 46.22 90.03 152.69 47.08 88.75 152.60 3 0 32.41-999 ?-999 ?-999 ? CA CA C1123 mGLN.F 4 46.93 91.99 151.40 47.42 92.21 152.25 48.02 93.83 150.12 48.70 94.09 151.11 46.90 92.80 150.18 45.54 93.53 150.13 2 0 29.76-999 ?-999 ?-999 ? CA CA C1123 mGLY.F 5 48.17 94.46 148.96 47.55 94.17 148.24 48.70 96.88 149.10 47.59 97.09 149.61 49.18 95.49 148.77-999.99-999.99-999.99 1 0 26.65-999 ?-999 ?-999 ? CA CA C1123 mTHR.F 6 49.54 97.88 148.81 50.41 97.60 148.40 48.98 100.09 147.83 48.69 101.29 147.88 49.18 99.26 149.09 50.28 99.91 149.96 2 0 26.59-999 ?-999 ?-999 ? CA CA C1123 mVAL.F 7 49.20 99.50 146.66 49.46 98.54 146.71 47.82 99.71 144.69 47.72 98.49 144.52 49.04 100.26 145.42 50.27 100.12 144.49 3 0 24.77-999 ?-999 ?-999 ? CA CA C1123 mLYS.F 8 46.90 100.60 144.34 47.10 101.54 144.60 45.63 100.89 142.27 46.06 102.04 142.12 45.72 100.17 143.61 44.44 100.44 144.41 2 0 27.01-999 ?-999 ?-999 ? CA CA C1123 mPRO.F 9 44.95 100.28 141.32 44.60 99.38 141.58 44.06 102.25 140.15 43.11 102.38 140.92 44.76 100.90 140.01 43.82 99.94 139.28 3 0 26.85-999 ?-999 ?-999 ? CA CA C1123 mHIS.F 10 44.53 103.23 139.40 45.31 102.99 138.83 42.52 104.53 138.81 42.29 103.90 137.78 43.91 104.55 139.44 44.79 105.56 138.70 3 0 28.02-999 ?-999 ?-999 ? CA CA C1123 mALA.F 11 41.59 105.27 139.40 41.89 105.69 140.26 40.33 106.26 137.54 41.26 107.06 137.39 40.26 105.42 138.81 39.35 106.09 139.84 2 0 31.58-999 ?-999 ?-999 ? CA CA C1123 mSER.F 12 39.35 106.11 136.68 38.68 105.44 136.99 40.58 106.89 134.68 41.08 107.96 134.36 39.23 106.81 135.41 38.66 108.21 135.59 2 0 32.51-999 ?-999 ?-999 ? CA CA C1123 mPHE.F 13 41.15 105.71 134.45 40.60 104.94 134.77 42.41 105.96 132.34 41.56 105.60 131.54 42.42 105.52 133.79 42.86 104.04 133.83 3 0 29.06-999 ?-999 ?-999 ? CA CA C1123 mASN~F 14 43.43 106.73 131.97 44.02 107.02 132.72 45.16 107.07 130.33 45.88 107.93 130.83 43.65 107.10 130.58 43.07 108.47 130.27 2 0 28.43-999 ?-999 ?-999 ? CA CA C1123 mSER~F 15 45.63 106.01 129.68 44.94 105.40 129.29 47.66 106.84 128.57 48.84 107.18 128.63 47.09 105.85 129.58 47.43 104.42 129.21 2 0 24.94-999 ?-999 ?-999 ? CA CA C1123 mARG~F 16 46.85 107.30 127.62 45.92 106.94 127.61 47.63 109.61 127.38 48.60 110.31 127.11 47.39 108.28 126.67 46.46 108.48 125.48 2 0 24.93-999 ?-999 ?-999 ? CA CA D1134 mGLU~F 17 46.79 109.93 128.35 46.11 109.23 128.57 48.07 111.19 129.99 48.82 112.15 130.15 46.89 111.22 129.03 45.62 111.59 129.79 2 0 24.81-999 ?-999 ?-999 ? CA CA D1134 mASP~F 18 48.22 110.04 130.62 47.54 109.34 130.40 50.65 109.89 130.82 51.59 110.53 131.30 49.32 109.86 131.57 49.16 108.55 132.35 2 0 24.07-999 ?-999 ?-999 ? CA CA C1123 mALA~F 19 50.69 109.27 129.64 49.85 108.80 129.37 52.22 110.76 128.43 53.38 111.18 128.43 51.92 109.32 128.85 51.82 108.41 127.63 2 0 21.95-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 20 51.20 111.53 128.06 50.31 111.07 128.06 51.87 113.75 128.91 52.72 114.63 128.79 51.42 112.93 127.70 50.16 113.53 127.08 2 0 21.36-999 ?-999 ?-999 ? CA CA D1134 mTHR~F 21 51.35 113.43 130.09 50.65 112.72 130.04 53.24 113.84 131.63 53.99 114.72 132.07 51.76 114.08 131.33 50.94 113.53 132.52 2 0 23.60-999 ?-999 ?-999 ? CA CA D1134 mLEU~F 22 53.69 112.60 131.44 53.02 111.95 131.11 56.04 113.06 130.82 57.03 113.63 131.29 55.10 112.29 131.72 55.28 110.76 131.60 3 0 20.55-999 ?-999 ?-999 ? CA CA C1123 mARG~F 23 55.74 113.10 129.53 54.91 112.59 129.31 56.62 115.31 128.91 57.67 115.93 128.77 56.53 113.83 128.55 55.91 113.71 127.15 2 0 20.86-999 ?-999 ?-999 ? CA CA D1134 mLYS~F 24 55.48 115.86 129.32 54.70 115.23 129.33 56.36 117.49 130.90 56.98 118.54 130.99 55.41 117.26 129.73 53.98 117.64 130.13 2 0 20.23-999 ?-999 ?-999 ? CA CA D1134 mALA~F 25 56.45 116.51 131.80 55.91 115.69 131.60 58.77 116.69 132.60 59.61 117.21 133.34 57.30 116.68 132.98 57.04 115.59 134.00 2 0 22.14-999 ?-999 ?-999 ? CA CA C1123 mMET~F 26 59.08 116.12 131.43 58.31 115.77 130.90 60.87 117.00 129.92 62.03 117.40 129.84 60.49 116.03 131.02 60.78 114.60 130.56 2 0 19.95-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 27 59.94 117.39 129.04 59.01 117.09 129.21 60.82 119.59 128.30 60.23 120.23 129.17 60.37 118.19 127.90 59.28 118.30 126.82 2 0 18.31-999 ?-999 ?-999 ? CA CA C1133 mGLY.F 28 61.87 120.07 127.64 62.29 119.43 127.00 63.18 121.58 129.10 63.77 120.63 129.61 62.35 121.42 127.84-999.99-999.99-999.99 1 0 14.80-999 ?-999 ?-999 ? CA CA C1133 mILE.F 29 63.22 122.82 129.60 62.67 123.49 129.10 63.43 122.55 132.04 62.24 122.67 132.30 64.03 123.14 130.76 64.20 124.65 130.95 3 0 13.62-999 ?-999 ?-999 ? CA CA C1133 mGLY.F 30 64.30 121.93 132.83 65.22 121.91 132.45 63.39 119.95 134.01 63.16 119.37 132.95 63.98 121.34 134.10-999.99-999.99-999.99 1 0 16.39-999 ?-999 ?-999 ? CA CA C1133 mTHR.F 31 63.12 119.35 135.17 63.42 119.85 135.98 61.43 118.10 136.35 61.81 118.48 137.46 62.42 118.06 135.20 63.39 116.88 135.42 2 0 19.80-999 ?-999 ?-999 ? CA CA C1133 mASP~F 32 60.17 117.77 136.07 59.99 117.49 135.13 59.02 116.46 137.79 58.11 115.72 137.45 59.17 117.83 137.14 57.86 118.34 136.57 2 0 22.30-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 33 59.93 116.15 138.71 60.58 116.88 138.89 58.71 114.59 140.18 58.25 113.45 140.33 59.97 114.86 139.39 61.17 114.79 140.33 2 0 19.95-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 34 58.15 115.66 140.74 58.61 116.53 140.56 55.80 114.96 140.73 54.99 114.19 141.24 56.94 115.53 141.55 56.55 116.87 142.17 2 0 22.89-999 ?-999 ?-999 ? CA CA C1123 mSER~F 35 55.74 115.31 139.45 56.46 115.92 139.13 55.00 113.39 138.13 54.10 112.58 137.95 54.67 114.81 138.59 54.44 115.70 137.37 2 0 23.03-999 ?-999 ?-999 ? CA CA C1123 mILE~F 36 56.28 113.11 137.95 56.92 113.87 138.12 56.31 110.77 138.64 55.68 109.75 138.37 56.67 111.76 137.54 58.16 111.72 137.15 3 0 19.34-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 37 56.69 111.10 139.86 57.18 111.98 139.88 54.94 110.05 141.20 54.48 108.96 141.56 56.44 110.31 141.05 56.92 111.04 142.32 2 0 19.65-999 ?-999 ?-999 ? CA CA C1123 mHIS~F 38 54.18 111.12 140.97 54.67 111.95 140.68 52.14 109.97 140.23 51.34 109.11 140.60 52.74 111.02 141.15 52.06 112.38 140.90 3 0 22.89-999 ?-999 ?-999 ? CA CA C1123 mILE~F 39 52.52 110.06 138.95 53.19 110.77 138.75 52.38 107.71 138.29 51.56 106.77 138.29 51.95 109.14 137.97 52.39 109.54 136.55 3 0 21.77-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 40 53.68 107.54 138.56 54.23 108.38 138.58 53.63 105.63 140.07 53.32 104.44 140.14 54.21 106.21 138.80 55.74 106.22 138.88 3 0 18.76-999 ?-999 ?-999 ? CA CA C1123 mALA~F 41 53.52 106.45 141.11 53.71 107.42 140.93 51.66 105.67 142.52 51.27 104.89 143.39 53.15 105.89 142.40 53.67 106.75 143.54 2 0 20.83-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 42 50.84 106.34 141.70 51.28 106.90 141.00 48.72 105.40 140.80 47.50 105.23 140.75 49.39 106.21 141.90 48.70 107.58 142.03 2 0 24.01-999 ?-999 ?-999 ? CA CA C1123 mARG~F 43 49.54 104.86 139.89 50.50 105.11 139.96 49.52 102.54 139.20 50.63 102.44 139.73 48.99 103.95 138.89 49.36 104.38 137.48 2 0 22.93-999 ?-999 ?-999 ? CA CA C1123 mSER~F 44 48.72 101.51 138.95 47.82 101.77 138.58 50.21 99.71 138.18 50.35 100.34 137.13 49.15 100.14 139.19 47.95 99.18 139.08 2 0 22.36-999 ?-999 ?-999 ? CA CA C1123 mASN~F 45 50.94 98.63 138.48 50.75 98.21 139.37 51.31 97.88 136.16 51.88 98.17 135.11 51.93 98.14 137.52 52.59 96.85 138.04 2 0 19.27-999 ?-999 ?-999 ? CA CA C1123 mALA~F 46 50.11 97.29 136.12 49.69 97.08 137.00 49.21 98.31 134.06 49.25 98.40 132.82 49.50 97.02 134.82 48.22 96.22 135.01 2 0 21.41-999 ?-999 ?-999 ? CA CA C1123 mGLN~F 47 48.83 99.34 134.82 48.76 99.15 135.80 49.86 101.21 133.64 49.92 101.68 132.51 48.56 100.63 134.18 47.87 101.55 135.19 2 0 22.27-999 ?-999 ?-999 ? CA CA C1123 mARG~F 48 50.91 101.18 134.46 50.72 100.82 135.38 52.61 100.96 132.70 53.16 101.55 131.77 52.22 101.65 134.00 53.26 101.37 135.09 2 0 18.73-999 ?-999 ?-999 ? CA CA C1123 mGLN~F 49 52.29 99.67 132.54 51.81 99.24 133.31 51.93 99.66 130.12 52.48 99.79 129.02 52.66 99.02 131.29 52.35 97.52 131.34 2 0 18.25-999 ?-999 ?-999 ? CA CA C1123 mGLN~F 50 50.66 100.02 130.36 50.32 99.85 131.28 50.46 102.01 128.99 50.51 102.45 127.85 49.89 100.63 129.27 48.40 100.76 129.61 2 0 21.37-999 ?-999 ?-999 ? CA CA C1123 mILE~F 51 50.86 102.70 130.06 50.70 102.27 130.95 52.81 103.86 129.06 53.12 104.69 128.20 51.50 103.99 129.84 51.74 104.67 131.20 3 0 20.22-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 52 53.56 102.79 129.26 53.19 102.13 129.92 54.60 102.48 127.06 55.25 103.12 126.23 54.83 102.61 128.55 55.58 101.37 129.06 2 0 17.07-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 53 53.63 101.62 126.74 53.19 101.18 127.52 52.84 102.64 124.65 53.20 102.89 123.50 53.27 101.36 125.35 52.11 100.34 125.28 2 0 19.46-999 ?-999 ?-999 ? CA CA C1123 mASP~F 54 52.01 103.42 125.33 51.79 103.11 126.25 52.61 105.69 124.58 52.72 106.39 123.57 51.51 104.64 124.68 50.30 105.18 125.44 2 0 21.92-999 ?-999 ?-999 ? CA CA C1123 mTYR~F 55 53.48 105.81 125.56 53.31 105.22 126.35 55.44 106.39 124.23 55.82 107.26 123.44 54.60 106.76 125.45 55.47 106.79 126.71 3 0 19.64-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 56 55.82 105.11 124.13 55.48 104.51 124.85 55.96 104.91 121.68 56.53 105.34 120.67 56.67 104.70 123.01 57.12 103.24 123.18 2 0 18.48-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 57 54.65 104.66 121.65 54.24 104.36 122.51 53.76 106.32 120.08 53.99 106.72 118.94 53.92 104.84 120.40 52.55 104.14 120.42 2 0 22.14-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 58 53.41 107.15 121.06 53.22 106.73 121.94 54.70 109.14 120.38 54.73 109.97 119.46 53.33 108.59 120.78 52.88 109.37 122.00 3 0 19.76-999 ?-999 ?-999 ? CA CA D1134 mPHE~F 59 55.78 108.78 121.08 55.68 108.02 121.72 58.18 108.84 120.21 59.19 109.50 119.88 57.01 109.55 120.86 57.45 110.18 122.19 3 0 18.68-999 ?-999 ?-999 ? CA CA D1134 mGLY~F 60 58.14 107.54 119.98 57.30 107.11 120.32 60.43 106.58 120.14 61.51 106.28 119.60 59.20 106.82 119.29-999.99-999.99-999.99 1 0 19.93-999 ?-999 ?-999 ? CA CA C1123 mLYS.F 61 60.31 106.73 121.44 59.39 107.03 121.69 60.73 105.76 123.64 59.63 106.15 124.05 61.35 106.49 122.44 61.94 107.79 123.00 2 0 16.34-999 ?-999 ?-999 ? CA CA C1123 mHIS~F 62 61.44 104.79 124.20 62.33 104.60 123.80 60.95 104.94 126.61 61.96 105.63 126.82 60.85 104.09 125.35 61.50 102.71 125.57 3 0 13.80-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 63 59.93 104.85 127.45 59.20 104.23 127.14 61.07 105.29 129.60 61.63 106.18 130.23 59.86 105.57 128.71 58.58 105.20 129.44 3 0 13.57-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 64 61.46 104.02 129.69 60.90 103.36 129.18 63.85 104.48 130.03 64.63 104.95 130.87 62.64 103.67 130.48 62.98 102.18 130.35 2 0 9.81-999 ?-999 ?-999 ? CA CA C1123 mASP~F 65 64.02 104.61 128.71 63.33 104.19 128.13 65.16 106.82 128.61 66.14 107.40 129.07 65.21 105.34 128.24 65.37 105.17 126.74 2 0 9.90-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 66 64.00 107.45 128.48 63.29 106.91 128.03 64.25 108.97 130.41 64.95 109.92 130.75 63.81 108.81 128.96 62.34 109.23 128.83 2 0 12.79-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 67 63.81 108.04 131.27 63.29 107.30 130.86 65.58 107.87 132.99 66.11 108.41 133.96 64.11 108.15 132.69 63.24 107.20 133.51 3 0 11.25-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 68 66.20 107.00 132.20 65.61 106.62 131.48 68.49 107.88 132.15 69.54 108.03 132.77 67.60 106.65 132.36 67.99 105.57 131.35 2 0 8.26-999 ?-999 ?-999 ? CA CA C1123 mSER~F 69 68.00 108.78 131.29 67.13 108.53 130.87 68.30 111.12 131.98 69.11 111.87 132.51 68.71 110.02 131.01 68.44 110.48 129.58 2 0 11.38-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 70 66.99 111.26 132.19 66.41 110.54 131.81 66.63 112.25 134.44 66.79 113.25 135.15 66.51 112.41 132.94 65.08 112.74 132.50 2 0 13.97-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 71 66.58 111.04 134.98 66.46 110.29 134.34 68.08 110.40 136.84 68.87 109.97 136.01 66.70 110.89 136.43 65.64 109.90 136.96 3 0 12.77-999 ?-999 ?-999 ? CA CA C1123 mSER~F 72 68.35 110.42 138.14 67.62 110.78 138.72 69.49 109.25 140.00 68.49 109.38 140.69 69.63 109.94 138.65 70.62 111.11 138.76 2 0 12.00-999 ?-999 ?-999 ? CA CA C1123 mGLY~F 73 70.52 108.50 140.36 71.21 108.47 139.64 69.61 106.86 142.00 68.94 106.22 141.18 70.72 107.79 141.59-999.99-999.99-999.99 1 0 11.81-999 ?-999 ?-999 ? CA CA C1123 mASN~F 74 69.36 106.76 143.31 69.96 107.31 143.89 66.93 106.32 143.24 66.04 105.47 143.14 68.29 105.91 143.80 68.26 105.94 145.33 2 0 12.52-999 ?-999 ?-999 ? CA CA C1123 mTYR~F 75 66.74 107.61 142.94 67.50 108.24 143.09 65.18 107.34 141.07 64.12 106.80 140.76 65.41 107.99 142.43 65.24 109.50 142.37 3 0 13.62-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 76 66.20 107.35 140.21 67.02 107.84 140.52 65.86 105.19 139.08 65.12 104.54 138.35 66.08 106.69 138.91 67.38 106.92 138.12 2 0 10.38-999 ?-999 ?-999 ? CA CA C1123 mALA~F 77 66.57 104.60 140.03 67.14 105.20 140.59 65.07 102.77 140.67 64.49 101.80 140.18 66.46 103.14 140.19 67.53 102.63 141.14 2 0 8.86-999 ?-999 ?-999 ? CA CA C1123 mALA~F 78 64.54 103.53 141.61 65.13 104.28 141.92 62.13 103.49 141.07 61.18 102.69 140.97 63.19 103.28 142.13 62.93 104.14 143.36 2 0 12.16-999 ?-999 ?-999 ? CA CA C1123 mALA~F 79 62.29 104.53 140.24 63.11 105.08 140.41 61.33 103.70 138.13 60.29 103.20 137.68 61.31 104.79 139.19 61.51 106.15 138.53 2 0 12.38-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 80 62.52 103.32 137.70 63.28 103.85 138.09 62.15 100.90 137.26 61.68 100.03 136.52 62.68 102.23 136.74 64.18 102.09 136.46 3 0 9.22-999 ?-999 ?-999 ? CA CA C1123 mALA~F 81 62.31 100.65 138.56 62.77 101.40 139.05 60.34 99.26 139.11 59.75 98.21 138.85 61.85 99.41 139.19 62.28 99.45 140.66 2 0 10.54-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 82 59.65 100.38 139.34 60.20 101.18 139.58 57.73 100.14 137.83 56.63 99.60 137.62 58.20 100.39 139.25 57.69 101.74 139.77 3 0 13.85-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 83 58.56 100.49 136.84 59.43 100.87 137.13 58.27 98.86 134.98 57.64 98.44 134.00 58.15 100.30 135.45 58.97 101.21 134.53 3 0 12.81-999 ?-999 ?-999 ? CA CA C1123 mARG~F 84 59.11 98.08 135.65 59.56 98.50 136.44 58.07 95.86 135.47 57.44 95.96 136.52 59.31 96.70 135.21 60.48 96.08 135.98 2 0 11.82-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 85 57.79 94.92 134.57 58.27 94.98 133.69 57.38 93.15 136.16 58.60 93.09 136.29 56.81 93.90 134.96 56.54 92.99 133.77 2 0 14.97-999 ?-999 ?-999 ? CA CA C1123 mPRO~F 86 56.53 92.67 137.05 55.57 92.75 136.78 57.94 90.92 138.14 58.92 90.80 138.88 56.97 92.08 138.31 55.67 91.59 138.96 3 0 16.20-999 ?-999 ?-999 ? CA CA C1123 mASP~F 87 57.71 90.04 137.18 56.89 90.22 136.63 59.95 89.35 136.44 61.00 88.86 136.86 58.62 88.90 137.00 57.96 87.88 136.08 2 0 16.25-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 88 59.90 90.31 135.51 58.97 90.62 135.29 61.95 91.56 135.94 63.17 91.41 136.03 61.11 90.84 134.90 60.76 91.75 133.72 2 0 12.80-999 ?-999 ?-999 ? CA CA C1123 mPHE~F 89 61.28 92.33 136.79 60.30 92.42 136.61 62.78 92.01 138.74 63.94 92.29 139.01 61.96 93.00 137.89 60.95 93.69 138.80 3 0 11.56-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 90 62.19 90.91 139.19 61.24 90.78 138.91 64.04 89.25 139.28 65.14 88.99 139.78 62.95 89.98 140.05 62.03 88.99 140.74 3 0 13.66-999 ?-999 ?-999 ? CA CA C1123 mALA~F 91 63.76 88.95 138.01 62.83 89.14 137.73 65.97 89.32 137.04 67.13 88.93 137.24 64.79 88.36 137.15 64.21 88.08 135.78 2 0 12.82-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 92 65.68 90.59 136.77 64.72 90.81 136.66 67.49 91.73 137.99 68.70 91.88 138.10 66.79 91.56 136.65 66.29 92.91 136.11 2 0 9.09-999 ?-999 ?-999 ? CA CA C1123 mGLN~F 93 66.71 91.72 139.07 65.72 91.67 138.89 68.24 90.59 140.62 69.25 90.68 141.30 67.32 91.78 140.39 66.24 91.87 141.48 2 0 10.60-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 94 67.93 89.46 139.97 67.13 89.48 139.38 70.13 88.54 139.49 71.19 88.40 140.09 68.79 88.30 140.19 68.14 87.03 139.66 3 0 10.65-999 ?-999 ?-999 ? CA CA F1126 mHIS~F 95 69.99 88.91 138.23 69.04 88.99 137.92 72.12 90.11 138.08 73.30 89.80 138.25 71.14 89.18 137.38 70.64 89.80 136.07 3 0 8.89-999 ?-999 ?-999 ? CA CA F1126 mALA~F 96 71.60 91.25 138.53 70.62 91.36 138.36 73.02 91.71 140.49 74.07 92.17 140.95 72.42 92.25 139.20 71.62 93.51 139.49 2 0 7.96-999 ?-999 ?-999 ? CA CA F1126 mALA~F 97 72.36 90.72 141.11 71.49 90.44 140.72 74.18 89.27 141.95 75.00 88.95 142.81 72.98 90.15 142.31 71.99 89.34 143.12 2 0 6.84-999 ?-999 ?-999 ? CA CA F1126 mMET~F 98 74.26 88.85 140.69 73.60 89.28 140.08 76.36 88.46 139.39 77.53 88.11 139.54 75.25 87.87 140.26 74.58 86.76 139.42 2 0 -4.28-999 ?-999 ?-999 ? CA CA F1126smLYS~F 99 75.95 89.26 138.43 74.99 89.53 138.52 77.53 91.00 137.63 78.38 91.41 136.83 76.79 89.71 137.33 75.87 89.84 136.12 2 0 4.28-999 ?-999 ?-999 ? CA CA F1126 mGLY~F 100 77.27 91.62 138.78 76.52 91.23 139.31 79.40 92.37 139.71 79.80 91.21 139.54 78.05 92.79 139.17-999.99-999.99-999.99 1 0 -4.52-999 ?-999 ?-999 ? CA CA F1126smLEU.F 101 80.12 93.26 140.38 79.67 94.15 140.47 81.36 91.75 141.89 81.76 90.67 141.47 81.43 92.95 140.94 82.02 94.17 141.62 3 0 -4.70-999 ?-999 ?-999 ? CA CA F1126smGLY.F 102 80.89 91.88 143.13 80.61 92.80 143.40 79.53 89.94 143.81 78.90 89.98 142.75 80.83 90.70 143.99-999.99-999.99-999.99 1 0 -4.21-999 ?-999 ?-999 ? CA CA F1126smTHR.F 103 79.09 89.25 144.86 79.68 89.27 145.66 76.90 88.98 145.92 77.27 88.87 147.09 77.82 88.53 144.79 78.03 87.00 144.83 2 0 4.54-999 ?-999 ?-999 ? CA CA F1126 mASP~F 104 75.73 89.51 145.58 75.59 89.64 144.60 73.95 88.62 146.99 72.86 88.36 146.49 74.74 89.87 146.59 73.74 90.92 146.08 2 0 7.73-999 ?-999 ?-999 ? CA CA F1126 mLYS~F 105 74.52 87.85 147.90 75.39 88.20 148.25 72.61 86.78 149.06 71.64 86.08 148.78 73.92 86.60 148.33 74.97 85.81 149.13 2 0 9.77-999 ?-999 ?-999 ? CA CA F1126 mASN~F 106 72.48 87.75 149.96 73.30 88.31 150.12 70.10 88.31 149.67 68.93 88.00 149.89 71.20 87.93 150.64 71.34 88.95 151.77 2 0 13.04-999 ?-999 ?-999 ? CA CA F1126 mALA~F 107 70.47 88.95 148.55 71.44 89.19 148.49 68.97 87.94 146.90 67.78 87.76 146.68 69.47 89.25 147.53 70.01 90.16 146.45 2 0 12.18-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 108 69.91 87.05 146.63 70.84 87.36 146.82 68.68 84.96 147.04 67.82 84.20 146.61 69.58 85.73 146.08 70.87 84.95 145.79 3 0 11.68-999 ?-999 ?-999 ? CA CA F1126 mILE~F 109 68.87 85.17 148.35 69.61 85.80 148.58 66.63 85.14 149.35 65.62 84.44 149.34 68.02 84.50 149.33 68.67 84.51 150.72 3 0 15.00-999 ?-999 ?-999 ? CA CA F1126 mASP~F 110 66.57 86.46 149.32 67.46 86.90 149.31 64.39 86.71 148.20 63.17 86.70 148.35 65.32 87.21 149.30 65.62 88.69 149.04 2 0 16.67-999 ?-999 ?-999 ? CA CA F1126 mILE~F 111 65.00 86.38 147.06 66.00 86.38 147.11 64.07 84.57 145.61 63.02 84.19 145.08 64.27 86.06 145.85 64.92 86.72 144.63 3 0 16.28-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 112 65.04 83.71 145.90 65.84 84.07 146.36 64.33 81.43 146.65 63.79 80.35 146.42 64.83 82.31 145.52 66.09 81.70 144.90 3 0 16.70-999 ?-999 ?-999 ? CA CA F1126 mCYH~F 113 64.49 81.83 147.91 64.90 82.73 148.03 62.70 81.33 149.55 62.29 80.87 150.63 64.07 80.95 149.00 65.10 81.00 150.13 2 0 19.18-999 ?-999 ?-999 ? CA CA F1126 mTHR.F 114 61.97 82.22 148.89 62.35 82.52 148.01 59.56 82.58 148.46 58.47 83.11 148.72 60.70 82.69 149.45 60.80 84.19 149.84 2 0 21.59-999 ?-999 ?-999 ? CA CA F1126 mGLN.F 115 59.76 81.88 147.34 60.65 81.43 147.27 58.00 80.46 146.28 58.58 79.43 146.63 58.71 81.81 146.33 59.30 82.08 144.94 2 0 22.59-999 ?-999 ?-999 ? CA CA F1126 mSER~F 116 56.79 80.49 145.73 56.43 81.42 145.61 56.64 78.69 144.08 57.35 79.39 143.34 56.05 79.30 145.35 54.60 79.73 145.04 2 0 25.66-999 ?-999 ?-999 ? CA CA F1126 mASN~F 117 56.30 77.46 143.76 55.72 77.01 144.45 56.40 77.71 141.32 57.24 78.02 140.47 56.73 76.82 142.52 56.03 75.47 142.36 2 0 25.70-999 ?-999 ?-999 ? CA CA F1126 mALA~F 118 55.13 78.12 141.23 54.53 77.81 141.97 55.52 80.23 140.00 55.87 80.69 138.91 54.69 78.96 140.12 53.22 79.35 140.31 2 0 26.60-999 ?-999 ?-999 ? CA CA F1126 mGLN~F 119 55.76 80.88 141.13 55.42 80.44 141.96 57.90 81.92 140.58 58.41 82.72 139.80 56.49 82.15 141.10 56.50 82.77 142.49 2 0 23.43-999 ?-999 ?-999 ? CA CA C1123 mILE~F 120 58.52 80.82 140.99 57.98 80.25 141.62 59.93 80.23 139.05 60.82 80.72 138.36 59.87 80.49 140.55 60.43 79.28 141.33 3 0 21.22-999 ?-999 ?-999 ? CA CA F1126 mHIS~F 121 58.96 79.47 138.53 58.29 79.11 139.19 58.75 80.51 136.32 59.24 80.64 135.20 58.92 79.22 137.10 57.77 78.27 136.75 3 0 22.86-999 ?-999 ?-999 ? CA CA F1126 mALA~F 122 58.00 81.47 136.87 57.65 81.28 137.78 59.00 83.57 136.10 59.40 84.22 135.13 57.76 82.70 136.10 56.58 83.42 136.72 2 0 21.10-999 ?-999 ?-999 ? CA CA C1123 mILE~F 123 59.69 83.60 137.25 59.28 83.10 138.01 61.98 83.71 136.38 62.74 84.40 135.70 60.95 84.33 137.30 61.48 84.35 138.75 3 0 18.14-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 124 62.02 82.37 136.34 61.37 81.89 136.92 62.72 82.10 133.99 63.61 82.44 133.21 62.99 81.73 135.44 62.92 80.21 135.61 2 0 18.58-999 ?-999 ?-999 ? CA CA F1126 mALA~F 125 61.44 82.02 133.61 60.78 81.75 134.31 61.48 83.77 131.88 62.05 84.05 130.83 61.12 82.33 132.21 59.66 82.02 131.93 2 0 19.42-999 ?-999 ?-999 ? CA CA C1123 mALA~F 126 61.20 84.70 132.80 60.76 84.35 133.63 63.03 86.30 132.37 63.44 87.02 131.47 61.53 86.10 132.57 61.04 86.96 133.72 2 0 16.00-999 ?-999 ?-999 ? CA CA C1123 mPHE~F 127 63.84 85.67 133.21 63.34 85.16 133.91 65.77 85.27 131.76 66.61 85.94 131.15 65.29 85.72 133.14 65.90 84.82 134.22 3 0 14.49-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 128 65.26 84.13 131.29 64.62 83.68 131.92 65.14 84.54 128.87 65.79 84.70 127.84 65.61 83.60 129.98 64.99 82.22 129.78 2 0 16.75-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 129 64.01 85.19 129.11 63.53 84.94 129.95 64.48 87.40 128.12 64.83 87.88 127.04 63.54 86.21 128.17 62.13 86.68 128.55 3 0 15.76-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 130 64.90 87.90 129.27 64.57 87.38 130.06 67.18 88.87 128.91 67.81 89.82 128.44 65.75 89.07 129.41 65.87 89.46 130.89 3 0 11.99-999 ?-999 ?-999 ? CA CA C1123 mTYR~F 131 67.76 87.71 129.16 67.13 86.97 129.43 69.65 86.46 128.10 70.83 86.36 127.76 69.21 87.57 129.04 69.81 87.34 130.43 3 0 12.51-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 132 68.72 85.61 127.67 67.79 85.73 128.02 70.16 83.67 127.40 71.14 83.21 126.84 69.15 84.58 126.71 69.75 85.24 125.47 2 0 16.16-999 ?-999 ?-999 ? CA CA C1123 mGLU.F 133 69.89 83.43 128.68 69.11 83.96 129.03 69.73 81.77 130.48 68.58 82.13 130.69 70.65 82.52 129.50 71.79 83.18 130.27 2 0 15.41-999 ?-999 ?-999 ? CA CA F1126 mASP~F 134 70.30 80.71 131.03 71.23 80.52 130.72 69.98 80.34 133.42 71.16 80.43 133.75 69.60 79.89 132.01 69.92 78.41 131.82 2 0 15.73-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 135 68.95 80.64 134.19 68.06 80.47 133.77 69.97 80.20 136.37 70.91 80.59 137.07 69.13 81.15 135.54 67.76 81.36 136.20 3 0 13.73-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 136 69.60 78.92 136.29 68.83 78.72 135.67 71.80 77.96 136.76 72.64 77.99 137.66 70.31 77.93 137.08 69.75 76.52 136.81 2 0 14.55-999 ?-999 ?-999 ? CA CA F1126 mLYS~F 137 72.07 77.96 135.46 71.25 77.97 134.88 74.22 79.15 135.44 75.39 79.09 135.79 73.42 77.96 134.93 73.38 77.97 133.39 2 0 13.54-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 138 73.55 80.31 135.50 72.60 80.30 135.19 74.49 81.36 137.50 75.54 81.71 138.02 74.28 81.47 136.01 73.52 82.75 135.64 2 0 9.98-999 ?-999 ?-999 ? CA CA F1126 mILE~F 139 73.49 80.86 138.22 72.68 80.59 137.68 74.69 79.74 140.06 75.39 79.87 141.07 73.60 80.71 139.66 72.26 80.21 140.25 3 0 9.94-999 ?-999 ?-999 ? CA CA F1126 mILE~F 140 74.84 78.68 139.26 74.22 78.62 138.47 77.28 78.25 139.36 78.25 77.84 140.00 75.88 77.71 139.61 75.64 76.40 138.85 3 0 11.60-999 ?-999 ?-999 ? CA CA F1126 mSER~F 141 77.40 79.25 138.49 76.55 79.51 138.04 79.05 80.96 139.22 80.18 81.46 139.19 78.67 79.89 138.21 78.67 80.46 136.79 2 0 9.16-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 142 78.15 81.39 140.11 77.28 80.91 140.10 78.43 82.12 142.47 78.64 82.92 143.40 78.51 82.50 141.00 77.58 83.69 140.72 2 0 6.30-999 ?-999 ?-999 ? CA CA F1126 mTHR~F 143 78.06 80.87 142.73 77.88 80.32 141.91 78.53 78.93 144.10 78.69 78.29 143.06 77.94 80.34 144.07 76.46 80.23 144.54 2 0 9.20-999 ?-999 ?-999 ? CA CA F1126 mSER~F 144 78.78 78.44 145.30 78.61 79.05 146.08 78.89 76.43 146.72 78.29 77.06 147.60 79.28 77.06 145.39 80.79 77.04 145.17 2 0 12.62-999 ?-999 ?-999 ? CA CA F1126 mGLY~F 145 79.20 75.15 146.87 79.62 74.73 146.06 77.49 74.27 148.43 76.64 74.41 147.55 78.96 74.42 148.10-999.99-999.99-999.99 1 0 16.17-999 ?-999 ?-999 ? CA CA F1126 mASN~F 146 77.21 74.03 149.70 78.03 73.97 150.28 74.97 75.00 149.80 73.79 74.83 149.53 75.87 73.85 150.22 75.92 73.75 151.75 2 0 18.09-999 ?-999 ?-999 ? CA CA F1126 mPHE~F 147 75.54 76.20 149.74 76.51 76.22 149.97 74.22 77.23 147.95 73.04 77.43 147.66 74.76 77.37 149.37 75.56 78.67 149.49 3 0 15.11-999 ?-999 ?-999 ? CA CA F1126 mGLN~F 148 75.13 76.82 147.06 76.06 76.69 147.40 73.57 75.60 145.61 72.56 75.79 144.92 74.71 76.60 145.68 75.90 76.07 144.89 2 0 13.98-999 ?-999 ?-999 ? CA CA F1126 mARG~F 149 73.77 74.47 146.29 74.60 74.44 146.84 71.42 73.84 146.71 70.37 73.43 146.20 72.78 73.39 146.21 73.32 72.18 146.99 2 0 17.63-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 150 71.36 74.69 147.73 72.25 74.94 148.13 69.37 76.02 147.11 68.16 75.95 146.90 70.06 75.19 148.20 70.22 76.05 149.46 3 0 18.14-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 151 70.17 76.82 146.40 71.13 76.80 146.68 69.23 76.77 144.14 68.17 76.99 143.55 69.64 77.64 145.32 70.65 78.71 144.91 3 0 15.53-999 ?-999 ?-999 ? CA CA F1126 mVAL~F 152 70.02 75.74 143.82 70.87 75.67 144.34 68.30 74.10 143.15 67.41 73.96 142.32 69.61 74.81 142.77 70.68 73.74 142.50 3 0 17.17-999 ?-999 ?-999 ? CA CA F1126 mSER~F 153 68.17 73.69 144.41 68.97 73.83 144.99 65.75 74.04 144.65 64.69 73.69 144.13 66.93 73.07 144.87 66.99 72.74 146.37 2 0 20.49-999 ?-999 ?-999 ? CA CA F1126 mMET~F 154 65.96 75.26 145.12 66.86 75.41 145.54 64.46 76.51 143.59 63.29 76.78 143.32 64.91 76.28 145.02 65.45 77.60 145.60 2 0 19.63-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 155 65.40 76.41 142.66 66.29 76.12 143.01 64.41 75.63 140.50 64.01 75.83 139.35 65.15 76.70 141.26 66.47 77.07 140.59 3 0 18.68-999 ?-999 ?-999 ? CA CA F1126 mGLN.F 156 64.16 74.47 141.10 64.51 74.38 142.03 61.90 73.72 140.43 61.12 73.14 139.68 63.40 73.46 140.37 63.69 72.09 141.00 2 0 20.42-999 ?-999 ?-999 ? CA CA A1121 mGLY.F 157 61.47 74.55 141.39 62.19 75.02 141.91 59.40 73.37 141.87 58.39 73.05 141.25 60.05 74.73 141.63-999.99-999.99-999.99 1 0 23.93-999 ?-999 ?-999 ? CA CA F1126 mGLY.F 158 60.02 72.58 142.75 60.81 72.99 143.22 58.97 70.97 144.36 58.77 69.81 144.72 59.56 71.23 142.99-999.99-999.99-999.99 1 0 23.69-999 ?-999 ?-999 ? CA CA A1121 mARG.F 159 58.70 72.00 145.15 58.93 72.90 144.78 56.82 70.99 146.33 56.06 71.18 145.37 58.10 71.79 146.47 57.79 73.16 147.10 2 0 26.99-999 ?-999 ?-999 ? CA CA A1121 mLYS.F 160 56.55 70.05 147.25 57.23 69.91 147.96 54.21 70.14 147.82 53.92 69.95 148.99 55.29 69.32 147.11 55.34 67.89 147.66 2 0 28.83-999 ?-999 ?-999 ? CA CA A1121 mGLU.F 161 53.70 71.11 147.07 53.97 71.11 146.11 51.49 71.51 148.10 50.84 72.02 149.01 52.82 72.10 147.68 52.69 73.30 146.73 2 0 31.77-999 ?-999 ?-999 ? CA CA A1121 mASP.F 162 51.10 70.37 147.54 51.72 69.97 146.86 49.97 68.72 149.00 49.15 67.82 149.10 49.81 69.80 147.94 49.09 69.23 146.71 2 0 33.79-999 ?-999 ?-999 ? CA CA A1121 mGLU.F 163 51.07 68.77 149.74 51.67 69.55 149.55 50.53 68.05 152.01 50.75 69.07 152.68 51.35 67.75 150.76 52.84 67.75 151.10 2 0 33.83-999 ?-999 ?-999 ? CA CA A1121 mPRO.F 164 49.61 67.16 152.35 49.54 66.38 151.72 49.60 67.25 154.82 50.56 66.49 154.91 48.78 67.35 153.54 47.82 66.15 153.49 3 0 37.49-999 ?-999 ?-999 ? CA CA A1121 mVAL.F 165 49.18 68.01 155.83 48.45 68.65 155.57 49.49 66.50 157.71 48.43 65.91 157.48 49.72 67.91 157.18 49.01 68.89 158.13 3 0 39.27-999 ?-999 ?-999 ? CA CA A1121 mASN~F 166 50.47 65.97 158.42 51.23 66.61 158.53 51.49 64.59 160.12 52.68 64.45 159.87 50.46 64.63 158.99 50.75 63.59 157.92 2 0 39.78-999 ?-999 ?-999 ? CA CA A1121 mALA~F 167 50.99 64.73 161.34 49.99 64.83 161.34 52.77 63.59 162.60 53.92 63.74 163.02 51.78 64.74 162.56 50.84 64.67 163.77 2 0 41.64-999 ?-999 ?-999 ? CA CA A1121 mALA~F 168 52.34 62.40 162.19 51.40 62.36 161.85 54.45 61.48 161.35 55.61 61.39 161.77 53.27 61.27 162.27 52.56 59.96 161.96 2 0 40.51-999 ?-999 ?-999 ? CA CA A1121 mHIS~F 169 54.18 61.79 160.07 53.21 61.88 159.84 56.13 63.18 159.52 57.35 63.20 159.40 55.31 61.96 159.15 54.84 62.03 157.70 3 0 36.77-999 ?-999 ?-999 ? CA CA A1121 mALA~F 170 55.45 64.21 160.01 54.46 64.07 160.04 57.10 65.10 161.59 58.22 65.61 161.64 56.14 65.42 160.46 55.10 66.44 160.92 2 0 37.38-999 ?-999 ?-999 ? CA CA A1121 mALA~F 171 56.66 64.26 162.53 55.74 63.89 162.41 58.78 63.20 163.13 59.90 63.41 163.58 57.56 63.95 163.65 56.84 63.17 164.73 2 0 36.93-999 ?-999 ?-999 ? CA CA A1131 mGLU~F 172 58.54 62.36 162.11 57.59 62.28 161.80 60.71 62.60 161.01 61.91 62.40 161.17 59.67 61.62 161.56 59.23 60.63 160.49 2 0 34.15-999 ?-999 ?-999 ? CA CA A1131 mASP~F 173 60.24 63.64 160.33 59.24 63.67 160.24 61.76 65.50 160.89 62.93 65.88 160.81 61.15 64.65 159.78 60.41 65.56 158.80 2 0 32.85-999 ?-999 ?-999 ? CA CA A1131 mALA~F 174 60.98 65.80 161.93 60.04 65.46 161.86 62.64 65.83 163.74 63.62 66.45 164.16 61.51 66.57 163.05 60.42 66.93 164.05 2 0 33.55-999 ?-999 ?-999 ? CA CA A1131 mALA~F 175 62.52 64.50 163.83 61.67 64.12 163.48 64.77 63.60 163.42 65.94 63.65 163.80 63.61 63.70 164.40 63.13 62.31 164.80 2 0 31.33-999 ?-999 ?-999 ? CA CA A1131 mALA~F 176 64.46 63.45 162.13 63.49 63.40 161.90 66.41 64.64 161.22 67.64 64.62 161.21 65.57 63.36 161.18 65.05 63.09 159.78 2 0 28.58-999 ?-999 ?-999 ? CA CA A1131 mILE~F 177 65.72 65.78 161.28 64.73 65.70 161.34 67.31 67.20 162.51 68.44 67.66 162.47 66.48 67.03 161.25 65.55 68.23 161.04 3 0 28.62-999 ?-999 ?-999 ? CA CA A1131 mTYR~F 178 66.73 66.79 163.64 65.77 66.51 163.57 68.81 66.03 164.71 69.89 66.52 165.01 67.50 66.79 164.88 66.71 66.15 166.02 3 0 28.63-999 ?-999 ?-999 ? CA CA A1131 mGLN~F 179 68.69 64.81 164.18 67.78 64.53 163.90 70.88 64.60 163.08 72.09 64.42 163.24 69.88 63.98 164.05 69.51 62.57 163.59 2 0 25.46-999 ?-999 ?-999 ? CA CA A1131 mALA~F 180 70.38 65.31 162.07 69.39 65.44 162.06 72.16 66.98 161.62 73.20 67.33 161.06 71.31 65.84 161.07 70.54 66.33 159.84 2 0 23.76-999 ?-999 ?-999 ? CA CA A1131 mGLY~F 181 71.71 67.58 162.72 70.85 67.23 163.10 72.81 68.49 164.75 73.98 68.30 165.09 72.47 68.67 163.29-999.99-999.99-999.99 1 0 24.43-999 ?-999 ?-999 ? CA CA A1131 mGLU.F 182 71.80 68.59 165.60 70.91 68.68 165.16 72.47 67.22 167.56 73.37 67.18 168.40 71.97 68.57 167.04 70.67 68.96 167.74 2 0 26.28-999 ?-999 ?-999 ? CA CA A1131 mGLY.F 183 71.93 66.10 167.10 71.25 66.23 166.37 73.70 64.33 167.28 73.96 63.12 167.26 72.30 64.81 167.63-999.99-999.99-999.99 1 0 25.07-999 ?-999 ?-999 ? CA CA A1131 mGLN.F 184 74.64 65.23 167.01 74.30 66.17 167.02 76.91 66.12 166.69 76.43 67.24 166.87 76.02 64.88 166.71 76.14 64.14 165.38 2 0 21.61-999 ?-999 ?-999 ? CA CA A1131 mILE.F 185 78.20 65.90 166.47 78.45 64.94 166.34 79.25 67.58 165.02 79.19 68.79 164.82 79.15 67.02 166.43 80.53 66.60 166.96 3 0 19.91-999 ?-999 ?-999 ? CA CA A1131 mGLY.F 186 79.38 66.69 164.04 79.49 65.75 164.36 77.94 67.43 162.20 77.06 67.58 163.05 79.36 67.08 162.64-999.99-999.99-999.99 1 0 17.89-999 ?-999 ?-999 ? CA CA A1131 mTHR.F 187 77.71 67.58 160.90 78.51 67.48 160.31 76.00 67.11 159.17 76.84 66.81 158.33 76.35 67.88 160.44 76.16 69.39 160.22 2 0 19.95-999 ?-999 ?-999 ? CA CA A1131 mASP~F 188 74.72 66.76 159.03 74.16 66.87 159.85 73.38 67.40 157.12 72.16 67.44 157.27 74.21 66.28 157.76 73.32 65.04 157.89 2 0 20.62-999 ?-999 ?-999 ? CA CA A1131 mGLU~F 189 74.07 68.32 156.46 75.06 68.15 156.41 72.33 69.06 154.89 71.30 69.72 154.79 73.41 69.48 155.89 74.44 70.40 155.23 2 0 22.60-999 ?-999 ?-999 ? CA CA A1131 mSER~F 190 72.62 68.04 154.09 73.48 67.58 154.30 70.34 67.32 153.48 69.37 67.38 152.72 71.74 67.66 153.00 72.35 66.51 152.19 2 0 23.36-999 ?-999 ?-999 ? CA CA A1131 mARG~F 191 70.20 66.96 154.75 71.03 66.98 155.30 68.04 67.82 155.51 66.83 67.82 155.29 68.87 66.57 155.24 69.00 65.68 156.46 2 0 25.55-999 ?-999 ?-999 ? CA CA A1131 mPHE~F 192 68.70 68.88 155.98 69.66 68.72 156.18 67.55 70.68 154.82 66.44 71.18 154.67 68.03 70.17 156.18 68.97 71.20 156.79 3 0 26.80-999 ?-999 ?-999 ? CA CA F1126 mASN~F 193 68.41 70.56 153.82 69.30 70.19 154.10 66.88 70.11 151.98 65.90 70.65 151.49 68.09 70.92 152.45 69.26 70.59 151.52 2 0 24.23-999 ?-999 ?-999 ? CA CA F1126 mALA~F 194 67.00 68.79 152.15 67.82 68.48 152.64 64.61 68.27 152.20 63.63 68.40 151.46 65.97 67.89 151.64 66.30 66.44 151.91 2 0 25.07-999 ?-999 ?-999 ? CA CA A1121 mVAL~F 195 64.52 68.41 153.51 65.38 68.36 154.02 62.69 70.06 153.87 61.51 70.32 153.63 63.19 68.64 154.09 63.20 68.29 155.59 3 0 28.66-999 ?-999 ?-999 ? CA CA A1121 mLEU~F 196 63.61 71.02 153.97 64.54 70.70 154.12 62.83 72.79 152.43 62.11 73.77 152.19 63.22 72.42 153.85 64.32 73.33 154.40 3 0 26.55-999 ?-999 ?-999 ? CA CA F1126 mALA~F 197 63.28 72.03 151.44 63.83 71.24 151.70 61.73 71.65 149.51 61.13 72.12 148.53 62.93 72.41 150.07 64.15 72.22 149.18 2 0 25.08-999 ?-999 ?-999 ? CA CA F1126 mTHR~F 198 61.40 70.47 150.04 61.87 70.24 150.89 59.04 69.57 150.05 58.05 69.27 149.36 60.41 69.62 149.39 60.89 68.15 149.23 2 0 26.76-999 ?-999 ?-999 ? CA CA A1121 mARG~F 199 58.94 69.74 151.37 59.80 69.96 151.83 56.81 70.88 151.82 57.34 71.99 151.78 57.65 69.62 152.03 57.78 69.38 153.53 2 0 30.46-999 ?-999 ?-999 ? CA CA A1121 mSER~F 200 55.49 70.68 151.77 55.24 69.72 151.78 54.70 72.72 152.88 55.15 72.31 153.95 54.53 71.76 151.71 53.10 71.18 151.72 2 0 32.12-999 ?-999 ?-999 ? CA CA F1126 mTYR~F 201 54.35 74.00 152.71 54.05 74.24 151.78 53.58 74.50 155.01 54.01 74.59 156.18 54.44 74.94 153.83 53.99 76.33 153.35 3 0 31.48-999 ?-999 ?-999 ? CA CA F1126 mPRO~F 202 52.33 74.08 154.83 51.99 74.09 153.89 52.23 72.48 156.73 52.28 72.43 157.96 51.57 73.64 156.01 50.21 73.25 155.44 3 0 35.25-999 ?-999 ?-999 ? CA CA F1126 mGLN~F 203 52.81 71.53 155.98 52.76 71.67 154.99 54.75 70.77 157.32 55.11 70.20 158.36 53.44 70.40 156.65 53.62 69.22 155.70 2 0 35.64-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 204 55.49 71.73 156.77 55.12 72.12 155.92 56.44 72.82 158.76 57.10 72.58 159.76 56.74 72.16 157.41 57.48 73.14 156.51 3 0 32.76-999 ?-999 ?-999 ? CA CA F1126 mHIS~F 205 55.40 73.65 158.76 54.99 73.79 157.86 54.60 73.25 161.04 54.82 73.46 162.23 54.94 74.29 159.98 53.70 75.15 159.66 3 0 34.43-999 ?-999 ?-999 ? CA CA F1126 mGLN~F 206 54.06 72.11 160.61 53.87 72.06 159.63 55.08 70.42 162.07 55.24 70.14 163.26 53.78 71.03 161.56 52.88 69.97 160.92 2 0 37.58-999 ?-999 ?-999 ? CA CA F1126 mILE~F 207 56.04 70.25 161.18 55.76 70.52 160.26 58.12 70.69 162.42 58.92 70.27 163.27 57.37 69.74 161.49 58.17 69.57 160.19 3 0 35.85-999 ?-999 ?-999 ? CA CA F1126 mPHE~F 208 57.92 72.01 162.29 57.30 72.31 161.57 58.09 72.68 164.63 58.83 72.66 165.62 58.65 72.88 163.23 58.59 74.34 162.80 3 0 34.60-999 ?-999 ?-999 ? CA CA F1126 mHIS~F 209 56.77 72.47 164.71 56.29 72.52 163.83 56.70 70.95 166.61 57.16 70.95 167.76 56.12 72.21 165.98 54.61 72.07 165.82 3 0 38.25-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 210 56.69 69.87 165.84 56.31 70.00 164.92 58.63 68.77 166.80 59.02 68.20 167.82 57.20 68.60 166.34 57.10 67.51 165.26 2 0 38.94-999 ?-999 ?-999 ? CA CA A1131 mTYR~F 211 59.40 69.58 166.07 58.96 70.06 165.31 60.97 70.22 167.86 61.80 69.72 168.63 60.81 69.71 166.43 61.58 70.62 165.47 3 0 36.01-999 ?-999 ?-999 ? CA CA A1131 mSER~F 212 60.16 71.22 168.22 59.50 71.52 167.54 60.01 70.78 170.64 60.54 70.88 171.75 60.30 71.81 169.55 59.40 73.03 169.72 2 0 38.24-999 ?-999 ?-999 ? CA CA A1131 mLYS~F 213 59.22 69.77 170.32 58.91 69.75 169.37 59.96 67.80 171.63 59.96 67.12 172.66 58.84 68.78 171.33 57.58 68.04 170.92 2 0 39.26-999 ?-999 ?-999 ? CA CA A1131 mILE~F 214 60.94 67.71 170.74 60.84 68.33 169.96 63.38 67.50 171.04 64.46 66.95 170.82 62.05 66.78 170.93 62.09 65.80 169.74 3 0 35.80-999 ?-999 ?-999 ? CA CA A1131 mSER.F 215 63.33 68.78 171.38 62.42 69.16 171.53 64.40 70.65 172.53 63.29 70.92 172.98 64.58 69.54 171.50 64.99 70.16 170.16 2 0 34.70-999 ?-999 ?-999 ? CA CA A1131 mASN.F 216 65.51 71.27 172.89 66.34 70.87 172.51 65.34 73.71 172.93 64.70 74.67 173.35 65.51 72.43 173.77 66.80 72.49 174.59 2 0 36.12-999 ?-999 ?-999 ? CA CA A1131 mLYS.F 217 65.94 73.69 171.75 66.36 72.81 171.51 64.93 74.77 169.77 64.61 73.68 169.30 65.97 74.86 170.88 67.36 75.01 170.24 2 0 35.41-999 ?-999 ?-999 ? CA CA A1131 mTHR~F 218 64.43 75.93 169.34 64.73 76.74 169.85 64.25 75.56 166.95 65.48 75.44 166.96 63.50 75.95 168.21 62.90 77.35 167.99 2 0 34.37-999 ?-999 ?-999 ? CA CA F1126 mILE~F 219 63.54 75.31 165.84 62.54 75.40 165.88 65.22 76.10 164.25 66.39 75.94 163.92 64.35 74.92 164.68 63.52 74.36 163.52 3 0 31.62-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 220 64.68 77.31 164.40 63.71 77.28 164.67 66.73 78.56 164.94 67.81 78.69 164.35 65.42 78.54 164.17 64.56 79.74 164.58 3 0 29.29-999 ?-999 ?-999 ? CA CA F1126 mGLN~F 221 66.63 78.43 166.26 65.70 78.37 166.60 68.72 77.22 166.69 69.94 77.33 166.62 67.82 78.37 167.11 67.42 78.16 168.57 2 0 30.78-999 ?-999 ?-999 ? CA CA F1126 mALA~F 222 68.06 76.10 166.39 67.06 76.12 166.46 69.63 75.29 164.71 70.83 75.07 164.59 68.86 74.94 165.97 67.96 73.72 165.77 2 0 30.79-999 ?-999 ?-999 ? CA CA F1126 mILE~F 223 68.93 75.87 163.73 67.96 76.04 163.91 70.72 77.24 162.72 71.83 77.10 162.19 69.64 76.20 162.50 68.64 76.63 161.41 3 0 27.09-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 224 70.44 78.27 163.50 69.50 78.28 163.84 72.73 78.65 164.33 73.83 78.88 163.84 71.43 79.30 163.83 70.90 80.24 164.91 2 0 26.35-999 ?-999 ?-999 ? CA CA F1126 mASN~F 225 72.57 77.77 165.31 71.61 77.59 165.52 74.54 76.29 165.08 75.77 76.31 165.17 73.66 77.12 166.00 73.09 76.21 167.09 2 0 28.55-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 226 73.90 75.54 164.20 72.92 75.76 164.16 75.19 75.03 162.14 76.11 74.43 161.59 74.50 74.50 163.38 73.38 73.53 162.97 2 0 25.96-999 ?-999 ?-999 ? CA CA A1131 mPHE~F 227 74.69 76.16 161.63 73.97 76.61 162.16 75.76 78.08 160.53 75.54 78.73 161.55 75.23 76.66 160.37 74.13 76.65 159.29 3 0 23.57-999 ?-999 ?-999 ? CA CA F1126 mSER~F 228 76.42 78.55 159.47 76.52 77.87 158.74 76.80 80.42 157.97 76.48 79.65 157.06 76.93 79.91 159.40 78.39 79.96 159.86 2 0 20.95-999 ?-999 ?-999 ? CA CA F1126 mGLY~F 229 77.05 81.71 157.78 77.21 82.22 158.62 75.86 82.07 155.60 74.74 81.96 156.09 77.08 82.34 156.48-999.99-999.99-999.99 1 0 17.32-999 ?-999 ?-999 ? CA CA F1126 mASP~F 230 76.12 82.01 154.30 77.10 82.01 154.11 74.07 80.89 153.51 72.88 81.17 153.61 75.14 81.94 153.24 75.83 81.68 151.90 2 0 15.01-999 ?-999 ?-999 ? CA CA F1126 mILE~F 231 74.51 79.63 153.61 75.50 79.51 153.53 72.75 78.75 155.09 71.56 78.39 155.15 73.56 78.54 153.83 74.35 77.22 153.84 3 0 17.73-999 ?-999 ?-999 ? CA CA F1126 mLYS~F 232 73.36 79.30 156.15 74.32 79.54 156.05 71.41 80.47 157.09 70.27 80.29 157.52 72.54 79.49 157.35 73.42 79.98 158.51 2 0 20.37-999 ?-999 ?-999 ? CA CA F1126 mASN~F 233 71.70 81.56 156.37 72.64 81.65 156.04 69.60 81.96 155.13 68.41 82.26 155.21 70.61 82.51 156.12 71.19 83.83 155.60 2 0 18.94-999 ?-999 ?-999 ? CA CA F1126 mGLY~F 234 70.07 81.17 154.15 71.06 81.04 154.11 68.12 79.66 153.96 66.90 79.75 153.76 69.10 80.57 153.24-999.99-999.99-999.99 1 0 18.28-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 235 68.62 78.75 154.81 69.61 78.74 154.91 66.78 78.65 156.44 65.58 78.42 156.48 67.70 77.86 155.51 68.43 76.79 156.32 3 0 21.89-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 236 67.37 79.61 157.16 68.35 79.70 157.03 65.46 81.13 157.28 64.33 81.22 157.75 66.56 80.42 158.06 67.43 81.42 158.81 3 0 23.26-999 ?-999 ?-999 ? CA CA F1126 mALA~F 237 65.77 81.62 156.08 66.72 81.47 155.78 63.63 81.38 154.92 62.46 81.75 154.81 64.76 82.32 155.29 65.34 82.96 154.04 2 0 21.76-999 ?-999 ?-999 ? CA CA F1126 mILE~F 238 63.95 80.09 154.75 64.91 79.82 154.83 61.94 79.07 155.68 60.71 79.20 155.60 62.81 79.21 154.45 63.24 77.85 153.87 3 0 23.66-999 ?-999 ?-999 ? CA CA F1126 mVAL~F 239 62.55 78.88 156.85 63.55 78.89 156.85 60.85 79.90 158.31 59.67 79.82 158.65 61.70 78.68 158.04 62.55 78.29 159.26 3 0 26.85-999 ?-999 ?-999 ? CA CA F1126 mLYS~F 240 61.44 81.08 158.10 62.38 81.04 157.79 59.56 82.53 157.35 58.51 83.07 157.70 60.71 82.33 158.32 61.69 83.50 158.25 2 0 26.59-999 ?-999 ?-999 ? CA CA F1126 mSER~F 241 59.74 82.12 156.10 60.61 81.67 155.92 57.49 81.45 155.40 56.35 81.73 155.05 58.69 82.34 155.09 59.20 82.01 153.68 2 0 26.12-999 ?-999 ?-999 ? CA CA F1126 mVAL~F 242 57.81 80.32 156.02 58.79 80.17 156.18 56.00 79.93 157.61 54.78 80.02 157.57 56.76 79.39 156.41 57.34 78.00 156.74 3 0 29.20-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 243 56.75 80.30 158.65 57.74 80.23 158.51 55.51 82.14 159.77 54.38 82.37 160.22 56.15 80.77 159.89 57.18 80.78 161.01 2 0 31.29-999 ?-999 ?-999 ? CA CA F1126 mASN~F 244 56.22 83.10 159.17 57.13 82.85 158.85 56.30 85.23 157.94 57.25 85.96 158.21 55.62 84.43 159.05 55.68 85.19 160.38 2 0 30.45-999 ?-999 ?-999 ? CA CA F1126 mARG~F 245 55.79 85.06 156.73 55.00 84.45 156.72 56.42 87.19 155.69 57.44 87.82 155.41 56.33 85.68 155.52 55.45 85.32 154.32 2 0 27.70-999 ?-999 ?-999 ? CA CA F1126 mPHE~F 246 55.33 87.77 156.19 54.56 87.15 156.37 56.46 89.57 157.38 57.09 90.62 157.23 55.31 89.20 156.45 53.97 89.61 157.07 3 0 28.90-999 ?-999 ?-999 ? CA CA F1126 mALA~F 247 56.70 88.70 158.36 56.13 87.87 158.34 59.12 88.99 158.73 59.94 89.85 159.04 57.73 88.96 159.36 57.68 87.94 160.49 2 0 28.72-999 ?-999 ?-999 ? CA CA F1126 mTYR~F 248 59.36 88.05 157.82 58.62 87.39 157.70 60.85 89.36 156.37 61.84 90.04 156.64 60.61 88.02 157.08 60.59 86.86 156.07 3 0 25.06-999 ?-999 ?-999 ? CA CA F1126 mPHE~F 249 59.96 89.78 155.48 59.17 89.19 155.35 60.34 92.22 155.75 61.17 93.11 155.54 60.18 91.06 154.79 59.03 91.35 153.82 3 0 24.06-999 ?-999 ?-999 ? CA CA F1126 mALA~F 250 59.55 92.23 156.82 58.93 91.45 156.92 61.05 93.46 158.32 61.64 94.54 158.33 59.63 93.35 157.76 58.63 93.18 158.88 2 0 26.64-999 ?-999 ?-999 ? CA CA F1126 mGLU~F 251 61.57 92.30 158.70 60.92 91.54 158.60 63.97 92.60 158.21 64.88 93.38 158.51 62.92 92.11 159.20 63.10 90.61 159.45 2 0 25.14-999 ?-999 ?-999 ? CA CA F1126 mARG~F 252 63.85 92.13 156.98 63.10 91.48 156.84 64.73 94.05 155.72 65.78 94.69 155.60 64.78 92.54 155.92 64.40 91.80 154.63 2 0 21.58-999 ?-999 ?-999 ? CA CA F1126 mLEU~F 253 63.51 94.58 155.72 62.78 93.92 155.87 64.00 96.81 156.63 64.74 97.76 156.36 63.28 96.02 155.54 61.79 96.37 155.52 3 0 23.21-999 ?-999 ?-999 ? CA CA F1126 mHIS~F 254 63.75 96.37 157.86 63.09 95.63 157.90 65.91 96.86 158.88 66.66 97.77 159.24 64.40 96.92 159.04 63.99 96.11 160.28 3 0 25.21-999 ?-999 ?-999 ? CA CA F1126 mHIS~F 255 66.36 95.72 158.34 65.67 95.07 158.05 68.37 96.51 157.19 69.39 97.15 157.40 67.81 95.54 158.22 68.13 94.08 157.88 3 0 22.22-999 ?-999 ?-999 ? CA CA F1126 mALA~F 256 67.68 96.66 156.07 66.84 96.12 156.01 68.39 98.97 155.52 69.32 99.65 155.07 68.15 97.55 155.02 67.17 97.53 153.86 2 0 20.36-999 ?-999 ?-999 ? CA CA F1126 mMET~F 257 67.59 99.44 156.47 66.97 98.76 156.85 68.43 101.03 158.19 68.58 102.17 158.64 67.65 100.83 156.90 66.23 101.39 157.08 2 0 23.51-999 ?-999 ?-999 ? CA CA F1126 mLYS~F 258 68.89 99.96 158.82 68.68 99.07 158.40 71.10 100.48 159.73 71.55 100.27 158.60 69.65 100.15 160.06 69.56 98.93 160.97 2 0 24.64-999 ?-999 ?-999 ? CA CA F1126 mGLY.F 259 71.82 100.98 160.72 71.30 101.10 161.57 73.47 102.73 160.13 72.62 103.61 160.29 73.22 101.31 160.60-999.99-999.99-999.99 1 0 24.48-999 ?-999 ?-999 ? CA CA F1126 mLEU.F 260 74.67 102.96 159.60 75.27 102.17 159.59 75.00 104.28 157.54 76.03 104.44 156.87 75.05 104.26 159.07 76.46 104.68 159.55 3 0 24.57-999 ?-999 ?-999 ? CA CA F1126 mGLY.F 261 73.78 104.13 157.03 73.08 104.02 157.74 72.14 103.43 155.32 71.29 103.27 156.20 73.46 104.12 155.62-999.99-999.99-999.99 1 0 22.36-999 ?-999 ?-999 ? CA CA F1126 mTHR.F 262 71.97 103.03 154.06 72.73 103.24 153.45 71.08 101.31 152.55 71.61 101.65 151.49 70.77 102.34 153.62 69.76 103.35 153.00 2 0 20.30-999 ?-999 ?-999 ? CA CA C1123 mSER~F 263 70.70 100.05 152.74 70.36 99.80 153.65 69.62 99.43 150.67 68.57 98.81 150.74 70.81 99.15 151.59 70.88 97.68 151.98 2 0 17.46-999 ?-999 ?-999 ? CA CA F1126 mASP~F 264 69.81 100.46 149.84 70.73 100.85 149.85 68.22 99.91 148.00 67.03 99.83 147.70 68.72 100.94 148.99 69.15 102.24 148.30 2 0 15.66-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 265 69.11 99.07 147.47 70.06 99.17 147.78 67.68 97.09 147.16 66.70 96.66 146.55 68.64 98.07 146.51 69.82 97.36 145.87 2 0 13.15-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 266 67.94 96.73 148.41 68.76 97.15 148.81 65.75 96.50 149.44 64.69 95.93 149.22 67.06 95.80 149.12 67.69 95.30 150.44 2 0 16.33-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 267 65.87 97.75 149.91 66.82 98.05 150.03 63.77 98.72 149.05 62.56 98.56 149.21 64.72 98.58 150.23 65.19 99.95 150.71 3 0 17.73-999 ?-999 ?-999 ? CA CA C1123 mILE~F 268 64.30 99.04 147.88 65.29 99.16 147.91 62.92 97.88 146.21 61.72 97.82 145.89 63.51 99.20 146.66 64.34 99.82 145.52 3 0 14.97-999 ?-999 ?-999 ? CA CA C1123 mARG~F 269 63.75 96.83 146.20 64.69 97.03 146.49 62.12 95.01 146.63 61.15 94.43 146.13 63.28 95.51 145.79 64.41 94.46 145.84 2 0 14.78-999 ?-999 ?-999 ? CA CA C1123 mILE~F 270 62.17 95.20 147.96 62.97 95.68 148.33 59.79 95.51 148.60 58.70 94.98 148.42 61.05 94.67 148.75 61.42 94.51 150.23 3 0 18.56-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 271 59.93 96.83 148.70 60.87 97.13 148.85 58.13 97.56 147.21 56.91 97.40 147.07 58.76 97.71 148.58 59.15 99.17 148.84 3 0 19.27-999 ?-999 ?-999 ? CA CA C1123 mVAL~F 272 58.94 97.59 146.15 59.92 97.70 146.33 57.69 96.11 144.60 56.52 96.00 144.20 58.31 97.48 144.83 59.30 97.80 143.70 3 0 16.87-999 ?-999 ?-999 ? CA CA C1123 mSER~F 273 58.45 95.03 144.81 59.34 95.19 145.23 56.72 93.31 145.24 55.94 92.44 144.82 57.92 93.72 144.42 59.01 92.64 144.54 2 0 17.66-999 ?-999 ?-999 ? CA CA C1123 mARG~F 274 56.54 93.90 146.43 57.20 94.62 146.65 54.30 94.49 147.29 53.28 94.29 147.95 55.44 93.47 147.29 55.92 93.26 148.73 2 0 21.34-999 ?-999 ?-999 ? CA CA C1123 mSER~F 275 54.51 95.59 146.59 55.37 95.59 146.07 52.15 96.26 146.21 51.19 96.87 146.69 53.57 96.69 146.57 54.06 97.79 145.62 2 0 21.70-999 ?-999 ?-999 ? CA CA C1123 mGLU.F 276 51.97 95.26 145.35 52.81 94.83 145.02 50.33 93.43 145.45 49.52 92.71 144.85 50.62 94.85 144.97 50.42 94.97 143.46 2 0 23.54-999 ?-999 ?-999 ? CA CA C1123 mILE.F 277 51.00 93.04 146.52 51.59 93.76 146.91 50.57 91.72 148.58 49.45 91.38 148.98 50.89 91.71 147.09 52.19 90.90 146.87 3 0 25.16-999 ?-999 ?-999 ? CA CA C1123 mASP~F 278 51.52 92.09 149.43 52.39 92.36 149.01 51.94 93.20 151.60 52.16 93.12 152.82 51.25 92.07 150.86 51.68 90.74 151.47 2 0 27.01-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 279 52.28 94.29 150.91 52.05 94.30 149.94 52.11 95.91 152.76 52.59 96.43 153.78 52.98 95.36 151.64 53.39 96.46 150.66 3 0 25.64-999 ?-999 ?-999 ? CA CA C1123 mALA~F 280 50.79 95.79 152.59 50.51 95.40 151.71 50.13 95.38 154.90 50.40 95.88 155.99 49.88 96.21 153.65 48.44 96.07 153.17 2 0 29.12-999 ?-999 ?-999 ? CA CA C1123 mASN~F 281 50.08 94.06 154.74 49.89 93.73 153.82 51.70 93.33 156.43 51.91 93.38 157.64 50.28 93.21 155.91 49.91 91.77 155.57 2 0 30.88-999 ?-999 ?-999 ? CA CA C1123 mILE~F 282 52.66 93.45 155.51 52.35 93.37 154.56 54.17 94.99 156.71 54.91 95.02 157.70 54.04 93.70 155.90 54.96 93.78 154.67 3 0 28.42-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 283 53.47 96.04 156.30 52.94 95.90 155.47 52.99 97.09 158.47 53.55 97.62 159.43 53.49 97.31 157.04 52.60 98.35 156.36 2 0 29.20-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 284 51.93 96.31 158.61 51.58 95.93 157.75 52.34 95.33 160.85 52.57 95.75 161.98 51.35 96.04 159.92 50.10 95.17 159.76 2 0 32.87-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 285 52.91 94.25 160.34 52.61 94.05 159.40 55.08 94.25 161.51 55.60 94.06 162.61 53.87 93.44 161.07 54.28 92.25 160.18 2 0 32.77-999 ?-999 ?-999 ? CA CA C1123 mPHE~F 286 55.55 95.17 160.67 55.03 95.24 159.82 56.48 96.81 162.24 57.36 96.89 163.10 56.71 96.00 160.96 56.99 96.95 159.79 3 0 30.95-999 ?-999 ?-999 ? CA CA C1123 mGLN~F 287 55.33 97.46 162.31 54.75 97.30 161.51 54.79 97.46 164.67 55.30 97.78 165.74 54.96 98.33 163.43 53.68 99.08 163.07 2 0 33.79-999 ?-999 ?-999 ? CA CA C1123 mALA~F 288 54.15 96.31 164.50 53.75 96.20 163.59 55.44 94.97 166.10 55.69 95.12 167.29 54.05 95.32 165.56 53.36 94.05 165.07 2 0 36.24-999 ?-999 ?-999 ? CA CA F1126 mMET~F 289 56.34 94.55 165.22 56.03 94.50 164.28 58.52 95.41 166.06 59.44 95.29 166.88 57.69 94.20 165.67 58.45 93.43 164.59 2 0 33.67-999 ?-999 ?-999 ? CA CA F1126 mTYR~F 290 58.31 96.57 165.46 57.50 96.64 164.86 58.70 98.82 166.47 59.46 99.67 166.96 59.28 97.64 165.72 59.95 98.06 164.40 3 0 33.46-999 ?-999 ?-999 ? CA CA F1126 mGLY~F 291 57.38 98.88 166.59 56.89 98.15 166.12 56.74 101.27 166.63 56.18 102.24 167.14 56.72 99.93 167.34-999.99-999.99-999.99 1 0 36.58-999 ?-999 ?-999 ? CA CA C1123 mLYS.F 292 57.38 101.33 165.48 57.82 100.46 165.24 56.95 102.14 163.24 57.12 100.99 162.83 57.46 102.52 164.63 58.88 103.04 164.55 2 0 33.96-999 ?-999 ?-999 ? CA CA C1123 mSER~F 293 56.31 103.07 162.53 56.25 103.98 162.93 56.84 102.55 160.17 57.88 103.18 160.25 55.75 102.68 161.23 54.66 103.65 160.77 2 0 31.67-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 294 56.56 101.70 159.18 55.69 101.21 159.30 57.62 102.86 157.32 58.73 103.24 156.98 57.43 101.52 158.04 56.87 100.51 157.04 3 0 27.96-999 ?-999 ?-999 ? CA CA C1123 mTYR~F 295 56.50 103.56 157.15 55.66 103.09 157.41 57.56 105.78 157.38 58.41 106.45 156.79 56.55 104.93 156.62 55.16 105.56 156.70 3 0 27.70-999 ?-999 ?-999 ? CA CA C1123 mGLU~F 296 57.44 105.84 158.71 56.74 105.27 159.12 59.80 106.32 159.23 60.65 107.19 159.02 58.35 106.73 159.44 58.06 106.76 160.93 2 0 29.68-999 ?-999 ?-999 ? CA CA C1123 mPHE~F 297 60.07 105.02 159.33 59.29 104.44 159.54 62.01 105.00 157.80 63.15 105.46 157.70 61.44 104.54 159.14 61.48 103.02 159.21 3 0 27.75-999 ?-999 ?-999 ? CA CA C1123 mILE~F 298 61.19 104.86 156.76 60.30 104.45 156.97 61.81 106.80 155.40 62.81 107.30 154.87 61.63 105.28 155.43 60.62 104.83 154.37 3 0 24.48-999 ?-999 ?-999 ? CA CA C1123 mALA~F 299 60.84 107.52 155.97 60.07 107.00 156.34 62.29 109.34 156.71 63.06 110.18 156.24 60.99 108.98 156.01 59.80 109.62 156.71 2 0 26.39-999 ?-999 ?-999 ? CA CA C1123 mASP~F 300 62.58 108.61 157.79 61.90 107.93 158.03 65.05 108.50 157.71 66.07 109.19 157.79 63.81 108.82 158.53 63.78 107.94 159.79 2 0 27.66-999 ?-999 ?-999 ? CA CA C1123 mASP~F 301 65.00 107.41 156.94 64.10 106.98 156.86 66.37 107.45 154.87 67.51 107.45 154.37 66.20 106.94 156.29 66.23 105.41 156.30 2 0 24.45-999 ?-999 ?-999 ? CA CA C1123 mCYH~F 302 65.31 107.91 154.19 64.42 107.89 154.65 65.43 109.89 152.70 64.87 110.56 153.58 65.59 108.39 152.83 64.70 107.67 151.82 2 0 21.99-999 ?-999 ?-999 ? CA CA C1123 mSER~F 303 65.87 110.42 151.56 66.33 109.76 150.95 65.31 112.05 149.79 65.38 111.15 148.95 65.70 111.83 151.25 66.99 112.59 151.56 2 0 22.35-999 ?-999 ?-999 ? CA CA C1123 mGLY~F 304 64.91 113.29 149.49 64.85 113.89 150.29 63.44 113.06 147.49 62.50 112.56 148.13 64.60 113.75 148.16-999.99-999.99-999.99 1 0 21.56-999 ?-999 ?-999 ? CA CA C1123 mASP~F 305 63.46 113.07 146.15 64.26 113.51 145.75 62.36 110.97 145.56 61.36 110.28 145.40 62.37 112.48 145.37 62.49 112.86 143.90 2 0 19.70-999 ?-999 ?-999 ? CA CA C1123 mTYR~F 306 63.51 110.41 145.92 64.28 111.05 146.00 62.69 108.61 147.34 61.77 107.80 147.25 63.60 108.97 146.17 65.04 108.60 146.46 3 0 17.52-999 ?-999 ?-999 ? CA CA C1123 mLYS~F 307 62.94 109.31 148.46 63.72 109.93 148.39 60.68 109.38 149.32 59.83 108.55 149.63 62.14 109.15 149.66 62.62 110.13 150.74 2 0 20.83-999 ?-999 ?-999 ? CA CA C1123 mASP~F 308 60.41 110.51 148.66 61.21 111.07 148.46 58.36 109.71 147.56 57.31 109.22 147.97 59.04 110.86 148.29 59.01 112.14 147.45 2 0 22.18-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 309 59.00 109.23 146.50 59.83 109.73 146.27 58.23 106.89 146.65 57.17 106.27 146.55 58.52 108.08 145.74 59.56 107.70 144.68 3 0 19.45-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 310 59.17 106.54 147.52 59.97 107.14 147.56 57.88 105.53 149.36 57.11 104.61 149.69 58.99 105.34 148.34 60.30 105.00 149.07 3 0 19.89-999 ?-999 ?-999 ? CA CA C1123 mLEU~F 311 57.81 106.74 149.91 58.51 107.39 149.64 55.39 106.88 150.16 54.44 106.26 150.65 56.72 107.00 150.86 56.92 108.37 151.51 3 0 23.63-999 ?-999 ?-999 ? CA CA C1123 mGLN~F 312 55.29 107.42 148.93 56.12 107.85 148.57 53.65 105.89 147.93 52.47 105.52 147.96 54.02 107.32 148.23 54.05 108.15 146.95 2 0 23.72-999 ?-999 ?-999 ? CA CA C1123 mILE~F 313 54.63 105.04 147.60 55.55 105.43 147.61 53.76 102.91 148.48 52.77 102.19 148.39 54.31 103.66 147.26 55.56 102.93 146.73 3 0 21.88-999 ?-999 ?-999 ? CA CA C1123 mTHR~F 314 54.44 103.10 149.59 55.18 103.76 149.46 52.86 102.87 151.50 52.05 102.03 151.89 54.19 102.46 150.87 55.32 102.78 151.86 2 0 24.19-999 ?-999 ?-999 ? CA CA C1123 mGLY~F 315 52.65 104.18 151.64 53.35 104.77 151.26 51.70 104.75 153.81 52.52 103.99 154.32 51.45 104.66 152.31-999.99-999.99-999.99 1 0 27.48-999 ?-999 ?-999 ? CA CA C1123 mHIS.F 316 51.02 105.67 154.48 50.38 106.21 153.93 51.06 104.56 156.69 51.92 104.30 157.57 51.23 105.86 155.91 50.30 106.95 156.46 3 0 30.43-999 ?-999 ?-999 ? CA CA C1123