REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 19-JUL-06 2HQY COMPND CONSERVED HYPOTHETICAL PROTEIN; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; SOURCE 3 ORGANISM_TAXID: 226186; SOURCE 4 STRAIN: VPI-5482; SOURCE 5 GENE: BT_3689; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PMCSG7 AUTHOR B.NOCEK,M.BOROVILOS,J.ABDULLAH,A.JOACHIMIAK,MIDWEST CENTER FOR AUTHOR 2 STRUCTURAL GENOMICS (MCSG) HET COA A1001 48 SSBOND 1 CYS A 92 CYS A 294 1555 1555 2.16 SSBOND 2 CYS A 176 CYS A 181 1555 1555 2.18 SSBOND 3 CYS B 92 CYS B 294 1555 1555 2.12 SSBOND 4 CYS B 176 CYS B 181 1555 1555 2.05 SITE 1 AC1 15 TRP A 175 ASN A 179 THR A 187 GLU A 190 >MET.A 1 45.89 57.65 -10.02 45.14 61.19 -11.72 45.52 59.42 -10.87 2 0 39.39 -999 ? N6A COA A1001 >ILE.A 2 43.38 56.31 -6.01 42.09 56.29 -5.35 42.74 56.30 -5.68 3 0 31.37 -999 ? N6A COA A1001 >PRO.A 3 47.52 58.73 -3.68 47.32 56.86 -4.93 47.42 57.80 -4.31 3 0 33.13 -999 ? N6A COA A1001 >PHE.A 4 44.44 52.70 -3.13 41.68 53.28 -3.23 43.06 52.99 -3.18 3 0 27.47 -999 ? N6A COA A1001 >LYS^A 5 49.22 52.44 -0.03 50.58 57.08 2.99 49.90 54.76 1.48 2 0 30.24 -999 ? N1A COA A1001 >ASP^A 6 50.55 48.40 2.28 50.89 47.45 0.44 50.72 47.92 1.36 2 0 25.27 -999 ? N6A COA A1001 >ILE.A 7 46.72 49.83 6.28 45.85 49.46 7.34 46.28 49.64 6.81 3 0 20.85 -999 ? N1A COA A1001 >THR~A 8 50.77 50.06 8.47 52.45 50.88 7.32 51.61 50.47 7.89 2 0 25.12 -999 ? N1A COA A1001 >LEU~A 9 52.42 50.20 13.00 52.35 48.31 14.00 52.38 49.25 13.50 3 0 22.56 -999 ? N1A COA A1001 >ALA~A 10 52.86 54.14 11.20 54.07 54.27 10.26 53.46 54.21 10.73 2 0 27.78 -999 ? N1A COA A1001 >ASP~A 11 48.94 54.63 8.50 50.35 54.36 6.97 49.65 54.50 7.73 2 0 26.51 -999 ? N1A COA A1001 >ARG~A 12 48.05 54.66 16.76 48.39 54.93 19.77 48.22 54.79 18.26 2 0 24.46 -999 ? C2A COA A1001 >ASP~A 13 48.87 60.29 13.44 49.84 60.11 15.34 49.35 60.20 14.39 2 0 29.62 -999 ? C2A COA A1001 >THR~A 14 46.59 59.74 9.63 47.61 59.67 7.69 47.10 59.70 8.66 2 0 29.42 -999 ? N1A COA A1001 >ILE~A 15 43.78 55.75 9.80 43.73 54.58 9.25 43.76 55.16 9.53 3 0 23.50 -999 ? N1A COA A1001 >THR~A 16 42.39 58.15 13.37 43.76 57.33 14.84 43.07 57.74 14.10 2 0 24.71 -999 ? N1A COA A1001 >ALA~A 17 42.34 61.85 12.43 43.38 62.62 11.66 42.86 62.23 12.04 2 0 29.95 -999 ? N1A COA A1001 >PHE~A 18 40.26 61.05 7.64 41.31 62.69 5.59 40.79 61.87 6.62 3 0 29.85 -999 ? N1A COA A1001 >THR~A 19 37.76 58.13 12.05 38.98 56.31 11.96 38.37 57.22 12.00 2 0 22.95 -999 ? N1A COA A1001 >MET~A 20 37.68 59.65 15.55 38.98 57.58 17.89 38.33 58.61 16.72 2 0 23.89 -999 ? C2A COA A1001 >LYS.A 21 35.70 62.73 14.46 36.72 64.74 9.19 36.21 63.73 11.82 2 0 31.58 -999 ? N1A COA A1001 >SER.A 22 33.35 60.66 12.26 33.94 58.32 11.94 33.65 59.49 12.10 2 0 24.84 -999 ? N1A COA A1001 >ASP.A 23 28.67 60.09 13.16 28.64 61.75 14.56 28.65 60.92 13.86 2 0 28.86 -999 ? N1A COA A1001 >ARG.A 24 30.68 56.03 8.77 32.20 55.33 6.20 31.44 55.68 7.48 2 0 23.81 -999 ? N6A COA A1001 >ARG.A 25 27.94 54.54 16.99 25.03 53.66 17.48 26.49 54.10 17.24 2 0 22.69 -999 ? N1A COA A1001 >ASN~A 26 31.00 49.58 11.37 32.13 50.41 9.84 31.57 50.00 10.61 2 0 18.02 -999 ? N1A COA A1001 >CYH~A 27 34.29 47.79 14.12 33.69 45.06 13.68 33.99 46.43 13.90 2 0 11.63 -999 ? N1A COA A1001 >ASP~A 28 35.31 47.14 9.40 34.57 45.15 9.45 34.94 46.14 9.42 2 0 12.96 -999 ? N6A COA A1001 >LEU~A 29 36.17 52.34 11.06 35.57 53.18 9.15 35.87 52.76 10.10 3 0 19.73 -999 ? N1A COA A1001 >SER~A 30 39.19 50.35 14.28 40.26 48.93 15.84 39.73 49.64 15.06 2 0 15.63 -999 ? N1A COA A1001 >PHE~A 31 45.09 52.14 13.47 47.69 52.14 12.35 46.39 52.14 12.91 3 0 21.19 -999 ? N1A COA A1001 >SER~A 32 43.82 47.74 15.14 44.14 46.02 16.80 43.98 46.88 15.97 2 0 14.50 -999 ? C2A COA A1001 >ASN~A 33 39.75 45.90 13.13 38.85 44.90 14.77 39.30 45.40 13.95 2 0 11.42 -999 ? N1A COA A1001 >LEU~A 34 42.48 48.98 9.58 40.81 50.17 8.80 41.65 49.58 9.19 3 0 17.94 -999 ? N1A COA A1001 >CYH~A 35 46.13 46.56 10.46 47.38 48.95 11.15 46.75 47.76 10.80 2 0 19.43 -999 ? N1A COA A1001 >SER~A 36 45.63 43.14 12.05 43.70 42.97 13.49 44.67 43.05 12.77 2 0 12.12 -999 ? N1A COA A1001 >TRP~A 37 41.01 41.80 11.69 40.00 38.03 11.05 40.50 39.92 11.37 3 0 8.74 -999 ? N1A COA A1001 >ARG~A 38 48.76 45.45 5.69 51.06 45.08 7.71 49.91 45.27 6.70 2 0 20.43 -999 ? N1A COA A1001 >PHE~A 39 46.44 38.03 7.88 44.13 36.66 8.88 45.29 37.34 8.38 3 0 12.35 -999 ? N6A COA A1001 >LEU~A 40 42.61 38.21 5.73 41.27 36.49 5.51 41.94 37.35 5.62 3 0 11.57 -999 ? N6A COA A1001 >TYR~A 41 40.62 41.56 3.99 38.65 40.13 5.40 39.64 40.85 4.70 3 0 12.91 -999 ? N6A COA A1001 >ASP~A 42 46.14 42.56 -0.11 47.18 40.71 -0.29 46.66 41.64 -0.20 2 0 20.14 -999 ? N6A COA A1001 >THR.A 43 44.38 46.23 2.76 43.10 46.32 4.48 43.74 46.28 3.62 2 0 18.17 -999 ? N6A COA A1001 >GLN^A 44 46.69 48.51 -0.53 47.31 48.41 -2.59 47.00 48.46 -1.56 2 0 25.65 -999 ? N6A COA A1001 >PHE^A 45 45.36 54.25 3.95 47.72 55.44 4.89 46.54 54.84 4.42 3 0 26.08 -999 ? N1A COA A1001 >ALA^A 46 44.37 56.65 0.44 44.26 56.62 -1.07 44.31 56.63 -0.31 2 0 29.42 -999 ? N6A COA A1001 >VAL^A 47 43.29 60.14 1.24 43.55 61.42 3.00 43.42 60.78 2.12 3 0 31.09 -999 ? N1A COA A1001 >ILE^A 48 41.30 60.55 -3.02 41.15 59.36 -3.66 41.22 59.95 -3.34 3 0 32.58 -999 ? N6A COA A1001 >ASP.A 49 38.19 64.08 -2.96 38.50 64.15 -5.10 38.35 64.11 -4.03 2 0 36.65 -999 ? N6A COA A1001 >ASP.A 50 38.62 66.42 1.98 39.83 68.19 1.74 39.23 67.31 1.86 2 0 37.28 -999 ? N1A COA A1001 >PHE^A 51 35.75 61.67 1.21 33.28 62.96 0.80 34.52 62.31 1.01 3 0 32.04 -999 ? N6A COA A1001 >LEU^A 52 39.89 58.28 5.28 41.21 56.84 6.21 40.55 57.56 5.75 3 0 26.13 -999 ? N1A COA A1001 >VAL^A 53 39.21 55.50 1.50 39.10 56.68 -0.37 39.15 56.09 0.57 3 0 26.97 -999 ? N6A COA A1001 >PHE^A 54 40.19 51.86 4.46 41.05 53.29 6.76 40.62 52.57 5.61 3 0 21.79 -999 ? N1A COA A1001 >LYS^A 55 40.60 49.07 -0.74 43.33 49.40 -6.51 41.96 49.23 -3.63 2 0 27.44 -999 ? N6A COA A1001 >PHE^A 56 39.10 45.84 2.27 38.67 47.62 4.42 38.89 46.73 3.34 3 0 17.72 -999 ? N6A COA A1001 >TRP^A 57 43.24 43.62 -3.35 41.60 43.11 -6.90 42.42 43.36 -5.12 3 0 22.85 -999 ? N6A COA A1001 >ALA^A 58 38.25 39.59 -0.10 36.85 40.01 0.34 37.55 39.80 0.12 2 0 15.36 -999 ? N6A COA A1001 >GLY.A 59 39.38 36.57 -2.06 39.26 37.42 -2.22 39.32 36.99 -2.14 1 0 16.89 -999 ? N6A COA A1001 >GLU.A 60 36.68 35.77 -6.82 36.63 34.12 -8.22 36.66 34.95 -7.52 2 0 22.19 -999 ? N6A COA A1001 >GLN^A 61 34.05 41.18 -3.10 32.61 41.53 -4.67 33.33 41.36 -3.88 2 0 20.58 -999 ? N6A COA A1001 >LEU^A 62 37.91 44.37 -6.13 39.09 46.22 -6.28 38.50 45.29 -6.21 3 0 23.80 -999 ? N6A COA A1001 >ALA^A 63 35.83 45.97 -2.36 35.13 45.20 -1.26 35.48 45.59 -1.81 2 0 19.46 -999 ? N6A COA A1001 >TYR^A 64 36.77 50.47 -3.33 38.33 50.03 -5.64 37.55 50.25 -4.49 3 0 25.33 -999 ? N6A COA A1001 >MET^A 65 34.80 50.94 2.23 34.22 50.03 5.61 34.51 50.48 3.92 2 0 18.96 -999 ? N6A COA A1001 >MET.A 66 32.23 53.76 2.29 29.29 55.48 1.47 30.76 54.62 1.88 2 0 26.35 -999 ? N6A COA A1001 >PRO.A 67 33.93 56.99 -0.12 34.01 56.37 2.04 33.97 56.68 0.96 3 0 27.02 -999 ? N6A COA A1001 >VAL^A 68 35.08 58.51 5.60 35.67 57.43 7.43 35.37 57.97 6.51 3 0 25.84 -999 ? N1A COA A1001 >GLY^A 69 34.93 62.31 5.76 34.20 62.00 5.51 34.56 62.15 5.64 1 0 30.18 -999 ? N1A COA A1001 >ASN.A 70 32.77 66.35 5.50 32.02 65.47 7.31 32.40 65.91 6.40 2 0 32.97 -999 ? N1A COA A1001 >GLY.A 71 33.19 66.65 0.96 32.52 66.12 1.01 32.85 66.39 0.98 1 0 36.10 -999 ? N1A COA A1001 >ASP~A 72 32.64 66.64 -3.74 31.43 66.47 -5.45 32.04 66.56 -4.59 2 0 38.84 -999 ? N6A COA A1001 >LEU~A 73 29.74 61.86 -1.29 29.48 59.85 -0.43 29.61 60.85 -0.86 3 0 32.01 -999 ? N6A COA A1001 >LYS~A 74 29.92 62.05 -5.79 24.96 63.78 -8.09 27.44 62.92 -6.94 2 0 39.17 -999 ? N6A COA A1001 >ALA~A 75 33.38 63.16 -6.96 34.05 64.49 -6.66 33.72 63.82 -6.81 2 0 37.63 -999 ? N6A COA A1001 >VAL~A 76 35.15 60.67 -4.71 35.36 60.16 -2.58 35.26 60.41 -3.65 3 0 32.55 -999 ? N6A COA A1001 >LEU~A 77 31.36 57.70 -5.55 30.56 56.87 -3.69 30.96 57.28 -4.62 3 0 30.82 -999 ? N6A COA A1001 >ARG~A 78 33.38 61.30 -12.24 31.53 62.86 -14.13 32.46 62.08 -13.18 2 0 41.11 -999 ? N6A COA A1001 >LYS~A 79 37.35 58.22 -8.62 40.10 63.64 -7.59 38.73 60.93 -8.10 2 0 37.76 -999 ? N6A COA A1001 >LEU~A 80 35.99 54.66 -5.53 36.76 55.05 -3.52 36.38 54.85 -4.53 3 0 28.62 -999 ? N6A COA A1001 >ILE~A 81 33.30 54.16 -10.30 31.95 54.24 -10.49 32.62 54.20 -10.40 3 0 32.34 -999 ? N6A COA A1001 >GLU~A 82 37.14 56.69 -13.27 37.43 58.80 -13.08 37.29 57.74 -13.18 2 0 37.40 -999 ? N6A COA A1001 >ASP~A 83 40.11 52.84 -8.36 41.86 51.89 -7.70 40.98 52.37 -8.03 2 0 29.47 -999 ? N6A COA A1001 >ALA~A 84 37.58 49.49 -9.95 36.17 49.42 -9.45 36.88 49.46 -9.70 2 0 28.56 -999 ? N6A COA A1001 >ASP~A 85 37.12 51.08 -14.59 35.07 51.61 -14.49 36.09 51.35 -14.54 2 0 33.95 -999 ? N6A COA A1001 >LYS~A 86 41.30 49.75 -13.80 45.40 49.78 -9.74 43.35 49.76 -11.77 2 0 30.75 -999 ? N6A COA A1001 >GLU~A 87 41.67 47.47 -9.37 43.68 46.78 -9.13 42.68 47.13 -9.25 2 0 28.17 -999 ? N6A COA A1001 >LYS~A 88 38.62 45.12 -14.20 41.22 45.78 -18.68 39.92 45.45 -16.44 2 0 35.52 -999 ? N6A COA A1001 >HIS.A 89 37.52 43.00 -9.97 38.51 41.16 -9.79 38.01 42.08 -9.88 3 0 25.61 -999 ? N6A COA A1001 >ASN.A 90 31.30 45.14 -10.83 31.00 44.09 -12.66 31.15 44.61 -11.75 2 0 29.07 -999 ? N6A COA A1001 >PHE.A 91 32.57 50.97 -7.07 32.76 52.59 -4.76 32.67 51.78 -5.92 3 0 27.41 -999 ? N6A COA A1001 >CSS^A 92 31.31 47.34 -4.68 30.38 44.94 -5.78 30.84 46.14 -5.23 2 0 23.49 -999 ? N6A COA A1001 >MET^A 93 31.43 49.11 -1.32 31.01 53.25 -1.43 31.22 51.18 -1.38 2 0 25.73 -999 ? N6A COA A1001 >LEU^A 94 32.37 46.59 2.54 32.61 44.58 1.77 32.49 45.59 2.15 3 0 17.42 -999 ? N6A COA A1001 >GLY^A 95 30.20 48.86 5.60 29.84 49.06 4.90 30.02 48.96 5.25 1 0 18.57 -999 ? N6A COA A1001 >VAL^A 96 27.43 50.99 4.22 26.93 51.48 2.16 27.18 51.23 3.19 3 0 22.59 -999 ? N6A COA A1001 >CYH~A 97 25.30 51.66 7.28 27.04 51.94 9.42 26.17 51.80 8.35 2 0 21.08 -999 ? N6A COA A1001 >SER~A 98 21.57 52.31 7.06 19.57 51.10 7.70 20.57 51.71 7.38 2 0 24.67 -999 ? N6A COA A1001 >ASN~A 99 22.86 56.79 8.53 22.77 58.91 8.34 22.82 57.85 8.43 2 0 29.25 -999 ? N6A COA A1001 >MET~A 100 25.16 55.91 4.76 28.05 57.32 5.95 26.61 56.62 5.36 2 0 26.56 -999 ? N6A COA A1001 >ARG~A 101 20.31 51.02 2.14 18.16 49.09 1.06 19.23 50.05 1.60 2 0 26.68 -999 ? N6A COA A1001 >ALA~A 102 20.37 56.91 2.64 19.72 57.41 3.93 20.04 57.16 3.29 2 0 30.55 -999 ? N6A COA A1001 >ASP~A 103 24.49 59.46 2.53 24.20 59.99 4.58 24.35 59.72 3.55 2 0 30.58 -999 ? N6A COA A1001 >LEU~A 104 24.51 55.76 -1.24 26.49 55.00 -1.35 25.50 55.38 -1.30 3 0 28.72 -999 ? N6A COA A1001 >GLU~A 105 18.23 55.80 -2.69 18.65 54.43 -4.25 18.44 55.11 -3.47 2 0 32.56 -999 ? N6A COA A1001 >ALA~A 106 20.21 60.74 -2.35 20.41 61.56 -1.07 20.31 61.15 -1.71 2 0 35.45 -999 ? N6A COA A1001 >ILE~A 107 24.75 61.78 -3.93 25.85 61.52 -3.28 25.30 61.65 -3.61 3 0 34.99 -999 ? N6A COA A1001 >LEU~A 108 24.42 57.78 -6.80 26.10 57.92 -7.84 25.26 57.85 -7.32 3 0 34.14 -999 ? N6A COA A1001 >PRO.A 109 18.91 59.64 -7.03 20.06 57.70 -6.99 19.48 58.67 -7.01 3 0 36.62 -999 ? N6A COA A1001 >GLU.A 110 16.52 53.74 -7.46 14.78 52.67 -8.07 15.65 53.20 -7.76 2 0 35.82 -999 ? N6A COA A1001 >ARG.A 111 23.22 55.29 -11.56 25.44 56.76 -13.61 24.33 56.03 -12.58 2 0 37.62 -999 ? N6A COA A1001 >PHE^A 112 25.32 52.04 -5.44 27.70 53.47 -5.86 26.51 52.76 -5.65 3 0 29.10 -999 ? N6A COA A1001 >ILE^A 113 22.43 45.92 -6.41 22.10 44.82 -7.16 22.26 45.37 -6.79 3 0 27.32 -999 ? N6A COA A1001 >PHE^A 114 21.86 49.36 -1.23 22.57 52.01 -1.80 22.21 50.69 -1.51 3 0 26.78 -999 ? N6A COA A1001 >THR^A 115 22.56 43.50 -0.10 23.67 42.46 -1.65 23.12 42.98 -0.87 2 0 21.50 -999 ? N6A COA A1001 >GLU^A 116 22.07 43.81 5.80 21.20 42.40 7.10 21.64 43.11 6.45 2 0 18.12 -999 ? N6A COA A1001 >ASP.A 117 25.29 38.98 5.07 25.44 36.95 5.75 25.36 37.97 5.41 2 0 13.26 -999 ? N6A COA A1001 >ARG~A 118 21.26 40.29 11.80 22.33 39.55 14.58 21.80 39.92 13.19 2 0 14.25 -999 ? O1A COA A1001 >ALA~A 119 26.03 37.53 10.04 26.58 36.47 9.12 26.31 37.00 9.58 2 0 10.38 -999 ? N6A COA A1001 >TYR~A 120 29.18 39.79 7.64 30.13 37.46 6.49 29.66 38.62 7.07 3 0 10.40 -999 ? N6A COA A1001 >ALA~A 121 26.03 43.14 11.77 24.54 42.99 12.10 25.28 43.06 11.93 2 0 14.68 -999 ? N6A COA A1001 >ASP^A 122 28.67 45.94 14.78 30.44 45.81 13.65 29.55 45.87 14.21 2 0 13.36 -999 ? N1A COA A1001 >TYR^A 123 25.75 41.99 18.65 24.19 39.88 17.72 24.97 40.94 18.19 3 0 12.50 -999 ? O2B COA A1001 >ILE^A 124 26.28 49.06 19.10 27.02 50.29 18.50 26.65 49.68 18.80 3 0 18.57 -999 ? C2A COA A1001 >TYR^A 125 26.49 45.73 24.02 26.30 43.17 22.94 26.39 44.45 23.48 3 0 14.53 -999 ? O2B COA A1001 >LEU^A 126 24.71 51.56 27.13 23.12 52.92 26.43 23.92 52.24 26.78 3 0 23.16 -999 ? O2B COA A1001 >ARG~A 127 32.19 53.25 29.41 32.30 53.18 32.48 32.25 53.21 30.95 2 0 24.33 -999 ? O2B COA A1001 >SER~A 128 26.93 52.13 31.22 24.97 53.31 30.29 25.95 52.72 30.76 2 0 24.84 -999 ? O2B COA A1001 >ASP~A 129 24.23 48.32 29.69 22.38 49.34 29.45 23.31 48.83 29.57 2 0 22.25 -999 ? O2B COA A1001 >LEU~A 130 28.94 46.43 29.26 28.17 45.27 27.53 28.56 45.85 28.40 3 0 16.56 -999 ? O2B COA A1001 >ALA~A 131 30.08 48.39 33.32 30.63 49.82 33.19 30.35 49.10 33.26 2 0 21.88 -999 ? O7A COA A1001 >THR~A 132 27.25 48.30 35.91 26.22 50.17 35.50 26.74 49.23 35.70 2 0 24.11 -999 ? O7A COA A1001 >LEU~A 133 25.56 44.05 35.17 26.92 42.97 33.90 26.24 43.51 34.54 3 0 18.33 -999 ? O7A COA A1001 >LYS.A 134 22.13 47.38 36.52 22.48 53.18 34.06 22.30 50.28 35.29 2 0 27.26 -999 ? O2B COA A1001 >GLY~A 135 18.42 46.55 36.21 18.89 45.91 36.33 18.65 46.23 36.27 1 0 25.23 -999 ? O7A COA A1001 >LYS~A 136 16.09 43.58 35.67 10.57 42.36 33.68 13.33 42.97 34.68 2 0 27.52 -999 ? O7A COA A1001 >LYS~A 137 17.41 42.73 32.19 17.70 47.61 28.25 17.55 45.17 30.22 2 0 23.25 -999 ? O2B COA A1001 >PHE~A 138 22.18 44.00 32.25 22.60 45.17 29.74 22.39 44.58 30.99 3 0 19.41 -999 ? O7A COA A1001 >GLN~A 139 18.61 39.08 38.46 16.97 39.63 39.66 17.79 39.35 39.06 2 0 24.35 -999 ? O7A COA A1001 >ALA~A 140 21.40 36.81 35.01 20.94 36.12 33.73 21.17 36.47 34.37 2 0 16.67 -999 ? O7A COA A1001 >LYS~A 141 24.66 38.65 34.20 25.09 36.78 29.29 24.87 37.72 31.74 2 0 11.75 -999 ? O7A COA A1001 >ARG~A 142 23.34 43.19 39.12 20.32 43.12 38.44 21.83 43.16 38.78 2 0 23.21 -999 ? O7A COA A1001 >ASN~A 143 23.14 35.44 38.60 23.22 33.51 39.53 23.18 34.47 39.06 2 0 18.51 -999 ? O7A COA A1001 >HIS~A 144 26.31 34.64 34.52 24.60 33.89 33.56 25.46 34.27 34.04 3 0 13.14 -999 ? O7A COA A1001 >ILE~A 145 29.34 39.27 38.21 30.42 39.70 37.55 29.88 39.49 37.88 3 0 16.84 -999 ? O7A COA A1001 >ASN~A 146 27.05 37.17 42.35 26.48 39.25 42.57 26.76 38.21 42.46 2 0 21.50 -999 ? O7A COA A1001 >ARG~A 147 27.55 30.01 39.46 26.29 27.80 40.59 26.92 28.90 40.03 2 0 17.75 -999 ? O7A COA A1001 >PHE~A 148 34.23 34.67 38.34 36.91 34.43 37.56 35.57 34.55 37.95 3 0 14.42 -999 ? O8A COA A1001 >ARG~A 149 32.26 39.80 42.88 31.50 42.44 41.45 31.88 41.12 42.17 2 0 21.19 -999 ? O7A COA A1001 >ASN~A 150 30.64 32.93 45.38 29.38 34.16 46.56 30.01 33.54 45.97 2 0 22.86 -999 ? O7A COA A1001 >THR~A 151 33.93 30.55 43.59 33.26 29.13 42.12 33.60 29.84 42.85 2 0 17.70 -999 ? O7A COA A1001 >TYR~A 152 37.22 31.34 40.71 36.69 29.01 39.25 36.96 30.17 39.98 3 0 15.73 -999 ? O8A COA A1001 >PRO.A 153 37.37 33.41 47.26 37.20 34.61 45.36 37.29 34.01 46.31 3 0 22.43 -999 ? O8A COA A1001 >ASP.A 154 41.84 35.08 46.00 41.81 33.07 45.36 41.82 34.07 45.68 2 0 22.10 -999 ? O8A COA A1001 >TYR.A 155 38.79 37.51 40.42 37.31 39.88 40.23 38.05 38.69 40.33 3 0 18.39 -999 ? O8A COA A1001 >GLU^A 156 44.98 38.60 41.73 47.06 38.19 42.08 46.02 38.40 41.91 2 0 22.56 -999 ? O8A COA A1001 >TYR^A 157 40.94 42.85 35.58 40.78 44.34 33.21 40.86 43.59 34.39 3 0 17.69 -999 ? O8A COA A1001 >THR^A 158 45.28 43.07 35.43 46.90 41.62 35.48 46.09 42.34 35.45 2 0 19.56 -999 ? O8A COA A1001 >PRO^A 159 45.87 47.16 34.10 45.63 45.14 33.13 45.75 46.15 33.61 3 0 21.14 -999 ? O8A COA A1001 >ILE.A 160 47.15 43.70 28.06 46.94 42.76 26.96 47.04 43.23 27.51 3 0 17.63 -999 ? O8A COA A1001 >THR~A 161 51.19 45.32 29.90 51.43 45.23 32.04 51.31 45.28 30.97 2 0 23.12 -999 ? O8A COA A1001 >PRO~A 162 54.68 46.82 27.66 53.77 44.83 28.21 54.22 45.82 27.93 3 0 24.13 -999 ? C2A COA A1001 >ASP~A 163 55.99 42.03 31.70 57.07 40.33 32.42 56.53 41.18 32.06 2 0 24.93 -999 ? O8A COA A1001 >ARG~A 164 50.06 41.32 33.36 50.29 43.45 35.58 50.17 42.39 34.47 2 0 22.74 -999 ? O8A COA A1001 >ILE~A 165 52.51 40.62 25.28 51.51 41.03 24.25 52.01 40.83 24.76 3 0 18.83 -999 ? C2A COA A1001 >GLN~A 166 55.11 34.56 26.59 55.11 34.23 24.48 55.11 34.39 25.54 2 0 19.67 -999 ? O8A COA A1001 >GLU~A 167 49.97 36.48 30.71 49.54 36.59 32.79 49.76 36.53 31.75 2 0 17.38 -999 ? O8A COA A1001 >CYH~A 168 47.94 36.15 26.45 47.20 38.68 27.33 47.57 37.41 26.89 2 0 14.60 -999 ? O8A COA A1001 >LEU~A 169 51.19 34.78 23.05 51.67 36.36 21.56 51.43 35.57 22.30 3 0 16.11 -999 ? C2A COA A1001 >ASP~A 170 50.76 31.20 27.09 52.89 31.39 26.95 51.82 31.30 27.02 2 0 17.24 -999 ? O8A COA A1001 >LEU~A 171 45.43 32.26 27.23 43.26 32.34 27.60 44.35 32.30 27.42 3 0 9.30 -999 ? O8A COA A1001 >GLU~A 172 45.81 32.72 20.30 43.78 32.68 19.58 44.79 32.70 19.94 2 0 8.00 -999 ? C2A COA A1001 >ALA~A 173 47.85 28.81 21.83 49.34 28.71 22.15 48.60 28.76 21.99 2 0 13.65 -999 ? O8A COA A1001 >GLU~A 174 47.19 26.63 26.52 47.00 26.35 28.63 47.09 26.49 27.58 2 0 12.43 -999 ? O8A COA A1001 >TRP~A 175 39.65 29.59 23.72 38.72 29.86 19.89 39.19 29.73 21.80 3 0 -4.12 -999 ? O8A COA A1001s >CSS~A 176 43.60 27.18 19.42 43.79 29.45 17.92 43.69 28.31 18.67 2 0 8.76 -999 ? N3A COA A1001 >LYS~A 177 44.83 23.66 20.31 48.62 21.39 18.27 46.72 22.52 19.29 2 0 15.80 -999 ? O4B COA A1001 >VAL~A 178 41.35 22.92 21.75 40.38 23.27 23.73 40.87 23.09 22.74 3 0 7.99 -999 ? O9A COA A1001 >ASN~A 179 39.06 26.12 19.10 37.76 26.35 20.82 38.41 26.24 19.96 2 0 -4.00 -999 ? C4B COA A1001s >ASN~A 180 40.81 22.20 15.37 41.83 21.22 13.75 41.32 21.71 14.56 2 0 11.27 -999 ? O5A COA A1001 >CSS.A 181 42.62 26.74 14.59 42.23 28.53 16.71 42.43 27.63 15.65 2 0 7.85 -999 ? O4B COA A1001 >ASP.A 182 46.06 23.74 12.74 47.70 24.30 13.98 46.88 24.02 13.36 2 0 14.72 -999 ? O4B COA A1001 >GLN.A 183 43.22 21.20 10.25 42.79 19.14 10.33 43.01 20.17 10.29 2 0 14.30 -999 ? CDP COA A1001 >GLN~A 184 38.28 24.66 13.13 36.36 23.83 12.74 37.32 24.24 12.94 2 0 7.41 -999 ? O5A COA A1001 >GLU~A 185 39.29 29.84 6.31 38.29 29.95 4.46 38.79 29.89 5.39 2 0 10.39 -999 ? N6A COA A1001 >GLY~A 186 37.69 31.28 10.56 38.33 30.82 10.83 38.01 31.05 10.69 1 0 4.53 -999 ? N6A COA A1001 >THR~A 187 39.48 30.85 13.84 38.76 29.31 15.21 39.12 30.08 14.53 2 0 -4.84 -999 ? C5A COA A1001s >GLY~A 188 42.82 30.26 12.02 42.29 30.90 12.06 42.56 30.58 12.04 1 0 8.37 -999 ? N6A COA A1001 >ASN~A 189 41.25 34.04 9.41 41.60 33.27 7.44 41.43 33.66 8.42 2 0 9.14 -999 ? N6A COA A1001 >GLU~A 190 40.09 35.69 15.86 39.26 34.96 17.68 39.67 35.32 16.77 2 0 -3.24 -999 ? C2A COA A1001s >ARG~A 191 46.88 30.74 16.07 46.90 27.97 14.73 46.89 29.35 15.40 2 0 12.41 -999 ? C2A COA A1001 >ARG~A 192 48.57 33.90 10.86 49.84 35.73 8.69 49.21 34.82 9.77 2 0 15.65 -999 ? N1A COA A1001 >ALA~A 193 44.90 38.92 13.47 43.45 39.24 13.15 44.18 39.08 13.31 2 0 9.54 -999 ? N1A COA A1001 >LEU~A 194 44.40 37.17 17.94 44.37 36.38 19.90 44.38 36.78 18.92 3 0 8.82 -999 ? C2A COA A1001 >ILE~A 195 49.38 36.28 16.65 50.14 35.09 16.70 49.76 35.69 16.67 3 0 13.64 -999 ? C2A COA A1001 >TYR~A 196 49.45 42.31 13.16 50.18 44.83 12.19 49.82 43.57 12.68 3 0 17.14 -999 ? N1A COA A1001 >ALA~A 197 47.64 42.78 17.52 46.16 42.64 17.85 46.90 42.71 17.69 2 0 13.25 -999 ? C2A COA A1001 >LEU~A 198 49.33 39.89 21.10 47.78 39.28 22.59 48.55 39.58 21.84 3 0 14.35 -999 ? C2A COA A1001 >HIS~A 199 53.54 39.49 17.64 53.75 37.40 17.57 53.65 38.44 17.60 3 0 18.00 -999 ? C2A COA A1001 >ASN~A 200 51.85 45.49 16.51 53.26 44.46 15.27 52.56 44.98 15.89 2 0 20.13 -999 ? C2A COA A1001 >PHE~A 201 48.76 45.42 23.09 46.37 45.39 24.65 47.56 45.41 23.87 3 0 17.50 -999 ? C2A COA A1001 >GLU~A 202 52.44 49.17 24.16 53.90 49.79 25.56 53.17 49.48 24.86 2 0 25.21 -999 ? C2A COA A1001 >ALA~A 203 51.97 50.80 18.43 52.81 50.14 17.35 52.39 50.47 17.89 2 0 23.23 -999 ? C2A COA A1001 >LEU~A 204 47.71 48.69 17.45 47.83 47.31 15.79 47.77 48.00 16.62 3 0 18.25 -999 ? C2A COA A1001 >GLY~A 205 46.93 51.96 20.56 46.84 51.15 20.49 46.89 51.56 20.53 1 0 21.29 -999 ? C2A COA A1001 >LEU.A 206 45.45 47.51 21.70 44.66 46.38 20.08 45.05 46.95 20.89 3 0 16.21 -999 ? C2A COA A1001 >THR^A 207 44.23 48.51 25.76 43.28 50.37 26.25 43.75 49.44 26.00 2 0 20.12 -999 ? C2A COA A1001 >GLY^A 208 43.31 45.24 27.37 43.62 45.69 27.97 43.47 45.47 27.67 1 0 16.84 -999 ? C2A COA A1001 >GLY^A 209 42.77 43.15 30.47 42.89 42.65 29.77 42.83 42.90 30.12 1 0 16.12 -999 ? O8A COA A1001 >ILE^A 210 45.21 39.50 31.90 46.47 39.04 31.46 45.84 39.27 31.68 3 0 15.50 -999 ? O8A COA A1001 >LEU^A 211 40.50 37.08 34.15 38.78 37.42 35.36 39.64 37.25 34.75 3 0 13.30 -999 ? O8A COA A1001 >HIS^A 212 46.12 36.47 36.26 47.23 37.73 35.00 46.68 37.10 35.63 3 0 17.20 -999 ? O8A COA A1001 >VAL^A 213 42.57 32.44 38.88 40.45 31.81 38.85 41.51 32.13 38.87 3 0 15.76 -999 ? O8A COA A1001 >ASN.A 214 44.10 28.84 41.20 42.22 28.65 42.23 43.16 28.75 41.71 2 0 19.05 -999 ? O8A COA A1001 >GLY.A 215 47.94 31.68 39.77 47.38 31.54 39.26 47.66 31.61 39.52 1 0 19.68 -999 ? O8A COA A1001 >LYS^A 216 47.29 31.25 36.02 43.31 27.18 34.86 45.30 29.21 35.44 2 0 13.18 -999 ? O8A COA A1001 >ILE^A 217 46.52 33.86 31.99 46.70 34.08 30.55 46.61 33.97 31.27 3 0 13.39 -999 ? O8A COA A1001 >VAL^A 218 42.22 32.23 32.45 41.37 31.89 34.48 41.80 32.06 33.47 3 0 11.10 -999 ? O8A COA A1001 >ALA^A 219 40.99 35.03 30.14 39.60 35.47 30.62 40.29 35.25 30.38 2 0 9.18 -999 ? O8A COA A1001 >PHE^A 220 43.80 37.51 26.38 44.13 36.44 23.80 43.97 36.98 25.09 3 0 10.73 -999 ? O8A COA A1001 >THR^A 221 40.47 40.83 26.12 38.70 41.91 26.91 39.58 41.37 26.52 2 0 12.58 -999 ? O8A COA A1001 >PHE^A 222 43.26 42.90 22.52 43.90 41.38 20.23 43.58 42.14 21.37 3 0 11.83 -999 ? C2A COA A1001 >GLY^A 223 40.21 46.70 22.03 40.84 46.99 22.52 40.53 46.84 22.28 1 0 14.29 -999 ? C2A COA A1001 >MET^A 224 40.48 50.38 21.28 43.33 50.63 18.05 41.91 50.50 19.66 2 0 18.23 -999 ? C2A COA A1001 >PRO^A 225 39.78 54.64 21.70 38.92 52.96 20.50 39.35 53.80 21.10 3 0 20.56 -999 ? C2A COA A1001 >ILE^A 226 35.26 52.39 16.62 34.52 51.33 16.19 34.89 51.86 16.40 3 0 18.02 -999 ? N1A COA A1001 >ASN^A 227 34.15 57.21 16.11 32.19 57.22 17.01 33.17 57.21 16.56 2 0 23.68 -999 ? N1A COA A1001 >HIS.A 228 33.34 61.33 18.91 31.42 61.57 18.15 32.38 61.45 18.53 3 0 27.90 -999 ? C2A COA A1001 >GLU.A 229 30.09 58.47 20.04 28.21 59.39 19.95 29.15 58.93 19.99 2 0 26.91 -999 ? C2A COA A1001 >THR^A 230 32.52 54.19 20.54 31.18 53.50 18.95 31.85 53.84 19.74 2 0 20.36 -999 ? C2A COA A1001 >PHE^A 231 36.68 51.13 23.82 39.22 50.13 24.48 37.95 50.63 24.15 3 0 18.25 -999 ? C2A COA A1001 >GLY^A 232 35.52 48.40 20.15 36.01 48.55 20.85 35.76 48.47 20.50 1 0 14.86 -999 ? C2A COA A1001 >VAL^A 233 36.25 45.17 21.97 35.62 44.47 23.96 35.94 44.82 22.96 3 0 12.40 -999 ? C2A COA A1001 >HIS^A 234 39.32 45.11 18.28 38.99 47.14 17.84 39.16 46.13 18.06 3 0 12.64 -999 ? C2A COA A1001 >VAL^A 235 39.06 39.91 21.15 41.09 39.00 20.62 40.07 39.46 20.89 3 0 7.73 -999 ? C2A COA A1001 >GLU^A 236 36.17 38.36 26.13 34.18 38.96 26.57 35.17 38.66 26.35 2 0 9.21 -999 ? O2B COA A1001 >LYS^A 237 39.23 34.57 25.04 39.30 32.92 19.92 39.27 33.75 22.48 2 0 4.09 -999 ? N3A COA A1001 >ALA^A 238 38.79 32.40 28.09 37.51 32.78 28.88 38.15 32.59 28.49 2 0 5.63 -999 ? O8A COA A1001 >ASP.A 239 40.79 28.78 30.57 41.10 26.75 31.11 40.95 27.76 30.84 2 0 9.14 -999 ? O8A COA A1001 >THR.A 240 36.54 27.10 28.98 35.70 25.66 27.58 36.12 26.38 28.28 2 0 4.71 -999 ? O9A COA A1001 >SER.A 241 36.96 24.98 32.12 39.34 24.63 32.48 38.15 24.81 32.30 2 0 10.33 -999 ? O8A COA A1001 >ILE.A 242 37.68 29.24 34.31 38.43 28.89 35.50 38.06 29.07 34.90 3 0 10.86 -999 ? O8A COA A1001 >ASP.A 243 31.98 28.17 35.66 29.91 28.33 35.22 30.94 28.25 35.44 2 0 11.44 -999 ? O7A COA A1001 >GLY~A 244 32.10 32.77 34.62 32.76 32.52 34.23 32.43 32.64 34.42 1 0 10.64 -999 ? O7A COA A1001 >ALA~A 245 35.42 33.89 33.23 36.62 33.02 32.83 36.02 33.46 33.03 2 0 9.11 -999 ? O8A COA A1001 >TYR~A 246 33.93 34.07 27.89 35.54 32.84 25.91 34.74 33.46 26.90 3 0 -4.51 -999 ? O7A COA A1001s >ALA~A 247 31.35 37.35 32.21 30.24 36.76 33.13 30.80 37.05 32.67 2 0 11.47 -999 ? O7A COA A1001 >MET~A 248 33.97 38.61 34.70 34.50 39.97 37.52 34.24 39.29 36.11 2 0 16.53 -999 ? O7A COA A1001 >ILE~A 249 37.52 38.97 31.22 38.40 38.78 30.30 37.96 38.87 30.76 3 0 11.23 -999 ? O8A COA A1001 >ASN~A 250 32.53 40.83 29.68 31.08 42.00 28.65 31.81 41.41 29.16 2 0 12.96 -999 ? O7A COA A1001 >TYR~A 251 31.74 43.60 35.65 31.15 45.33 37.78 31.45 44.46 36.72 3 0 19.10 -999 ? O7A COA A1001 >GLU~A 252 37.03 42.64 36.36 37.75 43.70 38.05 37.39 43.17 37.21 2 0 19.55 -999 ? O8A COA A1001 >PHE~A 253 38.48 45.56 28.89 39.77 47.02 26.86 39.13 46.29 27.87 3 0 16.66 -999 ? C2A COA A1001 >ALA~A 254 34.12 47.57 30.58 32.68 47.04 30.69 33.40 47.30 30.64 2 0 18.12 -999 ? O2B COA A1001 >ASN~A 255 34.87 48.85 35.18 32.83 48.74 35.82 33.85 48.79 35.50 2 0 21.97 -999 ? O7A COA A1001 >ARG~A 256 40.15 49.33 34.68 42.44 48.10 36.39 41.29 48.72 35.53 2 0 22.79 -999 ? O8A COA A1001 >ILE~A 257 35.88 51.16 28.24 35.34 50.57 27.07 35.61 50.87 27.66 3 0 20.00 -999 ? C2A COA A1001 >PRO.A 258 39.13 55.49 28.31 37.15 54.97 29.24 38.14 55.23 28.77 3 0 24.39 -999 ? C2A COA A1001 >GLU.A 259 32.99 57.17 32.57 31.70 57.96 34.09 32.34 57.56 33.33 2 0 29.33 -999 ? O2B COA A1001 >GLN.A 260 35.91 59.47 25.75 37.53 59.61 27.14 36.72 59.54 26.44 2 0 27.64 -999 ? C2A COA A1001 >TYR.A 261 35.31 55.51 24.37 37.69 56.69 23.55 36.50 56.10 23.96 3 0 23.26 -999 ? C2A COA A1001 >ILE.A 262 28.22 56.97 24.84 28.07 57.86 25.07 28.14 57.41 24.96 3 0 26.10 -999 ? C2A COA A1001 >TYR^A 263 27.39 54.03 21.65 25.25 55.80 21.57 26.32 54.91 21.61 3 0 23.70 -999 ? C2A COA A1001 >ILE^A 264 30.96 48.67 24.47 31.72 48.11 25.60 31.34 48.39 25.04 3 0 17.18 -999 ? O2B COA A1001 >ASN^A 265 31.44 48.36 18.58 31.01 47.31 16.76 31.22 47.83 17.67 2 0 14.37 -999 ? N1A COA A1001 >ARG.A 266 30.53 43.38 24.23 32.56 41.32 25.32 31.55 42.35 24.78 2 0 10.50 -999 ? O2B COA A1001 >GLU.A 267 34.01 43.45 17.12 36.00 43.23 16.37 35.00 43.34 16.74 2 0 9.36 -999 ? N1A COA A1001 >GLU.A 268 30.34 41.52 12.71 32.33 41.78 12.16 31.33 41.65 12.43 2 0 9.39 -999 ? N6A COA A1001 >ASP.A 269 26.64 36.63 15.98 25.09 36.97 14.55 25.86 36.80 15.26 2 0 10.82 -999 ? N6A COA A1001 >LEU.A 270 30.60 34.92 12.31 32.43 36.12 12.09 31.52 35.52 12.20 3 0 -4.72 -999 ? N6A COA A1001s >GLY.A 271 25.92 33.61 11.83 26.50 33.48 12.37 26.21 33.55 12.10 1 0 9.39 -999 ? N7A COA A1001 >ILE~A 272 28.56 31.25 15.20 29.84 30.83 15.33 29.20 31.04 15.26 3 0 -4.71 -999 ? O1A COA A1001s >GLU~A 273 23.79 27.93 17.50 22.65 26.14 17.38 23.22 27.03 17.44 2 0 6.32 -999 ? OAP COA A1001 >GLY~A 274 26.05 30.18 20.06 26.01 30.80 19.51 26.03 30.49 19.79 1 0 4.39 -999 ? O1A COA A1001 >LEU~A 275 28.71 33.76 18.32 30.77 34.52 18.42 29.74 34.14 18.37 3 0 4.77 -999 ? O2B COA A1001 >ARG~A 276 21.62 35.08 15.74 22.28 35.23 12.71 21.95 35.15 14.22 2 0 12.07 -999 ? O1A COA A1001 >LYS~A 277 22.69 34.05 21.63 21.12 28.32 21.42 21.90 31.18 21.53 2 0 9.08 -999 ? O1A COA A1001 >ALA~A 278 25.69 35.16 23.71 27.13 34.65 23.53 26.41 34.91 23.62 2 0 7.11 -999 ? O2B COA A1001 >LYS~A 279 25.78 38.64 22.11 31.07 39.01 18.51 28.42 38.83 20.31 2 0 7.43 -999 ? C2A COA A1001 >LEU~A 280 20.89 38.24 21.59 20.01 38.53 19.62 20.45 38.38 20.61 3 0 13.89 -999 ? O1A COA A1001 >SER~A 281 22.04 38.08 25.99 24.08 36.85 26.71 23.06 37.47 26.35 2 0 11.75 -999 ? O7A COA A1001 >TYR~A 282 26.43 40.75 27.54 28.08 39.50 29.47 27.26 40.12 28.51 3 0 12.52 -999 ? O7A COA A1001 >GLN.A 283 20.24 42.82 27.91 18.70 41.49 27.27 19.47 42.16 27.59 2 0 18.48 -999 ? O2B COA A1001 >PRO.A 284 21.95 43.71 21.25 22.27 44.98 23.08 22.11 44.34 22.17 3 0 16.71 -999 ? O2B COA A1001 >VAL.A 285 21.00 49.00 22.09 22.11 50.54 23.21 21.56 49.77 22.65 3 0 21.41 -999 ? O2B COA A1001 >THR^A 286 21.74 48.67 18.37 22.31 50.49 17.32 22.03 49.58 17.84 2 0 21.60 -999 ? N1A COA A1001 >ILE^A 287 21.53 44.63 15.76 21.28 43.30 15.96 21.41 43.96 15.86 3 0 17.58 -999 ? O2B COA A1001 >LEU^A 288 25.69 48.47 13.67 26.53 50.35 12.90 26.11 49.41 13.29 3 0 18.60 -999 ? N1A COA A1001 >GLU.A 289 21.12 45.94 10.16 19.20 46.52 9.49 20.16 46.23 9.83 2 0 21.35 -999 ? N6A COA A1001 >LYS.A 290 26.20 46.57 7.12 30.99 45.26 10.96 28.60 45.92 9.04 2 0 13.28 -999 ? N6A COA A1001 >TYR^A 291 22.93 47.71 3.62 20.51 47.52 4.96 21.72 47.61 4.29 3 0 22.04 -999 ? N6A COA A1001 >MET^A 292 27.19 45.92 0.40 29.42 43.06 -1.72 28.31 44.49 -0.66 2 0 19.43 -999 ? N6A COA A1001 >ALA^A 293 26.49 48.50 -2.32 26.52 49.97 -1.95 26.51 49.24 -2.13 2 0 24.77 -999 ? N6A COA A1001 >CSS^A 294 27.36 47.32 -5.81 28.35 44.84 -5.06 27.85 46.08 -5.43 2 0 23.35 -999 ? N6A COA A1001 >LEU^A 295 28.30 50.08 -9.61 28.50 52.10 -10.25 28.40 51.09 -9.93 3 0 30.66 -999 ? N6A COA A1001 >LYS.A 296 24.32 48.32 -11.16 18.83 49.49 -9.63 21.57 48.90 -10.40 2 0 33.03 -999 ? N6A COA A1001 >ASP.A 297 26.76 46.25 -14.75 26.73 45.80 -16.83 26.74 46.02 -15.79 2 0 34.33 -999 ? N6A COA A1001 >HIS.A 298 30.69 51.05 -15.21 32.46 52.09 -14.88 31.58 51.57 -15.05 3 0 34.57 -999 ? N6A COA A1001 >MET.B 1 63.03 49.62 21.35 58.93 48.31 21.27 60.98 48.96 21.31 2 0 27.21 -999 ? C2A COA A1001 >ILE.B 2 64.54 47.94 16.95 65.51 47.16 16.31 65.03 47.55 16.63 3 0 31.87 -999 ? C2A COA A1001 >PRO.B 3 62.76 52.58 15.10 61.80 50.75 16.00 62.28 51.66 15.55 3 0 31.58 -999 ? C2A COA A1001 >PHE.B 4 61.51 45.91 13.82 63.97 44.55 13.93 62.74 45.23 13.88 3 0 29.02 -999 ? C2A COA A1001 >LYS^B 5 57.82 49.12 10.72 58.34 52.72 7.30 58.08 50.92 9.01 2 0 30.42 -999 ? N1A COA A1001 >ASP^B 6 54.05 46.94 8.45 53.11 46.49 10.30 53.58 46.72 9.38 2 0 21.93 -999 ? N1A COA A1001 >ILE.B 7 57.84 45.46 4.44 58.20 44.54 3.42 58.02 45.00 3.93 3 0 27.36 -999 ? N1A COA A1001 >THR~B 8 54.94 48.38 2.38 54.08 50.37 2.65 54.51 49.38 2.52 2 0 27.76 -999 ? N1A COA A1001 >LEU~B 9 53.80 49.54 -2.19 52.70 48.01 -3.18 53.25 48.78 -2.69 3 0 29.20 -999 ? N6A COA A1001 >ALA~B 10 56.15 52.80 -0.35 55.33 53.76 0.51 55.74 53.28 0.08 2 0 31.66 -999 ? N1A COA A1001 >ASP~B 11 59.38 50.46 2.37 58.18 51.20 3.92 58.78 50.83 3.15 2 0 30.54 -999 ? N1A COA A1001 >ARG~B 12 60.00 50.12 -5.95 59.91 50.45 -8.97 59.96 50.29 -7.46 2 0 37.97 -999 ? N6A COA A1001 >ASP~B 13 63.14 54.66 -2.56 62.53 55.28 -4.50 62.84 54.97 -3.53 2 0 39.67 -999 ? N1A COA A1001 >THR~B 14 64.56 52.78 1.17 63.77 53.40 3.12 64.16 53.09 2.15 2 0 36.22 -999 ? N1A COA A1001 >ILE~B 15 63.88 47.99 0.83 63.13 47.03 1.38 63.51 47.51 1.11 3 0 34.02 -999 ? N1A COA A1001 >THR~B 16 66.60 48.89 -2.60 65.11 49.24 -4.12 65.85 49.06 -3.36 2 0 38.46 -999 ? N1A COA A1001 >ALA~B 17 69.00 51.71 -1.59 68.67 53.00 -0.81 68.84 52.36 -1.20 2 0 41.33 -999 ? N1A COA A1001 >PHE~B 18 70.08 49.51 3.20 70.30 51.30 5.33 70.19 50.41 4.26 3 0 39.66 -999 ? N1A COA A1001 >THR~B 19 70.13 45.90 -1.33 68.06 45.31 -1.22 69.09 45.60 -1.28 2 0 38.04 -999 ? N1A COA A1001 >MET~B 20 71.14 47.09 -4.80 68.88 46.38 -7.17 70.01 46.74 -5.98 2 0 41.98 -999 ? N6A COA A1001 >LYS.B 21 74.68 48.15 -3.80 74.70 53.13 0.18 74.69 50.64 -1.81 2 0 45.94 -999 ? N1A COA A1001 >SER.B 22 75.11 45.10 -1.52 73.24 43.56 -1.20 74.17 44.33 -1.36 2 0 42.05 -999 ? N1A COA A1001 >ASP.B 23 78.24 41.46 -1.95 78.51 41.03 0.06 78.38 41.24 -0.95 2 0 45.87 -999 ? N1A COA A1001 >ARG.B 24 74.17 39.58 1.78 72.53 40.13 4.31 73.35 39.86 3.04 2 0 38.78 -999 ? N1A COA A1001 >ARG.B 25 75.14 37.01 -6.57 76.98 34.58 -7.13 76.06 35.79 -6.85 2 0 46.86 -999 ? N6A COA A1001 >ASN~B 26 69.71 35.92 -0.34 68.08 35.03 0.77 68.89 35.47 0.22 2 0 35.43 -999 ? N1A COA A1001 >CYH~B 27 66.21 35.84 -3.67 64.87 33.34 -3.38 65.54 34.59 -3.52 2 0 34.39 -999 ? N6A COA A1001 >ASP~B 28 64.70 35.76 0.93 64.01 33.76 0.57 64.35 34.76 0.75 2 0 31.81 -999 ? N6A COA A1001 >LEU~B 29 67.52 40.38 -0.41 68.60 40.48 1.49 68.06 40.43 0.54 3 0 36.09 -999 ? N1A COA A1001 >SER~B 30 63.94 40.91 -3.67 62.21 40.56 -5.26 63.07 40.73 -4.47 2 0 34.02 -999 ? N6A COA A1001 >PHE~B 31 60.55 46.10 -2.73 58.58 47.77 -1.59 59.57 46.93 -2.16 3 0 32.37 -999 ? N1A COA A1001 >SER~B 32 58.68 41.92 -4.47 57.30 40.85 -6.18 57.99 41.38 -5.32 2 0 30.92 -999 ? N6A COA A1001 >ASN~B 33 60.66 37.86 -2.56 60.64 36.51 -4.26 60.65 37.19 -3.41 2 0 31.51 -999 ? N6A COA A1001 >LEU~B 34 60.55 41.83 1.13 62.58 41.54 1.91 61.57 41.68 1.52 3 0 30.29 -999 ? N1A COA A1001 >CYH~B 35 56.23 42.53 0.16 56.81 45.17 -0.46 56.52 43.85 -0.15 2 0 28.72 -999 ? N1A COA A1001 >SER~B 36 54.38 39.61 -1.42 54.71 39.93 -3.80 54.55 39.77 -2.61 2 0 27.28 -999 ? N6A COA A1001 >TRP~B 37 56.77 35.65 -0.86 54.90 32.23 -0.26 55.84 33.94 -0.56 3 0 25.27 -999 ? N6A COA A1001 >ARG~B 38 53.45 43.66 4.97 51.36 44.92 3.07 52.41 44.29 4.02 2 0 22.79 -999 ? N1A COA A1001 >PHE~B 39 50.15 36.55 2.80 50.98 34.06 1.75 50.56 35.30 2.28 3 0 19.45 -999 ? N6A COA A1001 >LEU~B 40 53.11 34.11 5.02 52.92 31.94 5.26 53.02 33.02 5.14 3 0 19.91 -999 ? N6A COA A1001 >TYR~B 41 56.79 35.28 6.75 57.37 32.92 5.36 57.08 34.10 6.05 3 0 23.21 -999 ? N1A COA A1001 >ASP~B 42 53.42 39.75 10.84 51.46 39.01 11.07 52.44 39.38 10.96 2 0 16.94 -999 ? N1A COA A1001 >THR.B 43 57.12 41.20 7.95 58.14 40.46 6.21 57.63 40.83 7.08 2 0 24.99 -999 ? N1A COA A1001 >GLN^B 44 56.95 44.49 11.25 56.55 44.83 13.34 56.75 44.66 12.29 2 0 23.38 -999 ? N1A COA A1001 >PHE^B 45 61.80 47.75 6.83 60.95 50.26 5.86 61.38 49.01 6.34 3 0 31.00 -999 ? N1A COA A1001 >ALA^B 46 64.21 48.78 10.46 64.27 48.63 11.96 64.24 48.71 11.21 2 0 32.09 -999 ? N1A COA A1001 >VAL^B 47 67.44 50.58 9.71 67.99 51.80 7.98 67.72 51.19 8.85 3 0 36.77 -999 ? N1A COA A1001 >ILE^B 48 69.47 48.80 13.49 68.85 47.92 14.35 69.16 48.36 13.92 3 0 36.11 -999 ? C2A COA A1001 >ASP.B 49 74.16 50.46 13.87 73.45 50.57 15.88 73.80 50.51 14.88 2 0 40.80 -999 ? C2A COA A1001 >ASP.B 50 74.88 52.23 8.76 75.04 54.29 9.27 74.96 53.26 9.01 2 0 44.50 -999 ? N1A COA A1001 >PHE^B 51 73.94 46.67 9.53 76.66 46.03 9.69 75.30 46.35 9.61 3 0 41.66 -999 ? N1A COA A1001 >LEU^B 52 68.47 47.22 5.52 66.51 47.06 4.59 67.49 47.14 5.05 3 0 35.80 -999 ? N1A COA A1001 >VAL^B 53 67.18 44.41 9.11 68.11 43.85 11.07 67.65 44.13 10.09 3 0 33.72 -999 ? N1A COA A1001 >PHE^B 54 63.90 42.53 6.02 64.13 44.28 3.83 64.02 43.41 4.92 3 0 31.50 -999 ? N1A COA A1001 >LYS^B 55 61.89 40.68 11.22 60.24 42.62 17.08 61.07 41.65 14.15 2 0 25.54 -999 ? C2A COA A1001 >PHE^B 56 60.88 37.30 8.32 62.26 38.41 6.10 61.57 37.86 7.21 3 0 27.24 -999 ? N1A COA A1001 >TRP^B 57 56.36 38.65 14.11 57.36 37.10 17.60 56.86 37.88 15.86 3 0 21.04 -999 ? C2A COA A1001 >ALA^B 58 56.37 32.14 11.22 57.44 31.44 10.40 56.91 31.79 10.81 2 0 22.21 -999 ? N1A COA A1001 >GLY.B 59 53.90 30.76 13.74 54.60 31.24 13.79 54.25 31.00 13.77 1 0 18.25 -999 ? C2A COA A1001 >GLU.B 60 54.65 28.18 18.07 54.88 27.05 19.82 54.76 27.61 18.94 2 0 19.69 -999 ? O8A COA A1001 >GLN^B 61 61.10 30.57 13.60 62.85 29.85 14.64 61.97 30.21 14.12 2 0 27.02 -999 ? C2A COA A1001 >LEU^B 62 60.90 35.37 16.59 61.27 37.49 16.77 61.09 36.43 16.68 3 0 24.97 -999 ? C2A COA A1001 >ALA^B 63 63.54 35.12 12.85 63.59 34.03 11.76 63.57 34.58 12.31 2 0 27.85 -999 ? N1A COA A1001 >TYR^B 64 65.68 39.22 13.84 64.30 39.89 16.20 64.99 39.55 15.02 3 0 29.38 -999 ? C2A COA A1001 >MET^B 65 67.24 38.38 8.15 67.24 37.37 4.86 67.24 37.87 6.50 2 0 33.25 -999 ? N1A COA A1001 >MET.B 66 71.06 38.62 8.14 74.39 37.92 8.96 72.73 38.27 8.55 2 0 39.18 -999 ? N1A COA A1001 >PRO.B 67 72.13 42.10 10.67 71.58 41.70 8.51 71.86 41.90 9.59 3 0 37.23 -999 ? N1A COA A1001 >VAL^B 68 72.31 44.15 5.01 71.18 43.84 3.12 71.74 44.00 4.07 3 0 38.93 -999 ? N1A COA A1001 >GLY^B 69 74.93 46.90 4.99 75.29 46.18 5.17 75.11 46.54 5.08 1 0 42.42 -999 ? N1A COA A1001 >ASN.B 70 79.38 48.40 5.14 81.43 47.82 5.51 80.40 48.11 5.32 2 0 48.59 -999 ? N1A COA A1001 >GLY.B 71 79.27 49.16 9.64 79.39 48.33 9.54 79.33 48.75 9.59 1 0 46.27 -999 ? N1A COA A1001 >ASP~B 72 79.33 48.76 14.39 80.11 47.87 16.16 79.72 48.31 15.27 2 0 46.06 -999 ? C2A COA A1001 >LEU~B 73 78.47 43.14 12.16 77.35 41.48 11.33 77.91 42.31 11.74 3 0 42.85 -999 ? C2A COA A1001 >LYS~B 74 78.57 43.62 16.69 82.43 44.20 21.75 80.50 43.91 19.22 2 0 47.55 -999 ? C2A COA A1001 >ALA~B 75 76.48 46.64 17.69 76.82 48.09 17.32 76.65 47.37 17.51 2 0 42.99 -999 ? C2A COA A1001 >VAL~B 76 73.53 45.64 15.48 72.86 46.02 13.43 73.19 45.83 14.45 3 0 38.93 -999 ? C2A COA A1001 >LEU~B 77 74.81 41.07 16.69 74.99 39.66 15.03 74.90 40.37 15.86 3 0 39.22 -999 ? C2A COA A1001 >ARG~B 78 76.61 44.93 22.13 77.85 47.44 20.78 77.23 46.18 21.45 2 0 43.90 -999 ? C2A COA A1001 >LYS~B 79 70.33 45.29 19.51 71.44 51.14 18.98 70.89 48.22 19.24 2 0 39.25 -999 ? C2A COA A1001 >LEU~B 80 69.15 41.74 16.35 68.80 42.59 14.37 68.98 42.16 15.36 3 0 33.81 -999 ? C2A COA A1001 >ILE~B 81 70.85 39.55 21.11 71.95 38.72 21.34 71.40 39.14 21.23 3 0 35.77 -999 ? C2A COA A1001 >GLU~B 82 69.68 43.88 24.01 70.47 45.78 24.49 70.08 44.83 24.25 2 0 36.97 -999 ? C2A COA A1001 >ASP~B 83 64.86 43.09 19.12 62.91 43.59 18.45 63.89 43.34 18.78 2 0 28.41 -999 ? C2A COA A1001 >ALA~B 84 64.50 38.84 20.60 65.54 37.84 20.08 65.02 38.34 20.34 2 0 29.71 -999 ? C2A COA A1001 >ASP~B 85 65.91 39.62 25.22 67.70 38.51 25.30 66.81 39.06 25.26 2 0 32.82 -999 ? C2A COA A1001 >LYS~B 86 61.94 41.45 24.54 59.18 44.37 20.43 60.56 42.91 22.49 2 0 25.44 -999 ? C2A COA A1001 >GLU~B 87 60.12 40.06 20.01 58.21 40.97 19.88 59.17 40.52 19.95 2 0 23.24 -999 ? C2A COA A1001 >LYS.B 88 60.88 36.22 24.78 57.06 38.21 29.43 58.97 37.22 27.11 2 0 23.29 -999 ? O8A COA A1001 >HIS.B 89 60.40 33.95 20.34 58.37 33.46 20.18 59.39 33.70 20.26 3 0 23.34 -999 ? C2A COA A1001 >ASN.B 90 66.25 31.36 21.05 66.10 30.25 22.88 66.17 30.80 21.96 2 0 30.21 -999 ? O8A COA A1001 >PHE.B 91 69.28 36.69 17.76 70.19 38.14 15.52 69.74 37.42 16.64 3 0 33.68 -999 ? C2A COA A1001 >CSS^B 92 67.81 33.33 15.10 66.93 30.83 16.08 67.37 32.08 15.59 2 0 30.85 -999 ? C2A COA A1001 >MET^B 93 68.91 34.83 11.78 71.90 37.67 12.30 70.41 36.25 12.04 2 0 36.19 -999 ? C2A COA A1001 >LEU^B 94 66.52 33.53 7.85 64.91 32.38 8.58 65.71 32.95 8.22 3 0 30.65 -999 ? N1A COA A1001 >GLY^B 95 69.56 33.89 4.92 69.99 33.77 5.60 69.77 33.83 5.26 1 0 35.26 -999 ? N1A COA A1001 >VAL^B 96 73.11 33.65 6.16 73.84 33.66 8.21 73.47 33.66 7.19 3 0 38.42 -999 ? N1A COA A1001 >CYH~B 97 75.37 33.00 3.17 76.08 35.56 2.33 75.72 34.28 2.75 2 0 42.29 -999 ? N1A COA A1001 >SER~B 98 78.79 31.37 3.55 78.71 29.42 2.14 78.75 30.40 2.85 2 0 45.03 -999 ? N1A COA A1001 >ASN~B 99 80.63 35.83 2.77 81.78 35.29 1.07 81.20 35.56 1.92 2 0 48.08 -999 ? N1A COA A1001 >MET~B 100 78.05 35.95 6.44 77.20 38.24 4.45 77.63 37.09 5.44 2 0 42.93 -999 ? N1A COA A1001 >ARG~B 101 78.73 28.92 8.47 79.47 26.07 9.35 79.10 27.49 8.91 2 0 44.61 -999 ? N1A COA A1001 >ALA~B 102 82.33 33.58 8.69 83.27 33.67 7.50 82.80 33.62 8.10 2 0 47.96 -999 ? N1A COA A1001 >ASP~B 103 80.75 38.21 8.97 81.74 38.82 7.20 81.25 38.51 8.09 2 0 46.78 -999 ? N1A COA A1001 >LEU~B 104 77.95 35.22 12.44 76.06 36.16 11.98 77.00 35.69 12.21 3 0 41.09 -999 ? C2A COA A1001 >GLU~B 105 83.15 31.22 13.95 81.96 30.08 15.34 82.56 30.65 14.65 2 0 45.91 -999 ? C2A COA A1001 >ALA~B 106 84.39 36.20 14.01 84.89 37.00 12.82 84.64 36.60 13.42 2 0 48.94 -999 ? C2A COA A1001 >ILE~B 107 80.94 39.06 15.88 80.22 40.28 15.56 80.58 39.67 15.72 3 0 44.73 -999 ? C2A COA A1001 >LEU~B 108 79.30 35.83 18.77 78.08 37.11 20.01 78.69 36.47 19.39 3 0 42.58 -999 ? C2A COA A1001 >PRO.B 109 84.89 34.13 18.54 82.80 33.30 18.35 83.85 33.72 18.44 3 0 47.61 -999 ? C2A COA A1001 >GLU.B 110 83.32 28.09 19.74 84.77 27.65 21.19 84.04 27.87 20.47 2 0 49.01 -999 ? O8A COA A1001 >ARG.B 111 78.83 32.60 22.64 79.01 33.96 25.51 78.92 33.28 24.08 2 0 43.30 -999 ? O8A COA A1001 >PHE^B 112 75.57 32.73 15.91 74.84 35.42 16.34 75.20 34.08 16.13 3 0 38.97 -999 ? C2A COA A1001 >ILE^B 113 73.51 26.26 16.57 72.97 25.37 17.36 73.24 25.82 16.97 3 0 37.86 -999 ? C2A COA A1001 >PHE^B 114 76.36 28.75 11.65 77.41 31.25 12.40 76.88 30.00 12.03 3 0 41.14 -999 ? C2A COA A1001 >THR^B 115 71.98 24.83 10.26 70.42 24.76 11.78 71.20 24.79 11.02 2 0 35.77 -999 ? C2A COA A1001 >GLU^B 116 72.88 24.88 4.33 72.70 23.22 3.04 72.79 24.05 3.69 2 0 40.27 -999 ? N1A COA A1001 >ASP.B 117 67.45 22.85 4.89 66.08 21.44 4.10 66.77 22.15 4.49 2 0 34.45 -999 ? N6A COA A1001 >ARG~B 118 71.61 21.68 -1.95 70.32 21.84 -4.69 70.96 21.76 -3.32 2 0 41.32 -999 ? N6A COA A1001 >ALA~B 119 66.01 22.46 -0.09 64.88 21.94 0.81 65.44 22.20 0.36 2 0 34.32 -999 ? N6A COA A1001 >TYR~B 120 65.05 26.04 2.62 62.89 24.76 3.83 63.97 25.40 3.22 3 0 31.67 -999 ? N6A COA A1001 >ALA~B 121 69.54 26.94 -1.52 70.66 25.96 -1.87 70.10 26.45 -1.69 2 0 39.50 -999 ? N6A COA A1001 >ASP^B 122 69.28 30.80 -4.48 67.82 31.79 -3.32 68.55 31.30 -3.90 2 0 36.97 -999 ? N6A COA A1001 >TYR^B 123 69.09 26.06 -8.47 68.90 23.42 -7.54 68.99 24.74 -8.00 3 0 41.16 -999 ? N6A COA A1001 >ILE^B 124 73.24 31.82 -8.90 72.58 32.92 -8.33 72.91 32.37 -8.61 3 0 43.98 -999 ? N6A COA A1001 >TYR^B 125 70.90 29.51 -13.80 69.36 27.39 -12.71 70.13 28.45 -13.26 3 0 44.53 -999 ? N6A COA A1001 >LEU^B 126 75.98 32.97 -16.78 78.03 33.01 -16.06 77.00 32.99 -16.42 3 0 51.69 -999 ? N6A COA A1001 >ARG~B 127 71.54 39.13 -18.88 70.80 39.40 -21.84 71.17 39.27 -20.36 2 0 50.89 -999 ? N6A COA A1001 >SER~B 128 74.51 34.97 -20.83 76.77 34.50 -20.01 75.64 34.73 -20.42 2 0 53.71 -999 ? N6A COA A1001 >ASP~B 129 74.25 30.27 -19.33 76.35 29.82 -19.16 75.30 30.04 -19.24 2 0 52.93 -999 ? N6A COA A1001 >LEU~B 130 69.31 31.74 -18.91 69.28 30.36 -17.21 69.29 31.05 -18.06 3 0 46.82 -999 ? N6A COA A1001 >ALA~B 131 69.74 34.15 -22.85 70.23 35.59 -22.67 69.98 34.87 -22.76 2 0 50.75 -999 ? N6A COA A1001 >THR~B 132 71.89 32.43 -25.50 73.88 33.24 -25.16 72.89 32.84 -25.33 2 0 55.02 -999 ? N6A COA A1001 >LEU~B 133 70.45 28.15 -25.01 68.72 27.97 -23.74 69.59 28.06 -24.38 3 0 51.73 -999 ? N6A COA A1001 >LYS.B 134 75.28 28.50 -26.21 78.69 32.49 -23.50 76.98 30.50 -24.86 2 0 57.41 -999 ? N6A COA A1001 >GLY~B 135 77.59 25.52 -25.77 76.83 25.34 -25.93 77.21 25.43 -25.85 1 0 58.58 -999 ? N6A COA A1001 >LYS~B 136 77.39 21.77 -25.24 76.86 17.05 -27.91 77.12 19.41 -26.58 2 0 61.18 -999 ? N6A COA A1001 >LYS~B 137 75.97 22.20 -21.70 79.54 23.72 -16.71 77.76 22.96 -19.20 2 0 54.73 -999 ? N6A COA A1001 >PHE~B 138 73.11 25.92 -21.92 73.71 26.84 -19.33 73.41 26.38 -20.62 3 0 51.96 -999 ? N6A COA A1001 >GLN~B 139 72.96 19.97 -28.18 74.12 18.40 -29.00 73.54 19.18 -28.59 2 0 59.77 -999 ? N6A COA A1001 >ALA~B 140 69.28 19.92 -24.95 69.16 18.99 -23.74 69.22 19.45 -24.35 2 0 52.63 -999 ? N6A COA A1001 >LYS~B 141 67.82 23.31 -24.03 66.35 21.92 -19.18 67.09 22.62 -21.60 2 0 46.80 -999 ? N6A COA A1001 >ARG~B 142 71.78 26.02 -28.94 74.08 24.11 -28.17 72.93 25.06 -28.56 2 0 58.01 -999 ? N6A COA A1001 >ASN~B 143 67.20 19.92 -28.63 69.06 19.46 -29.63 68.13 19.69 -29.13 2 0 56.82 -999 ? N6A COA A1001 >HIS~B 144 64.11 21.01 -24.36 64.83 19.45 -23.16 64.47 20.23 -23.76 3 0 -49.41 -999 ? N6A COA A1001s >ILE~B 145 63.99 26.96 -27.53 64.99 27.82 -26.96 64.49 27.39 -27.24 3 0 50.84 -999 ? N6A COA A1001 >ASN~B 146 65.14 23.97 -32.11 66.76 25.39 -32.22 65.95 24.68 -32.16 2 0 56.42 -999 ? N6A COA A1001 >ARG~B 147 60.68 18.33 -29.59 59.36 17.07 -27.20 60.02 17.70 -28.40 2 0 50.29 -999 ? N6A COA A1001 >PHE~B 148 57.86 26.17 -28.01 55.63 27.73 -27.24 56.75 26.95 -27.63 3 0 47.19 -999 ? N6A COA A1001 >ARG~B 149 62.71 28.92 -32.31 65.00 30.50 -30.96 63.86 29.71 -31.63 2 0 53.94 -999 ? N6A COA A1001 >ASN~B 150 59.51 22.63 -35.14 61.29 22.92 -36.24 60.40 22.77 -35.69 2 0 57.44 -999 ? N6A COA A1001 >THR~B 151 55.52 22.81 -33.19 55.28 21.28 -31.67 55.40 22.04 -32.43 2 0 51.17 -999 ? N6A COA A1001 >TYR~B 152 53.39 25.35 -30.24 52.37 23.18 -28.77 52.88 24.26 -29.50 3 0 47.68 -999 ? N6A COA A1001 >PRO.B 153 54.19 27.31 -36.73 55.21 28.03 -34.88 54.70 27.67 -35.81 3 0 53.67 -999 ? N6A COA A1001 >ASP.B 154 51.58 31.06 -35.04 50.98 29.05 -34.87 51.28 30.06 -34.95 2 0 51.41 -999 ? N6A COA A1001 >TYR.B 155 56.05 31.25 -29.97 58.74 32.08 -29.80 57.40 31.66 -29.89 3 0 49.13 -999 ? N6A COA A1001 >GLU^B 156 52.03 35.92 -31.13 50.19 36.93 -31.48 51.11 36.43 -31.30 2 0 47.96 -999 ? N6A COA A1001 >TYR^B 157 57.89 36.88 -24.99 58.94 37.89 -22.60 58.41 37.38 -23.79 3 0 44.51 -999 ? N6A COA A1001 >THR^B 158 54.65 39.79 -24.87 52.49 39.70 -25.27 53.57 39.74 -25.07 2 0 43.36 -999 ? N6A COA A1001 >PRO^B 159 56.92 43.21 -23.39 55.72 41.52 -22.51 56.32 42.36 -22.95 3 0 43.52 -999 ? N6A COA A1001 >ILE.B 160 53.66 41.17 -17.44 53.21 40.32 -16.27 53.44 40.74 -16.86 3 0 36.62 -999 ? N6A COA A1001 >THR~B 161 51.52 45.10 -18.64 51.13 45.52 -20.74 51.33 45.31 -19.69 2 0 40.15 -999 ? N6A COA A1001 >PRO~B 162 50.17 48.07 -15.69 49.50 46.05 -16.44 49.83 47.06 -16.07 3 0 36.22 -999 ? N6A COA A1001 >ASP~B 163 46.25 46.07 -20.03 44.41 45.82 -21.06 45.33 45.95 -20.54 2 0 38.37 -999 ? N6A COA A1001 >ARG~B 164 49.80 41.68 -22.10 50.97 43.21 -24.55 50.38 42.45 -23.33 2 0 42.81 -999 ? N6A COA A1001 >ILE~B 165 47.64 41.90 -14.07 48.31 42.32 -13.70 47.97 42.11 -13.88 3 0 31.93 -999 ? N6A COA A1001 >GLN~B 166 41.37 39.59 -13.97 41.45 39.19 -11.86 41.41 39.39 -12.92 2 0 27.23 -999 ? N6A COA A1001 >GLU~B 167 43.69 36.14 -19.58 43.60 36.61 -21.64 43.65 36.38 -20.61 2 0 36.71 -999 ? N6A COA A1001 >CYH~B 168 47.37 35.72 -15.87 49.64 37.17 -17.05 48.50 36.45 -16.46 2 0 34.42 -999 ? N6A COA A1001 >LEU~B 169 45.10 36.37 -11.53 46.27 37.37 -9.94 45.68 36.87 -10.74 3 0 27.07 -999 ? N6A COA A1001 >ASP~B 170 41.63 34.17 -14.94 40.40 35.64 -14.07 41.02 34.91 -14.50 2 0 28.57 -999 ? N6A COA A1001 >LEU~B 171 45.58 31.65 -17.17 44.74 31.38 -19.19 45.16 31.51 -18.18 3 0 33.63 -999 ? N6A COA A1001 >GLU~B 172 48.94 30.68 -11.49 48.47 29.99 -9.56 48.71 30.33 -10.53 2 0 27.14 -999 ? N6A COA A1001 >ALA~B 173 44.05 29.25 -11.08 42.89 30.13 -10.63 43.47 29.69 -10.86 2 0 25.87 -999 ? N6A COA A1001 >GLU~B 174 41.67 26.69 -16.30 40.98 27.56 -18.04 41.32 27.13 -17.17 2 0 32.74 -999 ? S1P COA A1001 >TRP~B 175 46.70 26.59 -17.31 49.26 29.58 -17.62 47.98 28.09 -17.47 3 0 34.24 -999 ? N6A COA A1001 >CSS~B 176 46.56 24.66 -10.78 46.02 25.05 -8.03 46.29 24.85 -9.40 2 0 25.73 -999 ? N6A COA A1001 >LYS~B 177 43.04 23.19 -10.78 37.67 25.99 -11.06 40.35 24.59 -10.92 2 0 24.91 -999 ? S1P COA A1001 >VAL~B 178 43.97 20.89 -13.70 44.12 21.11 -15.90 44.05 21.00 -14.80 3 0 31.24 -999 ? S1P COA A1001 >ASN~B 179 48.40 20.29 -11.89 49.37 19.77 -13.70 48.88 20.03 -12.80 2 0 33.74 -999 ? N6A COA A1001 >ASN.B 180 44.59 18.15 -8.11 42.85 17.55 -9.14 43.72 17.85 -8.63 2 0 26.48 -999 ? S1P COA A1001 >CSS.B 181 47.51 21.89 -6.90 47.81 24.72 -7.09 47.66 23.31 -7.00 2 0 25.87 -999 ? N6A COA A1001 >ASP.B 182 43.55 22.19 -4.07 42.83 24.14 -3.76 43.19 23.16 -3.91 2 0 21.19 -999 ? N6A COA A1001 >GLN.B 183 44.47 17.30 -2.64 42.86 18.50 -3.34 43.66 17.90 -2.99 2 0 22.51 -999 ? C2P COA A1001 >GLN.B 184 50.53 19.47 -4.99 50.69 20.23 -6.98 50.61 19.85 -5.98 2 0 28.99 -999 ? N6A COA A1001 >GLU.B 185 52.13 19.97 2.31 51.26 20.64 4.13 51.69 20.30 3.22 2 0 22.54 -999 ? N6A COA A1001 >GLY~B 186 51.95 25.48 0.41 51.41 25.20 -0.08 51.68 25.34 0.17 1 0 22.82 -999 ? N6A COA A1001 >THR~B 187 50.14 26.28 -2.85 49.49 24.45 -3.85 49.82 25.37 -3.35 2 0 24.37 -999 ? N6A COA A1001 >GLY~B 188 47.45 28.39 -1.05 48.28 28.47 -1.13 47.86 28.43 -1.09 1 0 19.90 -999 ? N6A COA A1001 >ASN~B 189 51.21 30.12 1.44 50.40 29.88 3.40 50.80 30.00 2.42 2 0 18.78 -999 ? N6A COA A1001 >GLU~B 190 53.73 28.83 -3.16 54.37 27.17 -4.29 54.05 28.00 -3.73 2 0 27.11 -999 ? N6A COA A1001 >ARG~B 191 46.33 32.04 -6.69 44.65 32.83 -9.18 45.49 32.43 -7.93 2 0 24.96 -999 ? N6A COA A1001 >ARG~B 192 45.84 34.84 -0.10 46.17 37.01 2.09 46.00 35.93 1.00 2 0 16.65 -999 ? N6A COA A1001 >ALA~B 193 51.90 35.86 -2.80 53.15 35.08 -2.43 52.52 35.47 -2.62 2 0 24.40 -999 ? N6A COA A1001 >LEU~B 194 50.76 34.33 -7.31 50.82 33.89 -9.43 50.79 34.11 -8.37 3 0 27.24 -999 ? N6A COA A1001 >ILE~B 195 46.84 37.29 -5.45 45.47 36.97 -5.21 46.15 37.13 -5.33 3 0 22.54 -999 ? N6A COA A1001 >TYR~B 196 51.01 41.60 -2.44 51.98 44.03 -1.49 51.50 42.81 -1.96 3 0 24.82 -999 ? N6A COA A1001 >ALA~B 197 52.62 40.60 -6.80 53.59 39.46 -7.13 53.10 40.03 -6.96 2 0 28.72 -999 ? N6A COA A1001 >LEU~B 198 49.63 39.61 -10.48 50.54 38.27 -11.97 50.09 38.94 -11.22 3 0 29.83 -999 ? N6A COA A1001 >HIS~B 199 45.96 42.25 -7.08 44.21 41.08 -7.01 45.08 41.66 -7.04 3 0 24.75 -999 ? N6A COA A1001 >ASN~B 200 51.22 45.59 -5.82 49.47 45.72 -4.60 50.34 45.66 -5.21 2 0 26.64 -999 ? N6A COA A1001 >PHE~B 201 53.52 43.47 -12.47 55.34 42.03 -14.11 54.43 42.75 -13.29 3 0 34.74 -999 ? N6A COA A1001 >GLU~B 202 53.19 48.88 -13.52 55.04 48.52 -14.51 54.11 48.70 -14.01 2 0 38.00 -999 ? N6A COA A1001 >ALA~B 203 54.55 49.63 -7.65 53.40 49.64 -6.61 53.97 49.64 -7.13 2 0 32.12 -999 ? N6A COA A1001 >LEU~B 204 56.40 45.21 -6.79 55.41 44.25 -5.14 55.91 44.73 -5.97 3 0 31.05 -999 ? N6A COA A1001 >GLY~B 205 59.08 47.25 -9.84 58.66 46.54 -9.76 58.87 46.90 -9.80 1 0 36.61 -999 ? N6A COA A1001 >LEU.B 206 57.31 42.93 -11.10 57.23 41.56 -9.43 57.27 42.24 -10.27 3 0 34.05 -999 ? N6A COA A1001 >THR^B 207 58.95 43.06 -15.16 60.85 43.03 -16.20 59.90 43.04 -15.68 2 0 40.84 -999 ? N6A COA A1001 >GLY^B 208 57.67 39.90 -16.86 57.65 40.49 -17.44 57.66 40.19 -17.15 1 0 38.74 -999 ? N6A COA A1001 >GLY^B 209 56.55 38.10 -19.95 56.12 37.79 -19.27 56.33 37.94 -19.61 1 0 40.38 -999 ? N6A COA A1001 >ILE^B 210 52.31 36.89 -21.40 51.02 37.28 -20.96 51.67 37.09 -21.18 3 0 38.98 -999 ? N6A COA A1001 >LEU^B 211 54.50 32.08 -23.66 56.01 31.15 -24.92 55.26 31.61 -24.29 3 0 43.18 -999 ? N6A COA A1001 >HIS^B 212 50.20 35.34 -26.02 50.17 37.04 -24.79 50.19 36.19 -25.41 3 0 42.21 -999 ? N6A COA A1001 >VAL^B 213 50.07 29.84 -28.50 51.33 28.01 -28.40 50.70 28.93 -28.45 3 0 45.29 -999 ? N6A COA A1001 >ASN.B 214 46.54 28.17 -30.89 47.89 26.74 -31.75 47.22 27.46 -31.32 2 0 47.78 -999 ? S1P COA A1001 >GLY.B 215 45.65 32.87 -29.51 45.92 32.34 -29.03 45.79 32.61 -29.27 1 0 44.66 -999 ? N6A COA A1001 >LYS^B 216 45.69 31.91 -25.81 46.18 26.01 -24.18 45.93 28.96 -24.99 2 0 40.24 -999 ? N6A COA A1001 >ILE^B 217 47.97 33.65 -21.83 47.80 34.06 -20.49 47.88 33.85 -21.16 3 0 37.30 -999 ? N6A COA A1001 >VAL^B 218 50.00 29.45 -22.09 50.38 28.61 -24.12 50.19 29.03 -23.11 3 0 40.14 -999 ? N6A COA A1001 >ALA^B 219 52.73 30.72 -19.74 54.08 30.11 -20.23 53.40 30.42 -19.99 2 0 39.14 -999 ? N6A COA A1001 >PHE^B 220 52.06 34.27 -16.00 50.88 33.52 -13.56 51.47 33.89 -14.78 3 0 33.01 -999 ? N6A COA A1001 >THR^B 221 56.89 34.78 -15.74 58.92 34.50 -16.58 57.90 34.64 -16.16 2 0 38.69 -999 ? N6A COA A1001 >PHE^B 222 56.11 38.01 -11.99 54.70 37.13 -9.71 55.41 37.57 -10.85 3 0 32.32 -999 ? N6A COA A1001 >GLY^B 223 60.80 39.01 -11.41 60.54 39.66 -11.92 60.67 39.34 -11.66 1 0 36.54 -999 ? N6A COA A1001 >MET^B 224 62.99 41.97 -10.58 60.99 43.88 -7.32 61.99 42.92 -8.95 2 0 35.18 -999 ? N6A COA A1001 >PRO^B 225 66.30 44.79 -11.00 65.85 42.95 -9.84 66.08 43.87 -10.42 3 0 40.84 -999 ? N6A COA A1001 >ILE^B 226 68.31 40.04 -6.14 68.20 38.74 -5.69 68.25 39.39 -5.91 3 0 39.12 -999 ? N6A COA A1001 >ASN^B 227 72.30 43.00 -5.45 73.83 41.77 -6.35 73.07 42.38 -5.90 2 0 44.53 -999 ? N1A COA A1001 >HIS.B 228 75.62 45.70 -8.25 77.33 44.65 -7.63 76.48 45.17 -7.94 3 0 48.25 -999 ? N1A COA A1001 >GLU.B 229 76.22 41.40 -9.51 78.33 41.03 -9.42 77.28 41.22 -9.46 2 0 49.74 -999 ? N6A COA A1001 >THR^B 230 71.62 39.78 -9.99 72.27 38.39 -8.44 71.94 39.08 -9.21 2 0 43.67 -999 ? N6A COA A1001 >PHE^B 231 66.43 40.20 -13.23 63.84 41.09 -13.89 65.14 40.64 -13.56 3 0 41.38 -999 ? N6A COA A1001 >GLY^B 232 65.55 37.30 -9.61 65.31 37.74 -10.32 65.43 37.52 -9.96 1 0 38.68 -999 ? N6A COA A1001 >VAL^B 233 62.96 35.35 -11.58 62.91 34.51 -13.61 62.94 34.93 -12.60 3 0 38.45 -999 ? N6A COA A1001 >HIS^B 234 60.69 37.13 -7.87 61.99 38.70 -7.36 61.34 37.91 -7.62 3 0 34.26 -999 ? N6A COA A1001 >VAL^B 235 57.54 33.06 -10.81 55.47 33.51 -10.20 56.50 33.28 -10.51 3 0 32.44 -999 ? N6A COA A1001 >GLU^B 236 58.67 30.06 -15.90 60.53 29.22 -16.32 59.60 29.64 -16.11 2 0 39.65 -999 ? N6A COA A1001 >LYS^B 237 53.92 29.21 -14.64 53.12 27.89 -9.51 53.52 28.55 -12.07 2 0 29.95 -999 ? N6A COA A1001 >ALA^B 238 52.72 27.33 -17.70 53.92 26.81 -18.50 53.32 27.07 -18.10 2 0 37.95 -999 ? N6A COA A1001 >ASP.B 239 49.08 25.80 -20.42 47.60 24.44 -21.10 48.34 25.12 -20.76 2 0 38.11 -999 ? N6A COA A1001 >THR.B 240 51.33 21.84 -18.74 51.00 21.26 -16.68 51.17 21.55 -17.71 2 0 36.39 -999 ? N6A COA A1001 >SER.B 241 49.55 20.65 -21.92 47.72 22.09 -22.69 48.63 21.37 -22.30 2 0 39.74 -999 ? S1P COA A1001 >ILE.B 242 51.78 24.27 -24.08 51.02 24.59 -25.32 51.40 24.43 -24.70 3 0 42.74 -999 ? N6A COA A1001 >ASP.B 243 55.54 19.80 -25.56 57.21 18.54 -25.13 56.38 19.17 -25.34 2 0 47.10 -999 ? N6A COA A1001 >GLY~B 244 58.29 23.28 -24.17 57.60 23.50 -23.85 57.95 23.39 -24.01 1 0 45.60 -999 ? N6A COA A1001 >ALA~B 245 56.36 26.33 -22.87 54.88 26.36 -22.45 55.62 26.34 -22.66 2 0 41.89 -999 ? N6A COA A1001 >TYR~B 246 57.75 25.31 -17.67 55.70 25.11 -15.78 56.72 25.21 -16.73 3 0 38.26 -999 ? N6A COA A1001 >ALA~B 247 61.76 26.40 -21.84 62.25 25.20 -22.68 62.01 25.80 -22.26 2 0 46.19 -999 ? N6A COA A1001 >MET~B 248 60.48 28.99 -24.30 60.90 30.45 -27.16 60.69 29.72 -25.73 2 0 48.53 -999 ? N6A COA A1001 >ILE~B 249 58.03 31.68 -20.96 57.23 32.16 -19.88 57.63 31.92 -20.42 3 0 41.04 -999 ? N6A COA A1001 >ASN~B 250 63.10 29.79 -19.43 64.91 29.75 -18.27 64.01 29.77 -18.85 2 0 43.95 -999 ? N6A COA A1001 >TYR~B 251 65.39 31.59 -25.28 66.93 32.59 -27.38 66.16 32.09 -26.33 3 0 50.81 -999 ? N6A COA A1001 >GLU~B 252 60.71 34.14 -25.90 60.89 35.40 -27.60 60.80 34.77 -26.75 2 0 48.89 -999 ? N6A COA A1001 >PHE~B 253 61.53 37.20 -18.35 61.45 39.14 -16.30 61.49 38.17 -17.32 3 0 41.18 -999 ? N6A COA A1001 >ALA~B 254 66.10 36.03 -20.08 66.89 34.72 -20.20 66.49 35.37 -20.14 2 0 46.62 -999 ? N6A COA A1001 >ASN~B 255 66.35 37.58 -24.68 67.78 36.18 -25.36 67.07 36.88 -25.02 2 0 51.15 -999 ? N6A COA A1001 >ARG~B 256 62.56 41.29 -24.14 60.14 41.75 -25.98 61.35 41.52 -25.06 2 0 47.88 -999 ? N6A COA A1001 >ILE~B 257 67.05 39.84 -17.69 67.08 39.01 -16.56 67.06 39.43 -17.13 3 0 44.98 -999 ? N6A COA A1001 >PRO.B 258 67.30 45.25 -17.58 68.41 43.63 -18.61 67.85 44.44 -18.09 3 0 47.17 -999 ? N6A COA A1001 >GLU.B 259 73.60 44.74 -21.11 74.04 45.02 -23.15 73.82 44.88 -22.13 2 0 55.05 -999 ? N6A COA A1001 >GLN.B 260 72.24 46.20 -15.13 71.06 47.28 -16.59 71.65 46.74 -15.86 2 0 49.24 -999 ? N6A COA A1001 >TYR.B 261 70.25 42.68 -13.80 69.22 45.09 -12.82 69.74 43.89 -13.31 3 0 45.35 -999 ? N6A COA A1001 >ILE.B 262 76.67 39.33 -14.62 77.32 39.43 -15.88 76.99 39.38 -15.25 3 0 51.41 -999 ? N6A COA A1001 >TYR^B 263 75.42 36.42 -11.18 78.21 36.39 -11.06 76.81 36.41 -11.12 3 0 48.73 -999 ? N6A COA A1001 >ILE^B 264 69.25 34.69 -14.02 68.25 34.82 -15.15 68.75 34.75 -14.59 3 0 44.10 -999 ? N6A COA A1001 >ASN^B 265 68.59 34.58 -8.15 68.34 33.43 -6.37 68.47 34.00 -7.26 2 0 38.91 -999 ? N6A COA A1001 >ARG.B 266 66.24 30.39 -13.93 63.34 29.93 -14.92 64.79 30.16 -14.43 2 0 40.43 -999 ? N6A COA A1001 >GLU.B 267 63.60 32.32 -6.71 61.96 33.34 -5.84 62.78 32.83 -6.28 2 0 33.31 -999 ? N6A COA A1001 >GLU.B 268 65.06 28.38 -2.39 63.51 29.81 -2.20 64.28 29.09 -2.30 2 0 32.78 -999 ? N6A COA A1001 >ASP.B 269 65.05 22.46 -5.91 66.36 21.60 -4.47 65.71 22.03 -5.19 2 0 37.98 -999 ? N6A COA A1001 >LEU.B 270 60.80 23.30 -2.24 59.97 25.29 -2.36 60.38 24.30 -2.30 3 0 31.23 -999 ? N6A COA A1001 >GLY.B 271 63.69 19.38 -1.81 63.13 19.67 -2.35 63.41 19.52 -2.08 1 0 35.32 -999 ? N6A COA A1001 >ILE~B 272 60.18 19.21 -5.22 58.88 19.69 -5.40 59.53 19.45 -5.31 3 0 33.87 -999 ? N6A COA A1001 >GLU~B 273 63.58 13.25 -7.38 63.04 11.22 -7.08 63.31 12.23 -7.23 2 0 41.14 -999 ? N6A COA A1001 >GLY~B 274 61.66 16.75 -10.04 61.97 17.25 -9.45 61.82 17.00 -9.75 1 0 39.25 -999 ? N6A COA A1001 >LEU~B 275 61.62 21.24 -8.22 61.02 23.31 -8.55 61.32 22.28 -8.39 3 0 36.01 -999 ? N6A COA A1001 >ARG~B 276 68.32 18.09 -5.72 67.78 18.42 -2.70 68.05 18.25 -4.21 2 0 39.42 -999 ? N6A COA A1001 >LYS~B 277 66.37 17.88 -11.53 65.35 12.83 -9.84 65.86 15.36 -10.68 2 0 43.38 -999 ? N6A COA A1001 >ALA~B 278 64.86 20.75 -13.57 63.44 21.25 -13.45 64.15 21.00 -13.51 2 0 41.06 -999 ? N6A COA A1001 >LYS~B 279 66.93 23.47 -11.89 63.23 27.11 -8.31 65.08 25.29 -10.10 2 0 36.29 -999 ? N6A COA A1001 >LEU~B 280 70.56 20.13 -11.43 71.49 19.97 -9.45 71.03 20.05 -10.44 3 0 45.25 -999 ? N6A COA A1001 >SER~B 281 69.48 20.81 -15.85 67.22 21.22 -16.62 68.35 21.01 -16.24 2 0 45.82 -999 ? N6A COA A1001 >TYR~B 282 67.92 25.72 -17.21 65.79 25.88 -19.06 66.85 25.80 -18.14 3 0 45.65 -999 ? N6A COA A1001 >GLN.B 283 73.84 23.25 -17.67 74.87 21.35 -17.72 74.35 22.30 -17.69 2 0 52.09 -999 ? N6A COA A1001 >PRO.B 284 73.10 24.86 -10.95 73.67 26.15 -12.76 73.38 25.50 -11.86 3 0 46.72 -999 ? N6A COA A1001 >VAL.B 285 77.05 28.59 -11.80 77.18 30.48 -12.92 77.11 29.54 -12.36 3 0 49.64 -999 ? N6A COA A1001 >THR^B 286 76.38 28.78 -8.04 77.15 30.50 -6.97 76.76 29.64 -7.50 2 0 46.98 -999 ? N6A COA A1001 >ILE^B 287 73.98 25.32 -5.59 73.35 24.08 -5.84 73.66 24.70 -5.71 3 0 44.02 -999 ? N6A COA A1001 >LEU^B 288 73.13 30.86 -3.31 73.74 32.81 -2.51 73.44 31.83 -2.91 3 0 41.85 -999 ? N6A COA A1001 >GLU.B 289 75.34 26.01 0.40 74.22 24.31 -0.27 74.78 25.16 0.07 2 0 42.47 -999 ? N6A COA A1001 >LYS.B 290 71.49 29.71 3.21 66.97 31.77 -0.62 69.23 30.74 1.29 2 0 35.01 -999 ? N6A COA A1001 >TYR^B 291 74.68 28.36 6.90 76.71 26.83 5.72 75.69 27.60 6.31 3 0 41.26 -999 ? N1A COA A1001 >MET^B 292 70.01 29.61 9.84 66.67 28.77 12.11 68.34 29.19 10.97 2 0 31.25 -999 ? C2A COA A1001 >ALA^B 293 72.16 30.94 12.72 73.10 32.08 12.33 72.63 31.51 12.52 2 0 37.21 -999 ? C2A COA A1001 >CSS^B 294 70.70 30.59 16.22 68.34 29.47 15.26 69.52 30.03 15.74 2 0 32.45 -999 ? C2A COA A1001 >LEU^B 295 71.86 33.13 20.14 73.19 34.71 20.71 72.53 33.92 20.42 3 0 36.42 -999 ? C2A COA A1001 >LYS.B 296 73.41 28.93 21.61 78.76 26.18 20.06 76.09 27.55 20.83 2 0 43.22 -999 ? O8A COA A1001