REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 08-APR-04 1T0B COMPND THUA-LIKE PROTEIN; COMPND 3 CHAIN: A, B, C, D, E, F, G, H; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; SOURCE 3 ORGANISM_TAXID: 1422; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562 AUTHOR D.BOREK,Y.CHEN,F.COLLART,A.JOACHIMIAK,Z.OTWINOWSKI,MIDWEST AUTHOR 2 CENTER FOR STRUCTURAL GENOMICS (MCSG) HET ZN A3001 1 HET ZN B3002 1 HET ZN C3003 1 HET ZN H3004 1 HET ZN E3005 1 HET ZN F3006 1 HET ZN G3007 1 HET ZN D3008 1 SITE 1 AC1 6 HIS A 101 GLU A 153 TYR A 155 HIS A 199 SITE 1 AC2 6 HIS B 101 GLU B 153 HIS B 199 GLU B 200 SITE 1 AC3 6 HIS C 101 GLU C 153 TYR C 155 HIS C 199 SITE 1 AC4 7 HIS H 101 GLU H 153 TYR H 155 HIS H 199 SITE 1 AC5 6 HIS E 101 GLU E 153 TYR E 155 HIS E 199 SITE 1 AC6 6 HIS F 101 GLU F 153 TYR F 155 HIS F 199 SITE 1 AC7 5 HIS G 101 GLU G 153 HIS G 199 HOH G 359 SITE 1 AC8 6 HIS D 101 GLU D 153 TYR D 155 HIS D 199 >THR.A 3 36.51 50.50 32.33 36.84 49.47 30.45 36.67 49.98 31.39 2 0 35.13 -999 ? ZN ZN A3001 >PRO.A 4 33.69 48.10 34.78 35.85 48.80 34.86 34.77 48.45 34.82 3 0 31.84 -999 ? ZN ZN A3001 >ILE.A 5 39.44 45.99 37.61 40.67 46.21 38.26 40.05 46.10 37.93 3 0 27.11 -999 ? ZN ZN A3001 >ARG^A 6 36.71 39.54 33.61 33.91 38.62 34.36 35.31 39.08 33.98 2 0 26.47 -999 ? ZN ZN A3001 >VAL^A 7 38.03 39.88 38.24 37.71 40.25 40.36 37.87 40.07 39.30 3 0 22.30 -999 ? ZN ZN A3001 >VAL^A 8 37.37 36.11 38.31 37.42 34.77 36.59 37.39 35.44 37.45 3 0 21.37 -999 ? ZN ZN A3001 >VAL^A 9 37.06 34.50 41.74 36.28 35.49 43.42 36.67 35.00 42.58 3 0 17.19 -999 ? ZN ZN A3001 >TRP^A 10 38.91 28.60 39.11 40.16 25.88 41.67 39.53 27.24 40.39 3 0 15.79 -999 ? ZN ZN A3001 >ASN^A 11 36.02 29.07 45.03 35.63 28.20 46.96 35.83 28.64 45.99 2 0 11.62 -999 ? ZN ZN A3001 >GLU.A 12 38.48 22.75 46.05 39.98 22.34 47.41 39.23 22.54 46.73 2 0 9.52 -999 ? ZN ZN A3001 >PHE.A 13 31.75 25.38 45.11 29.04 25.76 45.44 30.40 25.57 45.28 3 0 16.28 -999 ? ZN ZN A3001 >ARG~A 14 35.01 18.98 45.42 36.93 17.44 43.54 35.97 18.21 44.48 2 0 15.99 -999 ? ZN ZN A3001 >HIS~A 15 36.25 22.40 52.44 38.08 21.60 53.06 37.17 22.00 52.75 3 0 7.51 -999 ? ZN ZN A3001 >GLU~A 16 31.58 26.35 50.60 33.36 26.43 49.37 32.47 26.39 49.98 2 0 11.46 -999 ? ZN ZN A3001 >LYS~A 17 29.11 20.81 49.56 29.47 21.44 43.31 29.29 21.13 46.43 2 0 18.81 -999 ? ZN ZN A3001 >LYS~A 18 30.77 18.27 51.87 34.90 15.43 50.88 32.83 16.85 51.38 2 0 14.00 -999 ? ZN ZN A3001 >ASP~A 19 31.90 20.32 55.67 33.58 19.12 54.82 32.74 19.72 55.25 2 0 11.50 -999 ? ZN ZN A3001 >GLU~A 20 25.49 20.84 58.76 26.46 21.73 60.43 25.97 21.29 59.59 2 0 17.53 -999 ? ZN ZN A3001 >GLN~A 21 30.38 24.28 61.16 32.27 25.17 60.72 31.33 24.73 60.94 2 0 11.70 -999 ? ZN ZN A3001 >VAL~A 22 30.75 25.11 56.12 32.65 24.72 55.04 31.70 24.92 55.58 3 0 11.19 -999 ? ZN ZN A3001 >ARG~A 23 25.27 22.74 51.94 23.69 22.14 49.30 24.48 22.44 50.62 2 0 20.56 -999 ? ZN ZN A3001 >ALA~A 24 25.86 26.94 56.82 25.82 26.48 58.28 25.84 26.71 57.55 2 0 17.22 -999 ? ZN ZN A3001 >ILE~A 25 29.84 29.74 57.07 30.85 29.98 58.01 30.35 29.86 57.54 3 0 13.24 -999 ? ZN ZN A3001 >TYR~A 26 31.35 30.40 53.19 33.25 31.98 54.53 32.30 31.19 53.86 3 0 11.96 -999 ? ZN ZN A3001 >PRO.A 27 24.58 30.08 52.08 26.23 28.65 51.62 25.40 29.36 51.85 3 0 18.21 -999 ? ZN ZN A3001 >GLU.A 28 24.49 30.69 47.53 23.90 32.57 46.82 24.19 31.63 47.18 2 0 22.00 -999 ? ZN ZN A3001 >GLY~A 29 30.33 29.02 48.17 29.97 29.68 48.48 30.15 29.35 48.32 1 0 14.97 -999 ? ZN ZN A3001 >MET~A 30 33.04 31.46 49.32 35.87 29.75 51.88 34.45 30.61 50.60 2 0 8.88 -999 ? ZN ZN A3001 >HIS~A 31 32.54 30.68 44.26 31.15 29.14 44.08 31.85 29.91 44.17 3 0 16.49 -999 ? ZN ZN A3001 >THR~A 32 29.88 33.99 45.68 28.01 32.94 45.35 28.94 33.46 45.51 2 0 19.46 -999 ? ZN ZN A3001 >VAL~A 33 30.45 36.01 48.86 30.44 35.64 51.00 30.45 35.83 49.93 3 0 16.94 -999 ? ZN ZN A3001 >ILE~A 34 35.10 36.66 47.40 36.46 36.31 47.71 35.78 36.49 47.56 3 0 15.16 -999 ? ZN ZN A3001 >ALA~A 35 32.48 38.12 44.09 32.12 37.13 43.03 32.30 37.62 43.56 2 0 20.10 -999 ? ZN ZN A3001 >SER~A 36 29.33 39.81 45.46 27.65 38.18 45.73 28.49 39.00 45.60 2 0 21.98 -999 ? ZN ZN A3001 >TYR~A 37 33.07 43.05 49.28 34.28 45.22 50.53 33.67 44.13 49.91 3 0 21.26 -999 ? ZN ZN A3001 >LEU~A 38 34.62 41.98 43.90 36.64 41.41 44.64 35.63 41.69 44.27 3 0 20.85 -999 ? ZN ZN A3001 >ALA~A 39 30.66 43.59 42.32 29.56 42.61 42.04 30.11 43.10 42.18 2 0 25.40 -999 ? ZN ZN A3001 >GLU~A 40 27.47 45.12 46.40 26.85 44.93 48.40 27.16 45.02 47.40 2 0 25.94 -999 ? ZN ZN A3001 >ALA~A 41 32.67 47.78 45.03 33.89 47.19 45.68 33.28 47.49 45.35 2 0 25.23 -999 ? ZN ZN A3001 >GLY.A 42 32.48 48.46 41.28 32.80 47.76 41.46 32.64 48.11 41.37 1 0 28.77 -999 ? ZN ZN A3001 >PHE.A 43 36.37 45.20 41.46 38.42 46.37 42.94 37.40 45.78 42.20 3 0 24.70 -999 ? ZN ZN A3001 >ASP^A 44 33.54 43.72 35.48 32.64 42.40 34.05 33.09 43.06 34.76 2 0 29.14 -999 ? ZN ZN A3001 >ALA^A 45 33.16 40.21 38.99 32.79 40.35 40.46 32.97 40.28 39.72 2 0 23.35 -999 ? ZN ZN A3001 >ALA^A 46 32.63 36.57 37.84 32.95 36.30 36.43 32.79 36.43 37.14 2 0 24.10 -999 ? ZN ZN A3001 >THR^A 47 33.28 33.24 39.43 31.53 33.15 40.76 32.41 33.19 40.09 2 0 20.16 -999 ? ZN ZN A3001 >ALA^A 48 34.77 29.86 38.42 35.92 30.05 37.56 35.35 29.96 37.99 2 0 19.93 -999 ? ZN ZN A3001 >VAL^A 49 35.01 26.55 40.20 32.89 26.42 40.79 33.95 26.48 40.49 3 0 17.69 -999 ? ZN ZN A3001 >LEU.A 50 37.54 22.55 41.21 39.03 20.95 41.34 38.29 21.75 41.28 3 0 15.74 -999 ? ZN ZN A3001 >ASP.A 51 33.12 20.39 39.94 34.24 19.24 41.38 33.68 19.81 40.66 2 0 18.03 -999 ? ZN ZN A3001 >GLU~A 52 32.77 25.28 36.37 32.80 27.23 35.67 32.78 26.25 36.02 2 0 22.51 -999 ? ZN ZN A3001 >PRO~A 53 32.72 22.19 31.33 34.50 22.31 32.68 33.61 22.25 32.01 3 0 25.75 -999 ? ZN ZN A3001 >GLU~A 54 38.64 23.71 29.75 39.06 24.85 28.04 38.85 24.28 28.90 2 0 28.00 -999 ? ZN ZN A3001 >HIS~A 55 39.76 23.17 36.51 40.56 21.23 36.42 40.16 22.20 36.47 3 0 19.83 -999 ? ZN ZN A3001 >GLY~A 56 36.02 27.51 34.38 36.81 27.34 34.22 36.41 27.43 34.30 1 0 22.51 -999 ? ZN ZN A3001 >LEU~A 57 40.50 28.76 34.09 40.52 29.76 35.97 40.51 29.26 35.03 3 0 21.15 -999 ? ZN ZN A3001 >THR~A 58 39.08 28.61 29.35 36.98 28.64 28.91 38.03 28.63 29.13 2 0 27.63 -999 ? ZN ZN A3001 >ASP~A 59 41.69 30.50 25.71 43.36 29.14 25.72 42.52 29.82 25.71 2 0 30.23 -999 ? ZN ZN A3001 >GLU~A 60 37.17 31.68 24.67 37.33 29.65 25.28 37.25 30.67 24.98 2 0 31.21 -999 ? ZN ZN A3001 >VAL~A 61 37.64 33.60 30.21 36.60 32.59 31.83 37.12 33.09 31.02 3 0 26.41 -999 ? ZN ZN A3001 >LEU~A 62 42.39 33.12 31.14 42.88 31.79 32.79 42.63 32.46 31.97 3 0 24.70 -999 ? ZN ZN A3001 >ASP~A 63 41.69 36.15 26.67 43.12 34.65 25.93 42.41 35.40 26.30 2 0 31.11 -999 ? ZN ZN A3001 >ARG~A 64 35.75 37.65 28.80 33.89 35.37 27.87 34.82 36.51 28.33 2 0 30.80 -999 ? ZN ZN A3001 >CYH.A 65 40.39 38.37 33.19 40.80 36.88 35.51 40.60 37.63 34.35 2 0 23.15 -999 ? ZN ZN A3001 >ASP.A 66 41.83 42.60 34.88 41.13 43.56 33.12 41.48 43.08 34.00 2 0 28.79 -999 ? ZN ZN A3001 >VAL^A 67 42.81 39.67 38.10 43.17 41.08 39.67 42.99 40.37 38.88 3 0 22.26 -999 ? ZN ZN A3001 >LEU^A 68 42.97 34.93 38.45 42.28 32.97 38.13 42.62 33.95 38.29 3 0 19.26 -999 ? ZN ZN A3001 >VAL^A 69 41.50 35.29 42.87 40.44 36.62 44.22 40.97 35.96 43.54 3 0 15.96 -999 ? ZN ZN A3001 >TRP^A 70 43.72 28.72 43.94 43.47 27.83 40.17 43.60 28.28 42.06 3 0 13.94 -999 ? ZN ZN A3001 >TRP^A 71 40.11 30.43 50.24 39.24 26.72 51.03 39.68 28.57 50.64 3 0 6.61 -999 ? ZN ZN A3001 >GLY.A 72 41.76 25.81 47.16 42.05 26.24 47.84 41.91 26.03 47.50 1 0 8.68 -999 ? ZN ZN A3001 >HIS.A 73 41.95 22.92 52.25 42.35 22.23 54.19 42.15 22.58 53.22 3 0 4.22 -999 ? ZN ZN A3001 >ILE.A 74 40.42 19.06 50.31 39.24 19.11 51.07 39.83 19.09 50.69 3 0 9.00 -999 ? ZN ZN A3001 >ALA~A 75 41.71 19.13 45.76 40.29 19.15 45.17 41.00 19.14 45.46 2 0 12.82 -999 ? ZN ZN A3001 >HIS~A 76 45.77 22.36 46.52 45.38 23.91 47.89 45.57 23.14 47.21 3 0 9.39 -999 ? ZN ZN A3001 >ASP~A 77 45.83 16.51 43.54 44.27 16.57 45.25 45.05 16.54 44.40 2 0 14.11 -999 ? ZN ZN A3001 >GLU~A 78 41.28 16.46 42.00 39.30 16.05 42.61 40.29 16.26 42.31 2 0 16.80 -999 ? ZN ZN A3001 >VAL~A 79 43.56 21.11 38.80 43.56 23.15 39.43 43.56 22.13 39.12 3 0 17.08 -999 ? ZN ZN A3001 >LYS~A 80 44.79 19.92 35.43 40.94 16.57 34.64 42.87 18.25 35.03 2 0 23.16 -999 ? ZN ZN A3001 >ASP~A 81 49.42 19.87 34.13 50.06 18.72 35.87 49.74 19.29 35.00 2 0 22.34 -999 ? ZN ZN A3001 >GLU~A 82 45.90 22.47 28.91 44.83 21.48 27.40 45.36 21.97 28.16 2 0 28.77 -999 ? ZN ZN A3001 >VAL~A 83 45.02 24.85 33.04 42.91 24.88 33.70 43.97 24.87 33.37 3 0 22.45 -999 ? ZN ZN A3001 >VAL~A 84 47.83 25.64 35.55 48.68 24.55 37.25 48.25 25.09 36.40 3 0 20.13 -999 ? ZN ZN A3001 >GLU~A 85 51.25 25.87 30.31 53.24 26.47 30.77 52.24 26.17 30.54 2 0 23.18 -999 ? ZN ZN D3008 >ARG~A 86 43.89 28.50 29.58 42.70 25.73 29.05 43.29 27.11 29.31 2 0 26.72 -999 ? ZN ZN A3001 >VAL~A 87 47.11 30.59 34.11 45.92 30.41 35.91 46.52 30.50 35.01 3 0 21.59 -999 ? ZN ZN A3001 >HIS~A 88 53.23 29.86 34.92 55.28 30.17 35.12 54.25 30.01 35.02 3 0 23.22 -999 ? ZN ZN D3008 >ARG~A 89 51.55 29.89 27.93 49.03 28.10 27.78 50.29 29.00 27.86 2 0 26.49 -999 ? ZN ZN D3008 >ARG~A 90 46.08 35.02 29.76 46.01 38.00 30.67 46.04 36.51 30.21 2 0 28.05 -999 ? ZN ZN A3001 >VAL~A 91 50.19 35.97 34.99 50.21 35.30 37.05 50.20 35.64 36.02 3 0 23.23 -999 ? ZN ZN A3001 >LEU~A 92 54.53 35.32 32.76 55.76 33.93 33.94 55.14 34.62 33.35 3 0 21.96 -999 ? ZN ZN D3008 >GLU~A 93 51.30 36.95 28.73 49.81 36.13 27.49 50.56 36.54 28.11 2 0 25.96 -999 ? ZN ZN D3008 >GLY.A 94 50.36 40.74 33.27 50.03 40.09 33.33 50.20 40.42 33.30 1 0 27.83 -999 ? ZN ZN D3008 >MET.A 95 47.25 39.14 34.74 44.44 36.08 34.51 45.85 37.61 34.63 2 0 23.64 -999 ? ZN ZN A3001 >GLY^A 96 47.05 39.74 38.50 46.69 39.08 38.08 46.87 39.41 38.29 1 0 22.55 -999 ? ZN ZN A3001 >LEU^A 97 47.77 35.70 40.67 47.39 33.60 40.92 47.58 34.65 40.80 3 0 17.99 -999 ? ZN ZN A3001 >ILE^A 98 44.16 37.81 44.88 44.75 38.89 45.37 44.45 38.35 45.13 3 0 16.48 -999 ? ZN ZN A3001 >VAL^A 99 46.05 33.68 46.36 47.58 32.25 45.74 46.82 32.97 46.05 3 0 12.67 -999 ? ZN ZN A3001 >LEU^A 100 42.45 33.39 49.35 41.55 35.25 48.84 42.00 34.32 49.09 3 0 10.80 -999 ? ZN ZN A3001 >HIS.A 101 43.08 29.91 54.32 43.17 28.78 56.09 43.12 29.34 55.20 3 0 -3.52 -999 ? ZN ZN A3001s >SER~A 102 45.12 27.24 51.62 42.80 26.54 51.83 43.96 26.89 51.72 2 0 4.00 -999 ? ZN ZN A3001 >GLY~A 103 45.78 28.54 48.10 46.24 28.37 48.75 46.01 28.46 48.43 1 0 8.63 -999 ? ZN ZN A3001 >HIS~A 104 49.72 27.61 51.61 49.60 25.94 52.86 49.66 26.78 52.24 3 0 7.73 -999 ? ZN ZN A3001 >PHE~A 105 50.25 23.20 50.14 52.07 22.24 51.99 51.16 22.72 51.06 3 0 10.06 -999 ? ZN ZN A3001 >SER~A 106 47.89 25.34 44.89 47.85 27.76 44.35 47.87 26.55 44.62 2 0 12.61 -999 ? ZN ZN A3001 >LYS~A 107 49.74 24.18 41.87 47.94 19.02 38.77 48.84 21.60 40.32 2 0 19.02 -999 ? ZN ZN A3001 >ILE~A 108 48.51 28.51 39.99 48.71 29.26 39.61 48.61 28.89 39.80 3 0 17.24 -999 ? ZN ZN A3001 >PHE~A 109 51.27 30.52 45.76 52.48 32.37 47.38 51.88 31.45 46.57 3 0 14.05 -999 ? ZN ZN A3001 >LYS~A 110 53.84 26.71 43.94 53.34 21.18 45.92 53.59 23.95 44.93 2 0 15.14 -999 ? ZN ZN A3001 >LYS~A 111 54.79 26.98 40.27 55.74 25.45 35.12 55.27 26.22 37.70 2 0 22.65 -999 ? ZN ZN D3008 >LEU~A 112 54.05 31.72 40.65 52.83 32.61 39.12 53.44 32.16 39.88 3 0 20.11 -999 ? ZN ZN A3001 >MET~A 113 57.19 30.61 43.74 55.84 32.87 45.65 56.51 31.74 44.70 2 0 17.89 -999 ? ZN ZN A3001 >GLY~A 114 59.63 27.80 42.94 59.23 27.79 43.63 59.43 27.80 43.29 1 0 21.21 -999 ? ZN ZN A3001 >THR.A 115 59.48 26.46 46.52 59.60 28.41 47.41 59.54 27.43 46.96 2 0 18.90 -999 ? ZN ZN A3001 >THR.A 116 57.28 23.99 48.43 58.39 22.97 50.01 57.83 23.48 49.22 2 0 16.83 -999 ? ZN ZN A3001 >CYH.A 117 55.11 26.69 50.04 54.72 28.05 47.67 54.92 27.37 48.86 2 0 14.54 -999 ? ZN ZN A3001 >ASN.A 118 55.66 23.18 53.33 54.54 21.53 54.21 55.10 22.36 53.77 2 0 12.57 -999 ? ZN ZN A3001 >LEU.A 119 53.34 26.94 56.35 51.17 26.86 55.78 52.25 26.90 56.06 3 0 9.47 -999 ? ZN ZN A3001 >LYS^A 120 53.40 24.85 60.10 58.77 24.74 63.67 56.08 24.79 61.88 2 0 17.81 -999 ? ZN ZN A3001 >TRP^A 121 49.84 22.29 58.54 46.59 20.46 59.75 48.21 21.37 59.14 3 0 7.77 -999 ? ZN ZN A3001 >ARG^A 122 47.17 24.49 67.37 49.39 26.63 67.31 48.28 25.56 67.34 2 0 13.29 -999 ? ZN ZN A3001 >GLU^A 123 40.93 23.65 62.23 39.70 22.30 61.03 40.32 22.97 61.63 2 0 7.10 -999 ? ZN ZN A3001 >ALA^A 124 42.28 25.27 66.93 43.51 25.19 67.83 42.89 25.23 67.38 2 0 12.09 -999 ? ZN ZN A3001 >ASP^A 125 38.50 27.72 67.36 37.59 25.95 66.64 38.05 26.84 67.00 2 0 12.07 -999 ? ZN ZN A3001 >GLU^A 126 44.70 30.22 66.95 46.35 28.96 67.17 45.53 29.59 67.06 2 0 12.32 -999 ? ZN ZN A3001 >LYS^A 127 42.69 34.33 67.62 42.40 38.09 72.16 42.55 36.21 69.89 2 0 20.45 -999 ? ZN ZN A3001 >GLU^A 128 45.54 35.99 62.34 45.32 35.14 60.38 45.43 35.56 61.36 2 0 10.64 -999 ? ZN ZN A3001 >ARG^A 129 46.54 42.43 67.37 45.63 40.82 69.78 46.09 41.63 68.57 2 0 20.67 -999 ? ZN ZN A3001 >LEU^A 130 46.38 40.54 60.00 45.28 38.81 59.23 45.83 39.67 59.61 3 0 14.63 -999 ? ZN ZN A3001 >TRP^A 131 50.22 42.21 64.91 49.48 45.56 66.84 49.85 43.88 65.88 3 0 18.80 -999 ? ZN ZN C3003 >VAL^A 132 50.14 46.06 59.02 48.88 47.61 58.01 49.51 46.84 58.52 3 0 22.17 -999 ? ZN ZN A3001 >VAL.A 133 53.85 46.48 58.29 54.56 44.42 58.77 54.20 45.45 58.53 3 0 20.90 -999 ? ZN ZN C3003 >ALA.A 134 53.60 48.47 54.95 53.61 47.64 53.72 53.61 48.06 54.33 2 0 24.37 -999 ? ZN ZN A3001 >PRO.A 135 53.18 51.99 57.45 51.89 50.86 56.02 52.54 51.43 56.74 3 0 23.11 -999 ? ZN ZN C3003 >GLY.A 136 51.58 53.29 52.93 51.49 52.46 52.90 51.54 52.87 52.91 1 0 27.09 -999 ? ZN ZN C3003 >HIS~A 137 51.23 48.16 49.64 51.31 47.06 47.85 51.27 47.61 48.74 3 0 24.34 -999 ? ZN ZN A3001 >PRO~A 138 48.97 51.06 46.65 48.27 50.61 48.72 48.62 50.84 47.68 3 0 26.87 -999 ? ZN ZN A3001 >ILE~A 139 47.36 45.95 49.79 47.60 44.58 49.37 47.48 45.26 49.58 3 0 20.87 -999 ? ZN ZN A3001 >VAL~A 140 45.95 48.63 53.18 47.83 48.32 54.24 46.89 48.47 53.71 3 0 23.05 -999 ? ZN ZN A3001 >GLU~A 141 42.44 53.31 50.70 41.91 53.89 48.75 42.17 53.60 49.72 2 0 28.90 -999 ? ZN ZN A3001 >GLY.A 142 41.15 52.06 54.77 41.79 51.67 54.91 41.47 51.87 54.84 1 0 26.26 -999 ? ZN ZN A3001 >ILE.A 143 43.44 48.31 56.55 42.56 47.21 56.58 43.00 47.76 56.56 3 0 21.90 -999 ? ZN ZN A3001 >GLY.A 144 43.67 50.30 60.69 44.04 49.67 60.21 43.85 49.98 60.45 1 0 24.93 -999 ? ZN ZN A3001 >PRO.A 145 45.85 49.85 64.42 46.24 49.47 62.26 46.05 49.66 63.34 3 0 22.66 -999 ? ZN ZN C3003 >TYR^A 146 45.47 45.31 65.06 44.38 46.13 67.49 44.93 45.72 66.27 3 0 22.35 -999 ? ZN ZN C3003 >ILE^A 147 42.70 42.67 60.16 42.11 42.52 58.86 42.41 42.59 59.51 3 0 17.14 -999 ? ZN ZN A3001 >GLU^A 148 41.69 40.62 66.82 41.65 41.52 68.70 41.67 41.07 67.76 2 0 20.33 -999 ? ZN ZN A3001 >LEU^A 149 40.40 36.87 62.42 40.27 37.49 60.35 40.33 37.18 61.38 3 0 12.87 -999 ? ZN ZN A3001 >GLU^A 150 36.83 37.67 67.55 38.13 38.34 69.13 37.48 38.00 68.34 2 0 18.87 -999 ? ZN ZN A3001 >GLN^A 151 36.80 31.70 66.56 35.42 30.09 66.95 36.11 30.90 66.75 2 0 14.06 -999 ? ZN ZN A3001 >GLU^A 152 41.22 32.99 60.53 41.20 31.70 58.86 41.21 32.35 59.70 2 0 6.80 -999 ? ZN ZN A3001 >GLU^A 153 44.32 26.44 60.20 43.91 24.99 58.81 44.12 25.72 59.51 2 0 -3.34 -999 ? ZN ZN A3001s >MET^A 154 46.98 29.03 62.46 50.41 28.25 63.16 48.70 28.64 62.81 2 0 10.84 -999 ? ZN ZN A3001 >TYR^A 155 48.56 28.97 57.46 46.68 28.00 55.59 47.62 28.49 56.52 3 0 -5.49 -999 ? ZN ZN A3001s >GLY^A 156 53.18 29.52 61.15 53.23 29.20 60.41 53.21 29.36 60.78 1 0 12.21 -999 ? ZN ZN A3001 >GLU.A 157 56.84 32.81 59.82 57.07 33.03 57.73 56.96 32.92 58.78 2 0 16.04 -999 ? ZN ZN A3001 >PHE.A 158 60.81 28.90 56.80 61.81 29.55 54.37 61.31 29.23 55.58 3 0 18.77 -999 ? ZN ZN A3001 >PHE.A 159 54.79 30.82 54.12 52.89 31.05 52.08 53.84 30.93 53.10 3 0 12.40 -999 ? ZN ZN A3001 >ASP.A 160 58.93 26.63 52.28 60.55 26.20 50.86 59.74 26.42 51.57 2 0 18.37 -999 ? ZN ZN A3001 >ILE.A 161 57.09 32.03 50.22 56.15 32.73 50.88 56.62 32.38 50.55 3 0 16.10 -999 ? ZN ZN A3001 >PRO.A 162 59.67 32.60 46.26 60.28 32.70 48.40 59.97 32.65 47.33 3 0 20.26 -999 ? ZN ZN A3001 >GLU.A 163 62.50 38.49 51.19 64.41 39.40 51.41 63.46 38.94 51.30 2 0 25.83 -999 ? ZN ZN A3001 >PRO.A 164 57.37 38.01 51.33 58.75 38.21 49.56 58.06 38.11 50.44 3 0 20.24 -999 ? ZN ZN A3001 >ASP.A 165 57.89 42.29 46.05 58.46 41.42 44.19 58.17 41.85 45.12 2 0 24.89 -999 ? ZN ZN A3001 >GLU^A 166 56.89 45.79 49.13 55.89 47.66 49.06 56.39 46.73 49.09 2 0 26.27 -999 ? ZN ZN A3001 >THR^A 167 55.49 42.06 53.35 56.39 40.71 54.74 55.94 41.39 54.04 2 0 20.12 -999 ? ZN ZN A3001 >ILE^A 168 51.06 43.68 52.96 51.13 44.88 52.15 51.09 44.28 52.55 3 0 20.42 -999 ? ZN ZN A3001 >PHE^A 169 48.32 42.23 56.50 46.18 43.92 55.83 47.25 43.08 56.16 3 0 17.76 -999 ? ZN ZN A3001 >ILE^A 170 53.78 40.30 60.40 55.24 40.14 60.69 54.51 40.22 60.55 3 0 19.10 -999 ? ZN ZN A3001 >SER^A 171 50.10 37.76 61.85 48.40 36.93 60.24 49.25 37.35 61.05 2 0 13.16 -999 ? ZN ZN A3001 >TRP^A 172 51.33 38.07 68.76 48.15 36.76 70.65 49.74 37.42 69.70 3 0 19.36 -999 ? ZN ZN A3001 >PHE^A 173 48.42 32.68 64.44 47.65 32.89 61.79 48.03 32.78 63.11 3 0 11.34 -999 ? ZN ZN A3001 >GLU.A 174 45.26 32.55 71.69 43.20 32.14 71.93 44.23 32.35 71.81 2 0 17.34 -999 ? ZN ZN A3001 >GLY.A 175 49.16 29.84 70.19 49.48 30.48 70.00 49.32 30.16 70.10 1 0 16.23 -999 ? ZN ZN A3001 >GLY.A 176 52.61 31.34 69.84 52.30 31.39 69.17 52.46 31.37 69.51 1 0 17.98 -999 ? ZN ZN A3001 >GLU.A 177 53.06 29.03 65.71 51.61 28.30 67.12 52.33 28.67 66.41 2 0 14.54 -999 ? ZN ZN A3001 >VAL^A 178 53.77 34.29 63.63 55.59 35.26 64.29 54.68 34.78 63.96 3 0 16.92 -999 ? ZN ZN A3001 >PHE^A 179 51.95 32.84 58.27 51.99 31.43 55.95 51.97 32.13 57.11 3 0 11.15 -999 ? ZN ZN A3001 >ARG^A 180 57.80 36.67 56.04 59.18 34.31 54.71 58.49 35.49 55.37 2 0 18.42 -999 ? ZN ZN A3001 >SER^A 181 50.26 36.81 56.08 49.32 35.98 58.20 49.79 36.39 57.14 2 0 12.24 -999 ? ZN ZN A3001 >GLY^A 182 50.21 39.34 53.22 51.04 39.18 53.55 50.62 39.26 53.39 1 0 15.56 -999 ? ZN ZN A3001 >CYH^A 183 53.08 39.14 50.75 53.98 37.05 52.33 53.53 38.09 51.54 2 0 16.15 -999 ? ZN ZN A3001 >THR^A 184 53.44 40.64 47.26 53.35 42.81 47.50 53.39 41.73 47.38 2 0 21.58 -999 ? ZN ZN A3001 >PHE^A 185 55.42 37.03 45.71 55.30 35.77 48.17 55.36 36.40 46.94 3 0 18.58 -999 ? ZN ZN A3001 >THR^A 186 55.92 40.18 40.80 56.00 42.20 40.02 55.96 41.19 40.41 2 0 26.22 -999 ? ZN ZN A3001 >ARG^A 187 57.54 35.13 39.95 58.70 35.61 42.78 58.12 35.37 41.37 2 0 22.69 -999 ? ZN ZN A3001 >GLY.A 188 56.84 38.70 34.58 56.65 39.08 35.34 56.74 38.89 34.96 1 0 21.99 -999 ? ZN ZN D3008 >LYS.A 189 54.44 41.57 34.28 53.64 43.44 28.57 54.04 42.51 31.42 2 0 25.02 -999 ? ZN ZN D3008 >GLY^A 190 52.00 40.02 36.74 52.72 40.28 37.06 52.36 40.15 36.90 1 0 25.42 -999 ? ZN ZN A3001 >LYS^A 191 51.41 41.16 40.31 51.22 46.09 38.02 51.32 43.63 39.16 2 0 28.18 -999 ? ZN ZN A3001 >ILE^A 192 51.50 37.33 42.92 51.96 36.11 42.55 51.73 36.72 42.73 3 0 19.14 -999 ? ZN ZN A3001 >PHE^A 193 48.05 40.40 48.18 47.61 41.14 50.80 47.83 40.77 49.49 3 0 16.91 -999 ? ZN ZN A3001 >TYR^A 194 49.88 34.21 50.24 48.71 32.40 51.97 49.30 33.30 51.11 3 0 10.89 -999 ? ZN ZN A3001 >PHE^A 195 44.86 38.45 52.55 43.63 39.98 54.50 44.25 39.22 53.53 3 0 13.60 -999 ? ZN ZN A3001 >ARG.A 196 47.76 33.02 57.89 45.16 31.76 58.78 46.46 32.39 58.33 2 0 7.00 -999 ? ZN ZN A3001 >PRO.A 197 43.53 36.71 56.74 43.59 34.67 55.84 43.56 35.69 56.29 3 0 9.86 -999 ? ZN ZN A3001 >GLY.A 198 40.15 32.33 54.92 40.51 31.87 55.43 40.33 32.10 55.17 1 0 7.05 -999 ? ZN ZN A3001 >HIS.A 199 40.19 27.05 58.13 40.59 24.98 58.12 40.39 26.01 58.12 3 0 -3.40 -999 ? ZN ZN A3001s >GLU.A 200 36.84 24.81 55.36 38.91 24.38 55.33 37.87 24.59 55.34 2 0 4.24 -999 ? ZN ZN A3001 >THR.A 201 34.97 26.67 58.89 36.33 25.15 59.69 35.65 25.91 59.29 2 0 7.64 -999 ? ZN ZN A3001 >TYR.A 202 37.05 29.80 61.44 38.36 27.91 62.95 37.71 28.85 62.19 3 0 8.75 -999 ? ZN ZN A3001 >PRO~A 203 32.34 33.65 60.73 33.37 32.81 58.97 32.86 33.23 59.85 3 0 13.06 -999 ? ZN ZN A3001 >THR~A 204 36.38 35.12 57.63 38.48 34.49 57.83 37.43 34.80 57.73 2 0 9.88 -999 ? ZN ZN A3001 >TYR~A 205 36.42 34.89 52.63 38.96 33.86 52.11 37.69 34.37 52.37 3 0 10.51 -999 ? ZN ZN A3001 >HIS~A 206 30.39 36.34 55.99 29.30 34.99 54.82 29.85 35.66 55.40 3 0 16.28 -999 ? ZN ZN A3001 >HIS~A 207 36.57 40.69 59.51 37.37 42.15 60.80 36.97 41.42 60.16 3 0 17.19 -999 ? ZN ZN A3001 >PRO~A 208 33.58 44.54 58.32 34.50 43.22 56.74 34.04 43.88 57.53 3 0 20.12 -999 ? ZN ZN A3001 >ASP~A 209 39.15 44.40 57.97 38.87 46.18 59.13 39.01 45.29 58.55 2 0 20.96 -999 ? ZN ZN A3001 >VAL~A 210 39.17 41.11 55.00 39.30 39.05 55.64 39.24 40.08 55.32 3 0 14.66 -999 ? ZN ZN A3001 >LEU~A 211 35.42 42.00 52.09 34.08 40.41 52.01 34.75 41.20 52.05 3 0 17.73 -999 ? ZN ZN A3001 >LYS~A 212 38.34 45.43 51.89 39.54 50.58 50.75 38.94 48.01 51.32 2 0 25.43 -999 ? ZN ZN A3001 >VAL~A 213 41.89 44.11 51.65 43.37 43.40 53.08 42.63 43.75 52.36 3 0 18.20 -999 ? ZN ZN A3001 >ILE~A 214 39.89 40.65 48.94 39.52 39.24 48.86 39.71 39.95 48.90 3 0 15.97 -999 ? ZN ZN A3001 >ALA~A 215 39.23 44.63 46.93 38.04 45.40 47.35 38.63 45.02 47.14 2 0 21.80 -999 ? ZN ZN A3001 >ASN~A 216 42.87 47.29 48.77 41.71 48.60 49.96 42.29 47.94 49.37 2 0 23.49 -999 ? ZN ZN A3001 >ALA~A 217 44.56 44.07 46.23 44.67 42.74 47.01 44.61 43.41 46.62 2 0 19.10 -999 ? ZN ZN A3001 >VAL~A 218 42.41 43.49 43.10 40.48 42.51 42.63 41.44 43.00 42.86 3 0 21.49 -999 ? ZN ZN A3001 >ARG~A 219 41.70 50.84 43.23 39.91 49.92 45.60 40.80 50.38 44.41 2 0 26.27 -999 ? ZN ZN A3001 >TRP~A 220 49.63 47.42 44.40 50.60 43.65 44.22 50.11 45.54 44.31 3 0 23.89 -999 ? ZN ZN A3001 >ALA~A 221 47.11 43.83 40.95 46.74 42.46 41.48 46.92 43.14 41.21 2 0 22.24 -999 ? ZN ZN A3001 >ALA~A 222 45.30 44.97 37.84 44.17 45.89 37.77 44.74 45.43 37.80 2 0 26.95 -999 ? ZN ZN A3001 >PRO.A 223 46.05 43.57 33.79 47.05 44.91 35.25 46.55 44.24 34.52 3 0 28.33 -999 ? ZN ZN A3001 >VAL.A 224 48.33 48.38 33.04 48.50 49.80 34.74 48.42 49.09 33.89 3 0 31.07 -999 ? ZN ZN B3002 >ASN.A 225 52.37 47.37 30.59 53.28 49.21 30.03 52.82 48.29 30.31 2 0 27.85 -999 ? ZN ZN B3002 >ARG.A 226 47.38 41.27 30.15 45.53 38.87 30.39 46.45 40.07 30.27 2 0 28.64 -999 ? ZN ZN A3001 >GLY.A 227 50.50 41.36 26.81 51.10 41.51 27.37 50.80 41.44 27.09 1 0 26.75 -999 ? ZN ZN D3008 >GLU.A 228 54.00 37.86 23.75 53.56 36.91 21.92 53.78 37.38 22.83 2 0 22.58 -999 ? ZN ZN D3008 >ILE.A 229 57.89 40.69 27.25 58.41 42.01 27.70 58.15 41.35 27.48 3 0 19.97 -999 ? ZN ZN D3008 >VAL.A 230 59.71 40.64 23.11 59.94 41.75 21.28 59.83 41.19 22.20 3 0 18.53 -999 ? ZN ZN D3008 >PHE.A 231 61.39 37.11 25.85 60.17 37.63 28.29 60.78 37.37 27.07 3 0 15.79 -999 ? ZN ZN D3008 >GLY^A 232 64.89 36.25 21.42 65.10 36.97 21.69 65.00 36.61 21.55 1 0 12.01 -999 ? ZN ZN D3008 >ASN^A 233 67.78 36.32 17.69 69.70 36.66 16.83 68.74 36.49 17.26 2 0 11.27 -999 ? ZN ZN D3008 >VAL.A 234 67.77 41.00 18.32 67.13 41.61 20.29 67.45 41.30 19.31 3 0 13.94 -999 ? ZN ZN D3008 >LYS.A 235 69.74 43.32 16.12 67.52 45.81 11.23 68.63 44.57 13.68 2 0 21.49 -999 ? ZN ZN D3008 >PRO.A 236 73.61 45.22 16.02 71.78 45.31 17.31 72.69 45.27 16.66 3 0 16.54 -999 ? ZN ZN D3008 >LEU.A 237 70.29 49.85 19.64 68.23 49.40 20.09 69.26 49.63 19.86 3 0 20.01 -999 ? ZN ZN D3008 >GLU.A 238 74.39 51.48 20.53 73.82 53.45 20.09 74.11 52.46 20.31 2 0 21.43 -999 ? ZN ZN B3002 >PRO.A 239 77.35 51.92 15.19 76.99 50.00 16.21 77.17 50.96 15.70 3 0 21.92 -999 ? ZN ZN D3008 >ILE.A 240 78.92 45.33 17.03 78.42 44.33 17.78 78.67 44.83 17.41 3 0 15.98 -999 ? ZN ZN D3008 >LYS.A 241 83.27 46.82 15.87 87.35 45.58 15.90 85.31 46.20 15.88 2 0 20.92 -999 ? ZN ZN D3008 >ALA.A 242 84.31 43.72 13.93 84.06 43.49 12.43 84.19 43.61 13.18 2 0 19.70 -999 ? ZN ZN D3008 >THR.B 3 39.54 64.42 43.08 40.11 65.54 44.85 39.82 64.98 43.97 2 0 34.33 -999 ? ZN ZN B3002 >PRO.B 4 41.72 67.46 40.81 42.11 65.35 41.54 41.92 66.40 41.18 3 0 31.77 -999 ? ZN ZN B3002 >ILE.B 5 47.07 63.38 42.35 47.73 62.16 42.37 47.40 62.77 42.36 3 0 27.03 -999 ? ZN ZN B3002 >ARG^B 6 45.31 68.84 46.73 45.12 67.84 49.57 45.22 68.34 48.15 2 0 31.17 -999 ? ZN ZN B3002 >VAL^B 7 51.39 67.96 43.02 52.18 67.33 41.07 51.79 67.65 42.04 3 0 22.27 -999 ? ZN ZN B3002 >VAL^B 8 54.01 70.63 43.79 53.96 71.96 45.46 53.99 71.29 44.62 3 0 21.37 -999 ? ZN ZN B3002 >VAL^B 9 56.94 70.83 41.40 56.84 70.37 39.29 56.89 70.60 40.35 3 0 17.17 -999 ? ZN ZN B3002 >TRP^B 10 60.58 73.70 46.31 64.49 73.57 45.82 62.54 73.64 46.07 3 0 15.79 -999 ? ZN ZN B3002 >ASN^B 11 62.44 73.96 39.96 63.99 74.30 38.55 63.21 74.13 39.26 2 0 11.69 -999 ? ZN ZN B3002 >GLU.B 12 68.64 75.47 42.66 70.28 74.13 42.35 69.46 74.80 42.50 2 0 9.48 -999 ? ZN ZN B3002 >PHE.B 13 63.49 79.29 38.71 62.37 80.93 36.79 62.93 80.11 37.75 3 0 16.31 -999 ? ZN ZN B3002 >ARG~B 14 69.81 80.51 42.26 70.54 80.48 45.27 70.17 80.50 43.77 2 0 16.01 -999 ? ZN ZN B3002 >HIS~B 15 71.47 75.68 36.32 73.08 74.57 37.08 72.27 75.13 36.70 3 0 7.62 -999 ? ZN ZN B3002 >GLU~B 16 65.93 77.10 34.07 65.81 76.19 35.97 65.87 76.64 35.02 2 0 11.39 -999 ? ZN ZN B3002 >LYS~B 17 67.79 82.74 35.35 65.14 82.05 41.01 66.47 82.40 38.18 2 0 17.28 -999 ? ZN ZN B3002 >LYS~B 18 71.48 83.20 34.60 74.22 81.43 38.86 72.85 82.32 36.73 2 0 14.13 -999 ? ZN ZN B3002 >ASP~B 19 72.95 79.10 32.48 73.78 78.88 34.46 73.37 78.99 33.47 2 0 11.43 -999 ? ZN ZN B3002 >GLU~B 20 72.70 82.15 26.04 74.03 83.26 24.79 73.37 82.71 25.42 2 0 19.38 -999 ? ZN ZN B3002 >GLN~B 21 73.10 76.07 25.86 73.67 74.11 26.48 73.39 75.09 26.17 2 0 11.69 -999 ? ZN ZN B3002 >VAL~B 22 69.64 76.82 29.77 70.00 76.01 31.74 69.82 76.42 30.75 3 0 10.92 -999 ? ZN ZN B3002 >ARG~B 23 66.83 83.71 30.13 69.63 84.74 29.14 68.23 84.22 29.64 2 0 18.89 -999 ? ZN ZN B3002 >ALA~B 24 67.04 79.11 25.84 68.25 78.94 24.90 67.65 79.03 25.37 2 0 16.77 -999 ? ZN ZN B3002 >ILE~B 25 66.52 74.46 27.05 67.29 73.36 26.87 66.90 73.91 26.96 3 0 12.86 -999 ? ZN ZN B3002 >TYR~B 26 64.31 74.19 30.59 64.49 71.42 30.10 64.40 72.80 30.35 3 0 11.82 -999 ? ZN ZN B3002 >PRO.B 27 61.65 79.79 27.62 62.91 79.52 29.46 62.28 79.66 28.54 3 0 18.02 -999 ? ZN ZN B3002 >GLU.B 28 58.26 80.75 30.83 56.86 79.71 29.58 57.56 80.23 30.21 2 0 21.44 -999 ? ZN ZN B3002 >GLY~B 29 62.08 77.25 34.33 61.63 77.03 33.69 61.85 77.14 34.01 1 0 14.90 -999 ? ZN ZN B3002 >MET~B 30 61.98 73.43 34.27 65.68 71.53 34.33 63.83 72.48 34.30 2 0 8.74 -999 ? ZN ZN B3002 >HIS~B 31 59.50 75.76 38.15 60.05 77.79 37.98 59.77 76.78 38.07 3 0 16.43 -999 ? ZN ZN B3002 >THR~B 32 56.90 75.40 34.58 56.75 77.48 34.07 56.83 76.44 34.33 2 0 19.36 -999 ? ZN ZN B3002 >VAL~B 33 57.35 72.79 31.86 58.88 72.49 30.31 58.12 72.64 31.08 3 0 16.76 -999 ? ZN ZN B3002 >ILE~B 34 57.79 69.37 35.29 58.72 68.51 35.91 58.26 68.94 35.60 3 0 15.08 -999 ? ZN ZN B3002 >ALA~B 35 53.87 71.51 35.94 53.92 72.66 36.87 53.89 72.08 36.41 2 0 20.02 -999 ? ZN ZN B3002 >SER~B 36 52.22 72.47 32.68 53.10 74.61 32.03 52.66 73.54 32.35 2 0 21.75 -999 ? ZN ZN B3002 >TYR~B 37 53.32 66.63 30.75 52.77 64.06 29.78 53.04 65.34 30.27 3 0 21.19 -999 ? ZN ZN B3002 >LEU~B 38 51.71 67.63 36.04 53.21 66.19 36.73 52.46 66.91 36.38 3 0 20.82 -999 ? ZN ZN B3002 >ALA~B 39 48.11 70.08 34.71 48.26 71.59 34.68 48.18 70.84 34.69 2 0 25.37 -999 ? ZN ZN B3002 >GLU~B 40 47.98 71.08 29.51 47.77 72.50 31.13 47.87 71.79 30.32 2 0 26.45 -999 ? ZN ZN B3002 >ALA~B 41 47.23 65.50 32.32 48.49 64.75 32.63 47.86 65.13 32.48 2 0 25.18 -999 ? ZN ZN B3002 >GLY.B 42 44.58 66.24 35.02 45.31 66.38 35.23 44.95 66.31 35.12 1 0 28.74 -999 ? ZN ZN B3002 >PHE.B 43 48.60 65.13 37.93 49.20 62.47 37.39 48.90 63.80 37.66 3 0 24.70 -999 ? ZN ZN B3002 >ASP^B 44 45.39 69.78 41.58 45.17 71.68 42.47 45.28 70.73 42.02 2 0 29.08 -999 ? ZN ZN B3002 >ALA^B 45 49.77 71.14 39.73 50.39 70.79 38.40 50.08 70.97 39.07 2 0 23.20 -999 ? ZN ZN B3002 >ALA^B 46 51.63 74.06 41.32 51.18 74.36 42.70 51.40 74.21 42.01 2 0 24.01 -999 ? ZN ZN B3002 >THR^B 47 55.25 75.10 41.56 55.46 76.09 39.63 55.36 75.60 40.59 2 0 20.03 -999 ? ZN ZN B3002 >ALA^B 48 57.69 76.20 44.28 57.53 75.39 45.58 57.61 75.79 44.93 2 0 19.92 -999 ? ZN ZN B3002 >VAL^B 49 61.23 77.56 43.95 60.87 79.02 42.37 61.05 78.29 43.16 3 0 17.68 -999 ? ZN ZN B3002 >LEU.B 50 65.67 77.81 45.81 67.43 77.44 46.98 66.55 77.63 46.40 3 0 15.82 -999 ? ZN ZN B3002 >ASP.B 51 64.78 82.67 45.28 66.88 82.04 45.10 65.83 82.35 45.19 2 0 18.14 -999 ? ZN ZN B3002 >GLU~B 52 58.68 81.35 45.63 57.52 79.84 44.69 58.10 80.59 45.16 2 0 21.69 -999 ? ZN ZN B3002 >PRO~B 53 58.44 84.40 50.73 59.70 82.54 50.54 59.07 83.47 50.64 3 0 25.75 -999 ? ZN ZN B3002 >GLU~B 54 59.04 79.58 55.00 57.36 79.23 56.24 58.20 79.41 55.62 2 0 28.12 -999 ? ZN ZN B3002 >HIS~B 55 63.57 77.00 50.52 65.25 77.64 51.61 64.41 77.32 51.06 3 0 19.87 -999 ? ZN ZN B3002 >GLY~B 56 57.69 77.86 48.67 58.01 77.42 49.27 57.85 77.64 48.97 1 0 22.46 -999 ? ZN ZN B3002 >LEU~B 57 58.33 73.95 51.06 58.65 72.71 49.27 58.49 73.33 50.16 3 0 21.14 -999 ? ZN ZN B3002 >THR~B 58 55.24 76.51 53.90 54.10 78.07 53.02 54.67 77.29 53.46 2 0 27.59 -999 ? ZN ZN B3002 >ASP~B 59 52.84 74.50 57.57 54.35 73.92 58.96 53.59 74.21 58.26 2 0 30.28 -999 ? ZN ZN B3002 >GLU~B 60 49.24 77.49 55.44 50.81 77.77 56.88 50.02 77.63 56.16 2 0 32.20 -999 ? ZN ZN B3002 >VAL~B 61 51.54 74.41 50.90 52.84 75.29 49.45 52.19 74.85 50.18 3 0 26.32 -999 ? ZN ZN B3002 >LEU~B 62 54.05 70.81 53.03 56.12 70.72 52.34 55.08 70.77 52.69 3 0 24.76 -999 ? ZN ZN B3002 >ASP~B 63 49.06 70.93 55.13 50.39 70.91 56.88 49.72 70.92 56.00 2 0 31.03 -999 ? ZN ZN B3002 >ARG~B 64 46.83 73.73 48.95 48.32 76.41 49.42 47.57 75.07 49.19 2 0 29.59 -999 ? ZN ZN B3002 >CYH.B 65 50.57 68.58 48.65 53.15 68.43 47.58 51.86 68.51 48.11 2 0 23.13 -999 ? ZN ZN B3002 >ASP.B 66 48.96 64.46 46.91 47.03 65.00 47.65 48.00 64.73 47.28 2 0 28.75 -999 ? ZN ZN B3002 >VAL^B 67 53.26 64.51 45.87 53.35 62.91 44.43 53.30 63.71 45.15 3 0 22.23 -999 ? ZN ZN B3002 >LEU^B 68 57.12 67.03 47.03 58.11 68.87 47.50 57.62 67.95 47.26 3 0 19.18 -999 ? ZN ZN B3002 >VAL^B 69 58.69 66.64 42.72 58.03 66.30 40.68 58.36 66.47 41.70 3 0 15.94 -999 ? ZN ZN B3002 >TRP^B 70 65.01 68.57 45.11 63.39 70.36 48.24 64.20 69.46 46.67 3 0 14.00 -999 ? ZN ZN B3002 >TRP^B 71 65.77 68.44 37.68 68.73 71.02 37.69 67.25 69.73 37.69 3 0 6.56 -999 ? ZN ZN B3002 >GLY.B 72 68.19 70.85 42.40 68.35 70.21 41.89 68.27 70.53 42.15 1 0 8.67 -999 ? ZN ZN B3002 >HIS.B 73 73.18 70.94 39.33 74.94 70.54 38.27 74.06 70.74 38.80 3 0 4.18 -999 ? ZN ZN B3002 >ILE.B 74 74.52 75.06 41.29 74.41 75.73 40.06 74.46 75.40 40.67 3 0 9.09 -999 ? ZN ZN B3002 >ALA~B 75 72.33 75.24 45.59 71.43 76.44 45.28 71.88 75.84 45.44 2 0 12.83 -999 ? ZN ZN B3002 >HIS~B 76 71.88 70.09 46.10 71.39 69.05 44.34 71.64 69.57 45.22 3 0 9.40 -999 ? ZN ZN B3002 >ASP~B 77 74.57 74.04 50.65 74.98 75.56 49.18 74.78 74.80 49.91 2 0 15.34 -999 ? ZN ZN B3002 >GLU~B 78 72.12 78.12 49.02 72.17 79.71 47.65 72.14 78.91 48.33 2 0 16.72 -999 ? ZN ZN B3002 >VAL~B 79 67.66 74.74 51.35 66.52 73.33 50.19 67.09 74.03 50.77 3 0 17.10 -999 ? ZN ZN B3002 >LYS~B 80 67.19 75.43 55.04 67.71 80.25 54.21 67.45 77.84 54.63 2 0 22.72 -999 ? ZN ZN B3002 >ASP~B 81 68.27 72.39 58.61 70.29 71.86 57.93 69.28 72.12 58.27 2 0 22.37 -999 ? ZN ZN B3002 >GLU~B 82 62.02 75.22 59.58 61.63 77.00 60.64 61.82 76.11 60.11 2 0 28.68 -999 ? ZN ZN B3002 >VAL~B 83 62.23 73.06 55.55 61.82 74.47 53.90 62.02 73.77 54.72 3 0 22.55 -999 ? ZN ZN B3002 >VAL~B 84 64.14 69.77 54.88 66.16 69.19 54.29 65.15 69.48 54.59 3 0 20.21 -999 ? ZN ZN B3002 >GLU~B 85 64.55 68.88 59.94 64.95 66.82 60.38 64.75 67.85 60.16 2 0 23.85 -999 ? ZN ZN C3003 >ARG~B 86 57.34 72.94 56.52 58.59 75.64 57.16 57.97 74.29 56.84 2 0 26.84 -999 ? ZN ZN B3002 >VAL~B 87 59.38 67.82 54.04 60.07 68.32 52.05 59.72 68.07 53.05 3 0 21.64 -999 ? ZN ZN B3002 >HIS~B 88 62.73 63.40 56.96 63.22 61.56 57.82 62.97 62.48 57.39 3 0 23.24 -999 ? ZN ZN C3003 >ARG~B 89 58.30 66.85 61.46 57.64 69.87 60.71 57.97 68.36 61.08 2 0 26.93 -999 ? ZN ZN C3003 >ARG~B 90 53.33 67.26 55.43 51.47 65.45 53.71 52.40 66.35 54.57 2 0 28.05 -999 ? ZN ZN B3002 >VAL~B 91 57.08 62.04 53.39 58.71 61.78 52.00 57.90 61.91 52.69 3 0 23.27 -999 ? ZN ZN B3002 >LEU~B 92 57.96 59.88 57.69 60.06 59.28 57.79 59.01 59.58 57.74 3 0 22.05 -999 ? ZN ZN C3003 >GLU~B 93 53.06 62.61 58.65 52.57 64.72 58.82 52.82 63.67 58.74 2 0 26.38 -999 ? ZN ZN C3003 >GLY.B 94 52.60 59.60 53.45 52.99 60.30 53.41 52.79 59.95 53.43 1 0 27.89 -999 ? ZN ZN C3003 >MET.B 95 53.48 62.44 51.03 54.53 66.43 50.59 54.00 64.43 50.81 2 0 23.67 -999 ? ZN ZN B3002 >GLY^B 96 55.00 61.12 47.85 55.12 61.89 48.14 55.06 61.50 47.99 1 0 22.62 -999 ? ZN ZN B3002 >LEU^B 97 59.44 62.33 47.65 61.02 63.82 47.96 60.23 63.07 47.80 3 0 18.04 -999 ? ZN ZN B3002 >ILE^B 98 58.85 62.55 41.83 58.51 61.39 41.44 58.68 61.97 41.64 3 0 16.56 -999 ? ZN ZN B3002 >VAL^B 99 63.43 63.16 42.96 64.77 63.17 44.72 64.10 63.17 43.84 3 0 12.74 -999 ? ZN ZN B3002 >LEU^B 100 64.11 65.15 38.82 62.07 64.93 38.06 63.09 65.04 38.44 3 0 10.73 -999 ? ZN ZN B3002 >HIS.B 101 69.65 65.30 36.31 71.45 65.51 35.26 70.55 65.41 35.78 3 0 -3.51 -999 ? ZN ZN B3002s >SER~B 102 70.82 66.21 40.26 70.48 68.32 39.04 70.65 67.26 39.65 2 0 4.07 -999 ? ZN ZN B3002 >GLY~B 103 68.21 65.98 43.10 68.81 65.48 42.84 68.51 65.73 42.97 1 0 8.73 -999 ? ZN ZN B3002 >HIS~B 104 72.29 62.45 42.66 74.13 63.28 42.14 73.21 62.86 42.40 3 0 7.82 -999 ? ZN ZN B3002 >PHE~B 105 74.87 65.22 45.38 77.25 63.78 45.13 76.06 64.50 45.25 3 0 9.99 -999 ? ZN ZN B3002 >SER~B 106 69.50 67.17 47.63 67.39 65.94 47.25 68.45 66.55 47.44 2 0 12.65 -999 ? ZN ZN B3002 >LYS~B 107 69.47 67.36 51.36 70.75 72.54 54.53 70.11 69.95 52.94 2 0 19.17 -999 ? ZN ZN B3002 >ILE~B 108 64.73 66.27 50.85 64.02 65.77 51.02 64.37 66.02 50.93 3 0 17.30 -999 ? ZN ZN B3002 >PHE~B 109 67.40 61.29 47.19 67.43 58.78 46.00 67.42 60.04 46.59 3 0 14.14 -999 ? ZN ZN B3002 >LYS~B 110 70.38 62.19 51.14 74.83 66.01 50.63 72.61 64.10 50.89 2 0 14.63 -999 ? ZN ZN B3002 >LYS~B 111 68.47 62.37 54.46 66.90 64.15 59.23 67.69 63.26 56.84 2 0 22.89 -999 ? ZN ZN C3003 >LEU~B 112 64.82 59.94 52.31 62.84 60.87 52.54 63.83 60.40 52.43 3 0 20.12 -999 ? ZN ZN B3002 >MET~B 113 68.58 57.45 51.81 67.39 56.50 49.00 67.98 56.98 50.40 2 0 17.94 -999 ? ZN ZN B3002 >GLY~B 114 71.09 57.61 54.72 71.27 57.60 53.96 71.18 57.61 54.34 1 0 21.17 -999 ? ZN ZN B3002 >THR.B 115 74.02 57.31 52.26 73.08 55.86 51.05 73.55 56.59 51.66 2 0 18.94 -999 ? ZN ZN B3002 >THR.B 116 76.11 59.93 50.34 78.15 59.17 50.06 77.13 59.55 50.20 2 0 16.96 -999 ? ZN ZN B3002 >CYH.B 117 74.14 59.45 47.12 71.64 59.55 48.31 72.89 59.50 47.72 2 0 14.65 -999 ? ZN ZN B3002 >ASN.B 118 78.83 60.09 45.83 80.11 61.60 45.00 79.47 60.84 45.41 2 0 12.67 -999 ? ZN ZN B3002 >LEU.B 119 76.74 58.74 41.15 75.72 60.62 40.39 76.23 59.68 40.77 3 0 9.62 -999 ? ZN ZN B3002 >LYS^B 120 80.36 58.82 38.81 84.34 53.69 38.53 82.35 56.26 38.67 2 0 17.92 -999 ? ZN ZN B3002 >TRP^B 121 80.06 63.37 38.90 81.12 66.59 36.88 80.59 64.98 37.89 3 0 7.96 -999 ? ZN ZN B3002 >ARG^B 122 82.39 61.52 29.98 81.62 58.60 30.53 82.01 60.06 30.25 2 0 13.51 -999 ? ZN ZN B3002 >GLU^B 123 77.69 68.26 30.81 77.59 70.37 31.35 77.64 69.31 31.08 2 0 7.05 -999 ? ZN ZN B3002 >ALA^B 124 79.78 64.92 27.33 80.73 63.76 27.35 80.25 64.34 27.34 2 0 12.18 -999 ? ZN ZN B3002 >ASP^B 125 76.89 66.19 24.19 77.29 68.15 24.76 77.09 67.17 24.48 2 0 12.12 -999 ? ZN ZN B3002 >GLU^B 126 76.98 60.08 27.12 78.65 59.53 28.27 77.82 59.81 27.69 2 0 12.51 -999 ? ZN ZN B3002 >LYS^B 127 73.53 59.06 24.39 72.52 55.89 19.38 73.02 57.48 21.89 2 0 20.48 -999 ? ZN ZN B3002 >GLU^B 128 70.46 57.49 29.48 69.82 58.69 31.13 70.14 58.09 30.31 2 0 10.80 -999 ? ZN ZN B3002 >ARG^B 129 68.56 51.69 24.15 70.79 52.62 22.23 69.68 52.15 23.19 2 0 20.61 -999 ? ZN ZN B3002 >LEU^B 130 65.99 54.97 30.42 66.46 57.01 30.95 66.23 55.99 30.69 3 0 14.64 -999 ? ZN ZN B3002 >TRP^B 131 68.88 49.68 28.07 67.20 47.74 25.08 68.04 48.71 26.57 3 0 18.95 -999 ? ZN ZN D3008 >VAL^B 132 62.70 49.07 31.45 60.54 49.47 31.12 61.62 49.27 31.28 3 0 22.25 -999 ? ZN ZN B3002 >VAL.B 133 63.43 46.25 33.88 65.43 46.86 34.54 64.43 46.56 34.21 3 0 20.85 -999 ? ZN ZN D3008 >ALA.B 134 59.99 46.29 35.72 59.93 47.10 37.03 59.96 46.69 36.38 2 0 24.46 -999 ? ZN ZN B3002 >PRO.B 135 58.58 43.78 32.48 58.16 45.80 33.29 58.37 44.79 32.89 3 0 22.98 -999 ? ZN ZN D3008 >GLY.B 136 54.45 45.65 34.64 55.03 46.10 34.96 54.74 45.88 34.80 1 0 27.02 -999 ? ZN ZN D3008 >HIS~B 137 56.51 49.65 38.81 56.35 50.74 40.60 56.43 50.20 39.71 3 0 24.47 -999 ? ZN ZN B3002 >PRO~B 138 51.91 50.76 38.97 53.00 50.83 37.07 52.45 50.79 38.02 3 0 26.81 -999 ? ZN ZN B3002 >ILE~B 139 56.79 53.93 37.29 57.67 54.65 38.22 57.23 54.29 37.76 3 0 20.90 -999 ? ZN ZN B3002 >VAL~B 140 56.25 52.43 32.95 57.60 50.81 33.33 56.92 51.62 33.14 3 0 23.05 -999 ? ZN ZN B3002 >GLU~B 141 50.17 52.65 31.53 48.39 53.43 32.37 49.28 53.04 31.95 2 0 28.88 -999 ? ZN ZN B3002 >GLY.B 142 52.81 53.64 28.00 53.45 53.37 28.30 53.13 53.51 28.15 1 0 26.07 -999 ? ZN ZN B3002 >ILE.B 143 57.37 53.76 29.12 57.80 54.94 28.99 57.58 54.35 29.05 3 0 21.73 -999 ? ZN ZN B3002 >GLY.B 144 57.91 50.97 25.40 58.05 51.04 26.27 57.98 51.00 25.84 1 0 25.07 -999 ? ZN ZN B3002 >PRO.B 145 61.10 48.54 23.80 60.41 49.19 25.84 60.75 48.86 24.82 3 0 22.79 -999 ? ZN ZN D3008 >TYR^B 146 64.70 51.51 24.59 64.92 51.47 21.81 64.81 51.49 23.20 3 0 22.34 -999 ? ZN ZN B3002 >ILE^B 147 63.10 56.52 27.74 62.24 57.41 28.47 62.67 56.97 28.10 3 0 17.04 -999 ? ZN ZN B3002 >GLU^B 148 67.85 56.53 22.44 67.94 55.60 20.56 67.90 56.07 21.50 2 0 20.40 -999 ? ZN ZN B3002 >LEU^B 149 67.96 60.88 26.49 66.25 61.37 27.72 67.10 61.12 27.10 3 0 12.73 -999 ? ZN ZN B3002 >GLU^B 150 68.76 61.65 20.25 69.54 59.85 19.44 69.15 60.75 19.84 2 0 18.82 -999 ? ZN ZN B3002 >GLN^B 151 72.92 65.15 22.73 73.57 67.00 22.02 73.24 66.08 22.38 2 0 14.17 -999 ? ZN ZN B3002 >GLU^B 152 70.10 63.07 29.43 70.05 64.41 31.10 70.08 63.74 30.26 2 0 6.80 -999 ? ZN ZN B3002 >GLU^B 153 75.89 64.68 33.47 76.01 66.28 34.78 75.95 65.48 34.13 2 0 -3.35 -999 ? ZN ZN B3002s >MET^B 154 76.15 60.42 32.29 78.37 58.14 33.79 77.26 59.28 33.04 2 0 11.00 -999 ? ZN ZN B3002 >TYR^B 155 74.04 60.73 37.05 73.04 63.26 37.75 73.54 61.99 37.40 3 0 5.74 -999 ? ZN ZN B3002 >GLY^B 156 77.40 55.85 36.55 77.19 56.22 37.27 77.29 56.03 36.91 1 0 12.46 -999 ? ZN ZN B3002 >GLU.B 157 75.58 51.67 38.56 74.38 51.90 40.26 74.98 51.79 39.41 2 0 16.25 -999 ? ZN ZN B3002 >PHE.B 158 78.36 51.82 44.23 76.74 51.39 46.51 77.55 51.61 45.37 3 0 18.93 -999 ? ZN ZN B3002 >PHE.B 159 73.17 55.97 42.51 71.20 57.92 42.94 72.18 56.95 42.72 3 0 12.54 -999 ? ZN ZN B3002 >ASP.B 160 76.82 55.90 47.42 76.91 55.43 49.56 76.87 55.67 48.49 2 0 18.45 -999 ? ZN ZN B3002 >ILE.B 161 71.02 54.71 46.43 70.53 54.83 45.18 70.78 54.77 45.80 3 0 16.22 -999 ? ZN ZN B3002 >PRO.B 162 69.16 53.52 50.59 70.65 52.47 49.38 69.90 52.99 49.98 3 0 20.37 -999 ? ZN ZN B3002 >GLU.B 163 68.78 46.59 46.71 68.68 44.60 47.40 68.73 45.59 47.05 2 0 26.00 -999 ? ZN ZN B3002 >PRO.B 164 67.24 50.76 44.00 66.60 49.92 45.94 66.92 50.34 44.97 3 0 20.38 -999 ? ZN ZN B3002 >ASP.B 165 61.27 49.29 47.12 61.29 49.98 49.16 61.28 49.63 48.14 2 0 24.94 -999 ? ZN ZN B3002 >GLU^B 166 60.05 47.03 42.80 58.22 46.95 41.72 59.13 46.99 42.26 2 0 26.14 -999 ? ZN ZN B3002 >THR^B 167 64.53 49.03 40.06 66.68 48.80 39.89 65.60 48.92 39.98 2 0 20.26 -999 ? ZN ZN B3002 >ILE^B 168 61.46 51.44 37.47 60.21 50.87 37.79 60.84 51.15 37.63 3 0 20.66 -999 ? ZN ZN B3002 >PHE^B 169 63.54 53.42 33.73 61.14 54.18 32.63 62.34 53.80 33.18 3 0 17.85 -999 ? ZN ZN B3002 >ILE^B 170 69.17 49.34 34.14 69.92 48.24 34.72 69.55 48.79 34.43 3 0 19.25 -999 ? ZN ZN B3002 >SER^B 171 70.49 53.17 31.77 69.60 55.38 32.47 70.04 54.28 32.12 2 0 13.28 -999 ? ZN ZN B3002 >TRP^B 172 74.52 50.06 26.95 75.26 52.70 24.17 74.89 51.38 25.56 3 0 19.45 -999 ? ZN ZN B3002 >PHE^B 173 75.08 56.64 30.38 73.22 57.82 32.06 74.15 57.23 31.22 3 0 11.52 -999 ? ZN ZN B3002 >GLU.B 174 78.03 56.83 22.96 77.76 58.60 21.83 77.89 57.71 22.39 2 0 17.52 -999 ? ZN ZN B3002 >GLY.B 175 80.70 55.99 27.11 80.23 55.46 27.27 80.46 55.72 27.19 1 0 16.49 -999 ? ZN ZN B3002 >GLY.B 176 80.55 52.61 28.76 80.08 53.09 29.15 80.32 52.85 28.96 1 0 18.24 -999 ? ZN ZN B3002 >GLU.B 177 80.22 54.91 33.10 81.11 56.01 31.48 80.67 55.46 32.29 2 0 14.75 -999 ? ZN ZN B3002 >VAL^B 178 75.36 51.93 33.42 75.63 49.78 33.61 75.50 50.86 33.51 3 0 17.09 -999 ? ZN ZN B3002 >PHE^B 179 72.97 55.69 37.10 72.75 57.19 39.39 72.86 56.44 38.25 3 0 11.35 -999 ? ZN ZN B3002 >ARG^B 180 70.92 49.67 40.86 72.48 50.39 43.39 71.70 50.03 42.13 2 0 18.67 -999 ? ZN ZN B3002 >SER^B 181 68.06 55.31 36.72 69.55 55.44 34.90 68.80 55.37 35.81 2 0 12.77 -999 ? ZN ZN B3002 >GLY^B 182 64.57 54.62 38.07 65.18 54.08 38.38 64.88 54.35 38.23 1 0 15.73 -999 ? ZN ZN B3002 >CYH^B 183 64.36 53.38 41.64 67.25 53.40 41.56 65.81 53.39 41.60 2 0 16.32 -999 ? ZN ZN B3002 >THR^B 184 61.49 53.24 44.10 60.03 51.96 43.17 60.76 52.60 43.64 2 0 21.64 -999 ? ZN ZN B3002 >PHE^B 185 64.13 54.33 47.56 66.42 54.42 46.03 65.27 54.38 46.80 3 0 18.74 -999 ? ZN ZN B3002 >THR^B 186 59.30 53.56 50.74 57.42 52.39 50.74 58.36 52.97 50.74 2 0 26.35 -999 ? ZN ZN B3002 >ARG^B 187 63.20 55.58 53.72 64.75 53.51 51.96 63.97 54.54 52.84 2 0 22.80 -999 ? ZN ZN B3002 >GLY.B 188 57.30 55.63 56.51 57.35 55.28 55.70 57.32 55.45 56.10 1 0 22.09 -999 ? ZN ZN C3003 >LYS.B 189 54.09 55.82 54.62 49.14 56.90 58.25 51.62 56.36 56.44 2 0 25.04 -999 ? ZN ZN C3003 >GLY^B 190 55.70 57.81 51.77 55.91 57.01 51.92 55.80 57.41 51.85 1 0 25.45 -999 ? ZN ZN B3002 >LYS^B 191 56.59 56.47 48.40 51.35 54.66 48.42 53.97 55.57 48.41 2 0 28.24 -999 ? ZN ZN B3002 >ILE^B 192 60.92 57.94 47.53 61.81 58.39 48.43 61.37 58.17 47.98 3 0 19.23 -999 ? ZN ZN B3002 >PHE^B 193 60.19 57.14 40.55 61.05 56.30 38.01 60.62 56.72 39.28 3 0 16.97 -999 ? ZN ZN B3002 >TYR^B 194 66.71 58.86 41.89 68.56 60.30 40.41 67.63 59.58 41.15 3 0 10.98 -999 ? ZN ZN B3002 >PHE^B 195 62.84 59.45 36.08 62.37 58.88 33.42 62.60 59.16 34.75 3 0 13.67 -999 ? ZN ZN B3002 >ARG.B 196 70.99 58.92 35.13 71.45 61.30 33.35 71.22 60.11 34.24 2 0 7.13 -999 ? ZN ZN B3002 >PRO.B 197 66.07 60.28 32.56 67.07 61.64 34.00 66.57 60.96 33.28 3 0 9.86 -999 ? ZN ZN B3002 >GLY.B 198 67.04 65.92 33.34 67.79 65.75 33.38 67.42 65.83 33.36 1 0 7.04 -999 ? ZN ZN B3002 >HIS.B 199 72.79 68.06 32.72 74.42 69.11 33.52 73.60 68.58 33.12 3 0 -3.23 -999 ? ZN ZN B3002s >GLU.B 200 71.66 72.71 33.72 72.68 71.42 34.99 72.17 72.07 34.35 2 0 -4.05 -999 ? ZN ZN B3002s >THR.B 201 71.45 72.02 29.30 73.55 71.69 29.86 72.50 71.86 29.58 2 0 7.54 -999 ? ZN ZN B3002 >TYR.B 202 71.30 67.81 27.49 74.04 67.51 27.64 72.67 67.66 27.56 3 0 8.64 -999 ? ZN ZN B3002 >PRO~B 203 66.23 69.16 24.37 66.32 69.47 26.54 66.28 69.32 25.46 3 0 12.91 -999 ? ZN ZN B3002 >THR~B 204 65.03 66.32 28.49 66.34 65.01 29.56 65.69 65.66 29.03 2 0 9.92 -999 ? ZN ZN B3002 >TYR~B 205 62.55 67.82 32.53 63.96 66.67 34.61 63.25 67.24 33.57 3 0 10.35 -999 ? ZN ZN B3002 >HIS~B 206 60.99 70.68 26.19 61.07 72.68 26.84 61.03 71.68 26.52 3 0 16.12 -999 ? ZN ZN B3002 >HIS~B 207 61.86 62.39 25.36 61.76 60.54 24.36 61.81 61.46 24.86 3 0 17.23 -999 ? ZN ZN B3002 >PRO~B 208 57.04 63.49 23.70 57.68 63.36 25.83 57.36 63.42 24.76 3 0 20.02 -999 ? ZN ZN B3002 >ASP~B 209 59.20 58.74 26.87 58.46 57.81 25.09 58.83 58.28 25.98 2 0 20.92 -999 ? ZN ZN B3002 >VAL~B 210 60.13 61.48 30.26 62.13 62.41 30.47 61.13 61.95 30.36 3 0 14.60 -999 ? ZN ZN B3002 >LEU~B 211 56.47 64.64 30.25 57.10 66.70 30.07 56.78 65.67 30.16 3 0 17.65 -999 ? ZN ZN B3002 >LYS~B 212 54.83 60.52 31.02 50.74 58.29 29.07 52.78 59.40 30.04 2 0 25.39 -999 ? ZN ZN B3002 >VAL~B 213 57.09 58.63 33.49 58.94 57.48 33.44 58.01 58.06 33.47 3 0 18.19 -999 ? ZN ZN B3002 >ILE~B 214 57.36 62.98 35.55 58.23 64.07 35.84 57.79 63.52 35.69 3 0 16.01 -999 ? ZN ZN B3002 >ALA~B 215 53.04 61.66 35.52 52.28 61.92 34.27 52.66 61.79 34.89 2 0 21.82 -999 ? ZN ZN B3002 >ASN~B 216 53.55 56.88 35.16 52.72 56.55 33.21 53.14 56.71 34.18 2 0 23.52 -999 ? ZN ZN B3002 >ALA~B 217 55.11 58.24 39.05 56.56 58.67 39.00 55.84 58.45 39.02 2 0 19.15 -999 ? ZN ZN B3002 >VAL~B 218 53.02 61.05 40.58 52.70 63.16 40.28 52.86 62.11 40.43 3 0 21.55 -999 ? ZN ZN B3002 >ARG~B 219 47.56 57.29 37.72 49.21 57.73 35.07 48.38 57.51 36.40 2 0 26.03 -999 ? ZN ZN B3002 >TRP~B 220 53.62 52.87 42.23 56.63 54.47 44.18 55.13 53.67 43.20 3 0 23.92 -999 ? ZN ZN B3002 >ALA~B 221 53.33 57.94 44.67 54.46 58.98 44.44 53.90 58.46 44.56 2 0 22.27 -999 ? ZN ZN B3002 >ALA.B 222 49.98 59.44 45.78 48.69 59.46 45.03 49.33 59.45 45.40 2 0 27.36 -999 ? ZN ZN B3002 >PRO.B 223 49.57 61.33 49.58 49.39 59.27 48.82 49.48 60.30 49.20 3 0 28.08 -999 ? ZN ZN B3002 >VAL.B 224 46.92 56.24 50.71 47.73 54.21 50.40 47.33 55.23 50.56 3 0 30.15 -999 ? ZN ZN A3001 >ASN.B 225 46.78 55.21 55.43 45.58 53.46 55.00 46.18 54.33 55.22 2 0 27.73 -999 ? ZN ZN A3001 >ARG.B 226 48.75 63.42 53.82 49.73 64.87 51.32 49.24 64.14 52.57 2 0 28.12 -999 ? ZN ZN B3002 >GLY.B 227 48.81 60.93 58.74 48.89 60.21 58.72 48.85 60.57 58.73 1 0 26.45 -999 ? ZN ZN C3003 >GLU.B 228 45.63 58.01 59.74 45.20 56.53 58.23 45.41 57.27 58.99 2 0 27.56 -999 ? ZN ZN C3003 >ILE.B 229 51.85 55.56 62.32 51.74 54.02 62.04 51.80 54.79 62.18 3 0 19.92 -999 ? ZN ZN C3003 >VAL.B 230 50.71 55.61 66.76 49.09 55.39 68.16 49.90 55.50 67.46 3 0 18.35 -999 ? ZN ZN C3003 >PHE.B 231 55.45 55.65 66.31 55.77 55.45 63.56 55.61 55.55 64.93 3 0 15.89 -999 ? ZN ZN C3003 >GLY^B 232 55.21 55.02 71.93 54.92 54.34 71.67 55.06 54.68 71.80 1 0 11.98 -999 ? ZN ZN C3003 >ASN^B 233 54.57 53.87 76.53 54.32 52.32 77.94 54.44 53.09 77.24 2 0 10.96 -999 ? ZN ZN C3003 >VAL.B 234 51.35 50.97 74.76 51.63 50.54 72.65 51.49 50.76 73.71 3 0 13.51 -999 ? ZN ZN C3003 >LYS.B 235 49.31 48.75 77.10 50.13 51.37 81.68 49.72 50.06 79.39 2 0 15.66 -999 ? ZN ZN C3003 >PRO.B 236 49.32 44.67 78.49 48.98 45.69 76.57 49.15 45.18 77.53 3 0 16.02 -999 ? ZN ZN C3003 >LEU.B 237 46.36 43.61 72.38 46.40 45.33 71.11 46.38 44.47 71.75 3 0 19.36 -999 ? ZN ZN C3003 >GLU.B 238 46.90 39.40 73.40 45.04 38.67 72.66 45.97 39.03 73.03 2 0 21.30 -999 ? ZN ZN A3001 >PRO.B 239 44.48 38.28 78.97 46.37 39.33 78.57 45.43 38.80 78.77 3 0 21.91 -999 ? ZN ZN C3003 >ILE.B 240 51.22 40.11 80.32 52.23 40.84 79.80 51.72 40.47 80.06 3 0 15.96 -999 ? ZN ZN C3003 >LYS.B 241 50.76 36.12 82.88 50.02 32.19 80.81 50.39 34.15 81.84 2 0 22.76 -999 ? ZN ZN C3003 >ALA.B 242 52.76 36.87 86.01 52.22 37.13 87.39 52.49 37.00 86.70 2 0 20.49 -999 ? ZN ZN C3003 >THR.C 3 93.38 37.47 60.97 94.26 35.57 60.20 93.82 36.52 60.58 2 0 36.29 -999 ? ZN ZN C3003 >PRO.C 4 92.53 37.27 65.36 91.37 37.55 63.42 91.95 37.41 64.39 3 0 31.97 -999 ? ZN ZN C3003 >ILE.C 5 86.40 39.54 62.85 85.29 39.40 62.08 85.84 39.47 62.47 3 0 27.05 -999 ? ZN ZN C3003 >ARG^C 6 91.60 44.45 64.13 91.91 46.06 61.57 91.75 45.26 62.85 2 0 31.12 -999 ? ZN ZN C3003 >VAL^C 7 85.01 44.12 67.09 83.25 42.75 67.01 84.13 43.44 67.05 3 0 22.28 -999 ? ZN ZN C3003 >VAL^C 8 84.27 47.12 69.30 85.31 49.01 69.30 84.79 48.06 69.30 3 0 21.34 -999 ? ZN ZN C3003 >VAL^C 9 81.29 46.81 71.60 80.64 44.99 72.61 80.96 45.90 72.10 3 0 17.14 -999 ? ZN ZN C3003 >TRP^C 10 80.78 53.58 71.75 77.30 54.98 72.94 79.04 54.28 72.34 3 0 15.82 -999 ? ZN ZN C3003 >ASN^C 11 77.83 49.68 76.33 76.26 49.39 77.76 77.05 49.53 77.04 2 0 11.72 -999 ? ZN ZN C3003 >GLU.C 12 74.13 55.52 77.30 72.07 55.42 76.85 73.10 55.47 77.08 2 0 9.81 -999 ? ZN ZN C3003 >PHE.C 13 78.90 51.66 81.45 79.90 50.19 83.62 79.40 50.93 82.54 3 0 16.14 -999 ? ZN ZN C3003 >ARG~C 14 75.37 58.09 81.63 75.73 60.76 80.17 75.55 59.43 80.90 2 0 16.61 -999 ? ZN ZN C3003 >HIS~C 15 69.94 52.15 81.89 68.21 52.97 81.06 69.08 52.56 81.48 3 0 7.69 -999 ? ZN ZN C3003 >GLU~C 16 74.69 48.43 83.07 74.99 49.37 81.24 74.84 48.90 82.15 2 0 11.49 -999 ? ZN ZN C3003 >LYS~C 17 75.68 52.87 87.21 78.58 55.31 83.67 77.13 54.09 85.44 2 0 16.98 -999 ? ZN ZN C3003 >LYS~C 18 72.35 54.49 88.20 68.53 54.73 84.65 70.44 54.61 86.42 2 0 10.85 -999 ? ZN ZN C3003 >ASP~C 19 69.09 51.05 87.50 68.35 52.79 86.35 68.72 51.92 86.93 2 0 11.38 -999 ? ZN ZN C3003 >GLU~C 20 71.22 47.64 93.55 73.26 47.20 93.17 72.24 47.42 93.36 2 0 19.05 -999 ? ZN ZN C3003 >GLN~C 21 66.23 45.41 90.05 65.78 45.58 92.14 66.01 45.49 91.10 2 0 16.28 -999 ? ZN ZN C3003 >VAL~C 22 70.55 46.69 86.44 70.27 48.02 84.76 70.41 47.36 85.60 3 0 11.10 -999 ? ZN ZN C3003 >ARG~C 23 76.16 47.72 91.11 76.08 44.76 92.02 76.12 46.24 91.57 2 0 19.93 -999 ? ZN ZN C3003 >ALA~C 24 73.16 43.33 89.75 71.96 43.04 90.65 72.56 43.18 90.20 2 0 17.22 -999 ? ZN ZN C3003 >ILE~C 25 71.36 41.90 85.43 70.13 41.42 84.85 70.74 41.66 85.14 3 0 13.05 -999 ? ZN ZN C3003 >TYR~C 26 74.07 43.48 82.49 72.50 42.03 80.66 73.28 42.76 81.57 3 0 11.93 -999 ? ZN ZN C3003 >PRO.C 27 78.27 42.08 87.68 77.56 44.08 86.86 77.92 43.08 87.27 3 0 18.24 -999 ? ZN ZN C3003 >GLU.C 28 82.44 43.93 85.74 83.21 42.02 85.26 82.82 42.98 85.50 2 0 21.79 -999 ? ZN ZN C3003 >GLY~C 29 78.05 46.62 82.17 78.27 45.80 82.20 78.16 46.21 82.19 1 0 14.84 -999 ? ZN ZN C3003 >MET~C 30 76.54 44.86 79.14 72.48 45.95 78.54 74.51 45.41 78.84 2 0 8.73 -999 ? ZN ZN C3003 >HIS~C 31 80.70 47.60 78.15 81.05 48.51 80.01 80.87 48.06 79.08 3 0 16.50 -999 ? ZN ZN C3003 >THR~C 32 81.77 43.48 79.16 82.81 43.83 81.01 82.29 43.66 80.09 2 0 19.48 -999 ? ZN ZN C3003 >VAL~C 33 79.44 40.45 78.93 77.60 39.80 79.94 78.52 40.12 79.44 3 0 16.80 -999 ? ZN ZN C3003 >ILE~C 34 78.37 41.87 74.35 77.40 42.43 73.56 77.89 42.15 73.96 3 0 15.11 -999 ? ZN ZN C3003 >ALA~C 35 82.82 41.42 74.55 83.54 42.64 74.93 83.18 42.03 74.74 2 0 20.00 -999 ? ZN ZN C3003 >SER~C 36 83.88 38.56 76.84 83.87 39.33 79.07 83.87 38.95 77.95 2 0 21.72 -999 ? ZN ZN C3003 >TYR~C 37 79.68 35.01 73.82 78.69 32.94 72.30 79.19 33.97 73.06 3 0 21.19 -999 ? ZN ZN C3003 >LEU~C 38 82.85 38.82 70.98 81.08 39.47 69.85 81.97 39.15 70.41 3 0 20.79 -999 ? ZN ZN C3003 >ALA~C 39 86.70 37.07 72.86 87.17 37.64 74.17 86.93 37.36 73.52 2 0 25.34 -999 ? ZN ZN C3003 >GLU~C 40 85.55 33.62 76.24 84.52 32.78 77.87 85.03 33.20 77.06 2 0 25.72 -999 ? ZN ZN C3003 >ALA~C 41 84.53 32.91 70.36 83.25 33.60 69.86 83.89 33.26 70.11 2 0 25.01 -999 ? ZN ZN C3003 >GLY.C 42 87.86 33.99 68.84 87.35 34.59 68.94 87.60 34.29 68.89 1 0 28.65 -999 ? ZN ZN C3003 >PHE.C 43 84.76 37.63 67.18 82.92 36.42 65.50 83.84 37.02 66.34 3 0 24.73 -999 ? ZN ZN C3003 >ASP^C 44 90.65 40.98 67.85 91.89 42.55 68.60 91.27 41.76 68.23 2 0 29.05 -999 ? ZN ZN C3003 >ALA^C 45 87.10 42.34 71.05 86.05 41.44 71.68 86.57 41.89 71.36 2 0 23.18 -999 ? ZN ZN C3003 >ALA^C 46 87.27 45.76 72.82 88.13 46.80 72.16 87.70 46.28 72.49 2 0 23.96 -999 ? ZN ZN C3003 >THR^C 47 84.72 47.97 74.53 84.68 47.05 76.45 84.70 47.51 75.49 2 0 20.14 -999 ? ZN ZN C3003 >ALA^C 48 83.93 51.69 74.42 84.12 52.18 73.01 84.03 51.93 73.71 2 0 20.00 -999 ? ZN ZN C3003 >VAL^C 49 81.43 53.83 76.21 81.89 53.16 78.24 81.66 53.50 77.23 3 0 17.62 -999 ? ZN ZN C3003 >LEU.C 50 78.36 57.47 76.41 77.01 59.08 75.93 77.68 58.28 76.17 3 0 15.98 -999 ? ZN ZN C3003 >ASP.C 51 81.55 58.85 80.12 79.58 59.70 80.46 80.56 59.27 80.29 2 0 18.83 -999 ? ZN ZN C3003 >GLU~C 52 85.79 55.60 77.34 85.78 53.70 76.39 85.78 54.65 76.86 2 0 21.65 -999 ? ZN ZN C3003 >PRO~C 53 88.81 59.92 75.55 86.66 60.36 75.44 87.74 60.14 75.49 3 0 25.64 -999 ? ZN ZN C3003 >GLU~C 54 87.15 61.94 70.44 88.71 61.96 69.03 87.93 61.95 69.74 2 0 28.26 -999 ? ZN ZN C3003 >HIS~C 55 80.91 59.73 72.36 80.16 61.67 72.65 80.53 60.70 72.51 3 0 20.07 -999 ? ZN ZN C3003 >GLY~C 56 85.75 55.80 72.61 85.48 56.25 72.01 85.61 56.02 72.31 1 0 22.46 -999 ? ZN ZN C3003 >LEU~C 57 84.08 56.08 68.38 82.81 54.40 68.67 83.45 55.24 68.53 3 0 21.26 -999 ? ZN ZN C3003 >THR~C 58 88.49 58.10 67.65 89.93 57.77 69.16 89.21 57.94 68.41 2 0 27.69 -999 ? ZN ZN C3003 >ASP~C 59 90.41 58.72 63.25 89.17 60.36 62.62 89.79 59.54 62.94 2 0 30.27 -999 ? ZN ZN C3003 >GLU~C 60 94.32 57.14 66.02 93.45 59.12 65.78 93.88 58.13 65.90 2 0 32.27 -999 ? ZN ZN C3003 >VAL~C 61 89.96 53.09 67.03 88.97 52.86 68.93 89.46 52.97 67.98 3 0 26.47 -999 ? ZN ZN C3003 >LEU~C 62 86.62 54.28 63.66 84.75 54.79 64.64 85.69 54.53 64.15 3 0 24.90 -999 ? ZN ZN C3003 >ASP~C 63 91.36 53.51 61.12 90.62 55.46 60.45 90.99 54.49 60.79 2 0 31.09 -999 ? ZN ZN C3003 >ARG~C 64 92.88 50.08 66.54 93.43 51.65 69.12 93.15 50.87 67.83 2 0 29.78 -999 ? ZN ZN C3003 >CYH.C 65 87.42 48.31 63.90 84.96 48.62 65.11 86.19 48.46 64.51 2 0 23.18 -999 ? ZN ZN C3003 >ASP.C 66 86.39 44.30 61.44 88.47 44.16 61.01 87.43 44.23 61.22 2 0 28.72 -999 ? ZN ZN C3003 >VAL^C 67 82.53 45.61 63.16 81.40 43.78 62.84 81.96 44.69 63.00 3 0 22.25 -999 ? ZN ZN C3003 >LEU^C 68 80.89 49.49 65.30 80.90 51.15 66.71 80.89 50.32 66.01 3 0 19.26 -999 ? ZN ZN C3003 >VAL^C 69 78.24 46.82 68.06 78.13 44.81 68.86 78.18 45.81 68.46 3 0 15.96 -999 ? ZN ZN C3003 >TRP^C 70 74.42 52.50 69.69 77.36 54.90 68.75 75.89 53.70 69.22 3 0 14.07 -999 ? ZN ZN C3003 >TRP^C 71 71.83 47.18 74.27 70.59 49.78 76.95 71.21 48.48 75.61 3 0 6.63 -999 ? ZN ZN C3003 >GLY.C 72 72.21 53.04 73.85 71.60 52.43 73.70 71.91 52.74 73.77 1 0 8.90 -999 ? ZN ZN C3003 >HIS.C 73 67.33 53.11 77.06 65.39 52.85 77.81 66.36 52.98 77.43 3 0 4.45 -999 ? ZN ZN C3003 >ILE.C 74 68.69 57.01 79.29 68.74 56.36 80.53 68.72 56.69 79.91 3 0 9.40 -999 ? ZN ZN C3003 >ALA~C 75 71.61 59.46 76.39 72.85 59.39 77.26 72.23 59.42 76.83 2 0 13.25 -999 ? ZN ZN C3003 >HIS~C 76 69.64 57.28 71.96 69.12 55.25 72.11 69.38 56.27 72.03 3 0 9.63 -999 ? ZN ZN C3003 >ASP~C 77 70.47 63.76 73.10 70.07 63.04 75.17 70.27 63.40 74.14 2 0 15.06 -999 ? ZN ZN C3003 >GLU~C 78 74.36 63.31 76.50 74.97 62.96 78.47 74.67 63.14 77.48 2 0 17.48 -999 ? ZN ZN C3003 >VAL~C 79 76.68 61.32 71.24 76.65 59.27 70.51 76.67 60.30 70.87 3 0 17.34 -999 ? ZN ZN C3003 >LYS~C 80 78.29 64.21 69.41 80.07 65.98 73.73 79.18 65.09 71.57 2 0 23.05 -999 ? ZN ZN C3003 >ASP~C 81 76.80 66.00 65.20 74.74 66.26 65.81 75.77 66.13 65.50 2 0 22.55 -999 ? ZN ZN C3003 >GLU~C 82 83.69 65.15 65.05 85.23 66.47 65.58 84.46 65.81 65.32 2 0 29.02 -999 ? ZN ZN C3003 >VAL~C 83 81.45 61.21 66.03 82.06 60.41 67.97 81.76 60.81 67.00 3 0 22.75 -999 ? ZN ZN C3003 >VAL~C 84 78.16 60.08 64.46 76.08 60.30 64.87 77.12 60.19 64.66 3 0 20.37 -999 ? ZN ZN C3003 >GLU~C 85 78.29 63.73 61.04 78.42 65.84 61.52 78.36 64.79 61.28 2 0 25.92 -999 ? ZN ZN B3002 >ARG~C 86 85.79 59.35 64.03 86.03 61.64 66.01 85.91 60.49 65.02 2 0 26.86 -999 ? ZN ZN C3003 >VAL~C 87 81.04 56.28 62.25 80.31 55.30 64.04 80.68 55.79 63.14 3 0 21.80 -999 ? ZN ZN C3003 >HIS~C 88 76.90 58.08 57.98 75.79 58.18 56.21 76.35 58.13 57.10 3 0 23.17 -999 ? ZN ZN B3002 >ARG~C 89 83.44 60.79 56.64 83.66 62.31 59.33 83.55 61.55 57.99 2 0 25.93 -999 ? ZN ZN B3002 >ARG~C 90 86.18 54.20 59.37 86.55 51.23 58.53 86.36 52.71 58.95 2 0 28.27 -999 ? ZN ZN C3003 >VAL~C 91 80.11 52.08 57.72 78.27 51.74 58.78 79.19 51.91 58.25 3 0 23.34 -999 ? ZN ZN C3003 >LEU~C 92 79.47 54.77 53.71 77.41 55.64 53.61 78.44 55.21 53.66 3 0 22.04 -999 ? ZN ZN B3002 >GLU~C 93 85.01 52.99 55.38 86.76 54.02 55.97 85.89 53.51 55.67 2 0 27.53 -999 ? ZN ZN B3002 >GLY.C 94 82.62 48.86 54.68 82.64 49.36 55.33 82.63 49.11 55.01 1 0 27.94 -999 ? ZN ZN B3002 >MET.C 95 82.72 48.76 58.54 83.60 50.73 62.08 83.16 49.75 60.31 2 0 23.74 -999 ? ZN ZN C3003 >GLY^C 96 80.03 46.46 59.90 80.39 47.08 60.32 80.21 46.77 60.11 1 0 22.61 -999 ? ZN ZN C3003 >LEU^C 97 76.85 49.02 61.99 76.23 50.61 63.37 76.54 49.82 62.68 3 0 18.08 -999 ? ZN ZN C3003 >ILE^C 98 75.91 44.39 65.52 75.51 43.32 64.74 75.71 43.85 65.13 3 0 16.54 -999 ? ZN ZN C3003 >VAL^C 99 72.66 47.73 66.45 71.94 49.63 65.69 72.30 48.68 66.07 3 0 12.76 -999 ? ZN ZN C3003 >LEU^C 100 72.08 45.71 70.60 73.31 43.99 70.39 72.69 44.85 70.50 3 0 10.76 -999 ? ZN ZN C3003 >HIS.C 101 66.86 46.59 73.58 65.14 46.69 74.78 66.00 46.64 74.18 3 0 -3.46 -999 ? ZN ZN C3003s >SER~C 102 67.33 50.55 72.23 68.21 50.38 74.52 67.77 50.47 73.38 2 0 4.20 -999 ? ZN ZN C3003 >GLY~C 103 70.11 51.35 69.73 69.31 51.23 69.65 69.71 51.29 69.69 1 0 8.84 -999 ? ZN ZN C3003 >HIS~C 104 64.86 51.46 68.35 63.53 52.33 69.72 64.20 51.89 69.03 3 0 7.79 -999 ? ZN ZN C3003 >PHE~C 105 64.66 55.97 69.46 61.95 56.43 69.10 63.30 56.20 69.28 3 0 10.10 -999 ? ZN ZN C3003 >SER~C 106 70.66 55.96 68.22 71.73 54.12 66.92 71.19 55.04 67.57 2 0 12.79 -999 ? ZN ZN C3003 >LYS~C 107 71.73 58.88 66.09 73.83 64.27 68.53 72.78 61.58 67.31 2 0 19.40 -999 ? ZN ZN C3003 >ILE~C 108 75.14 55.80 64.38 75.56 55.34 63.77 75.35 55.57 64.07 3 0 17.50 -999 ? ZN ZN C3003 >PHE~C 109 69.50 52.03 63.50 67.95 50.10 62.32 68.73 51.07 62.91 3 0 14.12 -999 ? ZN ZN C3003 >LYS~C 110 68.47 56.84 62.49 66.65 60.06 66.83 67.56 58.45 64.66 2 0 14.66 -999 ? ZN ZN C3003 >LYS~C 111 71.02 58.50 60.17 74.40 62.25 58.28 72.71 60.38 59.22 2 0 22.77 -999 ? ZN ZN B3002 >LEU~C 112 72.40 54.07 58.72 74.52 53.71 58.81 73.46 53.89 58.77 3 0 20.19 -999 ? ZN ZN C3003 >MET~C 113 67.89 54.44 58.05 67.73 51.27 58.78 67.81 52.85 58.41 2 0 17.91 -999 ? ZN ZN C3003 >GLY~C 114 66.62 57.86 56.98 66.28 57.41 57.54 66.45 57.63 57.26 1 0 21.30 -999 ? ZN ZN C3003 >THR.C 115 63.44 57.38 59.07 63.17 55.32 58.40 63.31 56.35 58.74 2 0 19.00 -999 ? ZN ZN C3003 >THR.C 116 62.44 58.04 62.72 60.28 58.52 62.89 61.36 58.28 62.81 2 0 16.97 -999 ? ZN ZN C3003 >CYH.C 117 62.97 54.39 63.76 65.46 54.15 62.56 64.21 54.27 63.16 2 0 14.65 -999 ? ZN ZN C3003 >ASN.C 118 59.03 56.01 66.17 58.44 56.67 68.12 58.74 56.34 67.14 2 0 12.78 -999 ? ZN ZN C3003 >LEU.C 119 59.02 50.86 67.51 60.59 50.57 69.03 59.80 50.72 68.27 3 0 9.50 -999 ? ZN ZN C3003 >LYS^C 120 55.50 50.86 70.04 51.64 50.24 66.30 53.57 50.55 68.17 2 0 16.43 -999 ? ZN ZN C3003 >TRP^C 121 58.18 52.82 73.34 58.38 53.06 77.24 58.28 52.94 75.29 3 0 7.52 -999 ? ZN ZN C3003 >ARG^C 122 52.91 46.26 77.86 52.35 45.00 75.12 52.63 45.63 76.49 2 0 12.99 -999 ? ZN ZN C3003 >GLU^C 123 60.15 47.31 81.33 61.22 48.64 82.57 60.68 47.97 81.95 2 0 7.18 -999 ? ZN ZN C3003 >ALA^C 124 56.08 44.32 81.31 54.71 44.29 80.68 55.40 44.31 81.00 2 0 11.85 -999 ? ZN ZN C3003 >ASP^C 125 58.40 41.07 83.26 58.99 42.66 84.51 58.69 41.86 83.89 2 0 11.86 -999 ? ZN ZN C3003 >GLU^C 126 55.94 40.79 76.94 54.55 42.22 76.29 55.24 41.50 76.61 2 0 12.18 -999 ? ZN ZN C3003 >LYS^C 127 57.58 36.47 76.90 54.89 31.17 77.34 56.24 33.82 77.12 2 0 20.38 -999 ? ZN ZN C3003 >GLU^C 128 60.71 38.35 71.91 62.25 39.83 71.67 61.48 39.09 71.79 2 0 10.57 -999 ? ZN ZN C3003 >ARG^C 129 57.93 30.83 70.14 56.02 31.02 72.59 56.98 30.92 71.37 2 0 20.31 -999 ? ZN ZN C3003 >LEU^C 130 63.34 35.66 68.29 64.13 37.20 69.64 63.73 36.43 68.96 3 0 14.60 -999 ? ZN ZN C3003 >TRP^C 131 57.80 33.07 66.35 57.53 29.15 66.29 57.67 31.11 66.32 3 0 18.93 -999 ? ZN ZN A3001 >VAL^C 132 63.55 32.44 62.31 65.46 31.35 62.32 64.50 31.89 62.32 3 0 22.11 -999 ? ZN ZN C3003 >VAL.C 133 62.24 33.38 58.90 61.00 35.09 59.48 61.62 34.23 59.19 3 0 20.83 -999 ? ZN ZN A3001 >ALA.C 134 65.63 33.16 56.99 66.36 34.51 56.87 66.00 33.84 56.93 2 0 24.30 -999 ? ZN ZN C3003 >PRO.C 135 64.77 28.94 56.62 66.32 30.21 57.65 65.55 29.57 57.13 3 0 23.04 -999 ? ZN ZN A3001 >GLY.C 136 69.70 29.43 55.73 69.52 30.15 56.06 69.61 29.79 55.90 1 0 27.09 -999 ? ZN ZN A3001 >HIS~C 137 71.06 35.32 56.88 72.15 37.08 56.53 71.61 36.20 56.70 3 0 24.42 -999 ? ZN ZN C3003 >PRO~C 138 75.47 33.55 56.18 74.07 32.91 57.82 74.77 33.23 57.00 3 0 26.91 -999 ? ZN ZN C3003 >ILE~C 139 72.49 36.15 61.11 72.29 37.54 61.36 72.39 36.85 61.24 3 0 20.85 -999 ? ZN ZN C3003 >VAL~C 140 71.17 31.87 62.31 69.24 32.15 61.35 70.20 32.01 61.83 3 0 23.01 -999 ? ZN ZN C3003 >GLU~C 141 76.14 28.15 61.53 78.23 28.55 61.42 77.19 28.35 61.47 2 0 28.72 -999 ? ZN ZN C3003 >GLY.C 142 73.30 26.87 64.96 72.75 27.35 64.73 73.02 27.11 64.84 1 0 26.35 -999 ? ZN ZN C3003 >ILE.C 143 69.70 29.96 65.67 69.81 30.55 66.92 69.76 30.26 66.29 3 0 21.87 -999 ? ZN ZN C3003 >GLY.C 144 66.81 26.38 66.16 66.85 27.20 66.00 66.83 26.79 66.08 1 0 24.91 -999 ? ZN ZN C3003 >PRO.C 145 62.52 25.55 66.05 63.94 27.05 65.16 63.23 26.30 65.61 3 0 22.63 -999 ? ZN ZN A3001 >TYR^C 146 61.05 29.22 68.74 60.03 27.21 70.36 60.54 28.22 69.55 3 0 22.26 -999 ? ZN ZN C3003 >ILE^C 147 65.82 32.85 70.33 67.13 33.44 70.35 66.47 33.14 70.34 3 0 17.07 -999 ? ZN ZN C3003 >GLU^C 148 60.45 31.26 74.77 59.15 29.63 75.07 59.80 30.45 74.92 2 0 20.21 -999 ? ZN ZN C3003 >LEU^C 149 63.52 36.19 75.68 65.36 36.49 74.59 64.44 36.34 75.14 3 0 12.75 -999 ? ZN ZN C3003 >GLU^C 150 61.56 32.17 80.22 59.78 31.32 79.38 60.67 31.74 79.80 2 0 18.63 -999 ? ZN ZN C3003 >GLN^C 151 60.88 37.65 82.41 60.99 38.39 84.41 60.94 38.02 83.41 2 0 13.89 -999 ? ZN ZN C3003 >GLU^C 152 63.70 40.53 76.05 64.77 42.38 76.14 64.24 41.46 76.10 2 0 6.66 -999 ? ZN ZN C3003 >GLU^C 153 60.69 47.07 76.29 61.74 48.75 76.82 61.22 47.91 76.56 2 0 -2.96 -999 ? ZN ZN C3003s >MET^C 154 58.05 44.47 73.95 55.50 45.78 71.89 56.78 45.12 72.92 2 0 10.64 -999 ? ZN ZN C3003 >TYR^C 155 61.20 47.29 70.82 63.33 48.46 72.06 62.26 47.87 71.44 3 0 -5.51 -999 ? ZN ZN C3003s >GLY^C 156 55.83 46.40 68.27 56.40 46.98 68.04 56.12 46.69 68.15 1 0 12.19 -999 ? ZN ZN C3003 >GLU.C 157 56.03 45.16 63.36 57.59 45.98 62.19 56.81 45.57 62.78 2 0 16.04 -999 ? ZN ZN C3003 >PHE.C 158 55.08 50.91 60.86 56.80 51.59 58.72 55.94 51.25 59.79 3 0 18.77 -999 ? ZN ZN C3003 >PHE.C 159 61.01 48.96 63.68 63.72 49.12 64.39 62.37 49.04 64.03 3 0 12.45 -999 ? ZN ZN C3003 >ASP.C 160 59.21 54.42 61.67 59.32 55.84 60.08 59.26 55.13 60.88 2 0 18.35 -999 ? ZN ZN C3003 >ILE.C 161 63.15 50.36 59.81 63.33 49.19 60.50 63.24 49.77 60.15 3 0 16.20 -999 ? ZN ZN C3003 >PRO.C 162 65.37 51.85 56.01 63.18 51.42 56.25 64.28 51.64 56.13 3 0 20.31 -999 ? ZN ZN C3003 >GLU.C 163 61.20 45.83 52.96 60.40 45.46 51.04 60.80 45.65 52.00 2 0 25.84 -999 ? ZN ZN C3003 >PRO.C 164 63.95 44.88 57.25 64.53 45.78 55.33 64.24 45.33 56.29 3 0 20.33 -999 ? ZN ZN C3003 >ASP.C 165 68.87 43.61 52.80 69.95 45.31 52.10 69.41 44.46 52.45 2 0 25.03 -999 ? ZN ZN C3003 >GLU^C 166 68.10 39.34 53.16 69.11 37.47 52.87 68.61 38.40 53.01 2 0 26.49 -999 ? ZN ZN C3003 >THR^C 167 64.24 39.86 57.72 62.32 40.66 58.18 63.28 40.26 57.95 2 0 20.07 -999 ? ZN ZN C3003 >ILE^C 168 67.39 37.40 60.37 68.27 36.78 59.47 67.83 37.09 59.92 3 0 20.50 -999 ? ZN ZN C3003 >PHE^C 169 65.54 36.36 64.58 67.67 34.76 65.30 66.60 35.56 64.94 3 0 17.72 -999 ? ZN ZN C3003 >ILE^C 170 58.97 37.69 62.57 57.96 38.06 61.57 58.46 37.88 62.07 3 0 19.09 -999 ? ZN ZN C3003 >SER^C 171 59.12 38.21 67.21 61.06 39.21 68.32 60.09 38.71 67.76 2 0 13.14 -999 ? ZN ZN C3003 >TRP^C 172 52.98 35.19 68.86 52.95 34.56 72.73 52.96 34.87 70.80 3 0 19.16 -999 ? ZN ZN C3003 >PHE^C 173 56.60 40.87 71.92 59.16 41.69 71.37 57.88 41.28 71.64 3 0 11.29 -999 ? ZN ZN C3003 >GLU.C 174 52.38 36.78 77.23 53.18 36.39 79.17 52.78 36.59 78.20 2 0 17.31 -999 ? ZN ZN C3003 >GLY.C 175 50.80 40.99 74.83 50.97 40.62 74.17 50.88 40.81 74.50 1 0 16.07 -999 ? ZN ZN C3003 >GLY.C 176 49.69 40.74 71.22 50.43 40.95 71.22 50.06 40.84 71.22 1 0 17.83 -999 ? ZN ZN C3003 >GLU.C 177 52.26 44.74 70.42 51.75 44.26 72.47 52.00 44.50 71.45 2 0 14.27 -999 ? ZN ZN C3003 >VAL^C 178 54.85 41.34 66.57 53.58 40.64 64.93 54.22 40.99 65.75 3 0 16.86 -999 ? ZN ZN C3003 >PHE^C 179 59.74 44.54 66.65 61.23 46.83 66.33 60.49 45.68 66.49 3 0 11.14 -999 ? ZN ZN C3003 >ARG^C 180 59.43 43.93 59.41 59.20 46.86 58.82 59.31 45.40 59.11 2 0 18.41 -999 ? ZN ZN C3003 >SER^C 181 63.44 41.74 65.37 61.80 41.24 67.07 62.62 41.49 66.22 2 0 12.40 -999 ? ZN ZN C3003 >GLY^C 182 66.39 40.77 63.18 65.68 41.06 62.70 66.03 40.91 62.94 1 0 15.58 -999 ? ZN ZN C3003 >CYH^C 183 66.83 42.84 60.00 64.52 44.20 60.86 65.68 43.52 60.43 2 0 16.15 -999 ? ZN ZN C3003 >THR^C 184 69.84 43.25 57.72 70.24 41.30 56.94 70.04 42.28 57.33 2 0 21.56 -999 ? ZN ZN C3003 >PHE^C 185 69.08 47.63 57.10 66.85 47.63 58.70 67.97 47.63 57.90 3 0 18.73 -999 ? ZN ZN C3003 >THR^C 186 73.53 47.35 53.38 74.46 46.03 51.96 73.99 46.69 52.67 2 0 26.39 -999 ? ZN ZN C3003 >ARG^C 187 71.97 52.43 54.17 69.20 50.94 53.96 70.58 51.68 54.07 2 0 22.85 -999 ? ZN ZN C3003 >GLY.C 188 77.59 51.62 50.99 77.21 50.90 51.24 77.40 51.26 51.11 1 0 22.20 -999 ? ZN ZN B3002 >LYS.C 189 79.93 48.70 51.47 85.37 49.76 49.01 82.65 49.23 50.24 2 0 25.08 -999 ? ZN ZN B3002 >GLY^C 190 78.81 48.29 55.09 78.32 48.15 54.50 78.57 48.22 54.79 1 0 25.50 -999 ? ZN ZN C3003 >LYS^C 191 76.59 45.56 56.39 80.03 42.28 53.29 78.31 43.92 54.84 2 0 28.47 -999 ? ZN ZN C3003 >ILE^C 192 73.44 47.68 59.10 73.20 48.98 59.12 73.32 48.33 59.11 3 0 19.25 -999 ? ZN ZN C3003 >PHE^C 193 71.96 41.65 62.45 70.23 39.81 63.58 71.09 40.73 63.02 3 0 16.92 -999 ? ZN ZN C3003 >TYR^C 194 67.60 46.51 64.66 66.39 47.03 67.12 67.00 46.77 65.89 3 0 10.89 -999 ? ZN ZN C3003 >PHE^C 195 69.61 40.51 67.53 69.07 38.03 68.61 69.34 39.27 68.07 3 0 13.59 -999 ? ZN ZN C3003 >ARG.C 196 62.36 43.53 69.79 62.67 43.42 72.80 62.51 43.47 71.30 2 0 6.89 -999 ? ZN ZN C3003 >PRO.C 197 66.54 39.76 71.11 66.65 41.93 71.61 66.59 40.84 71.36 3 0 9.75 -999 ? ZN ZN C3003 >GLY.C 198 68.54 43.36 75.14 67.83 43.67 75.26 68.19 43.52 75.20 1 0 6.98 -999 ? ZN ZN C3003 >HIS.C 199 64.53 46.52 78.69 63.84 48.35 79.46 64.19 47.44 79.07 3 0 -3.26 -999 ? ZN ZN C3003s >GLU.C 200 68.17 48.78 81.37 66.89 49.67 79.93 67.53 49.23 80.65 2 0 4.34 -999 ? ZN ZN C3003 >THR.C 201 66.61 45.04 83.39 64.82 46.31 83.33 65.72 45.68 83.36 2 0 7.57 -999 ? ZN ZN C3003 >TYR.C 202 64.31 41.75 81.14 61.91 43.13 81.50 63.11 42.44 81.32 3 0 8.45 -999 ? ZN ZN C3003 >PRO~C 203 68.41 37.60 82.92 69.04 39.38 81.85 68.72 38.49 82.38 3 0 12.85 -999 ? ZN ZN C3003 >THR~C 204 69.12 38.85 77.95 67.72 39.79 76.64 68.42 39.32 77.29 2 0 9.75 -999 ? ZN ZN C3003 >TYR~C 205 73.02 41.26 76.01 71.79 43.08 74.26 72.41 42.17 75.13 3 0 10.43 -999 ? ZN ZN C3003 >HIS~C 206 73.97 36.88 81.54 75.20 38.19 82.61 74.59 37.53 82.07 3 0 16.28 -999 ? ZN ZN C3003 >HIS~C 207 69.02 33.23 75.93 67.97 31.61 75.12 68.50 32.42 75.53 3 0 17.07 -999 ? ZN ZN C3003 >PRO~C 208 72.88 29.93 76.45 72.97 31.85 75.36 72.92 30.89 75.91 3 0 19.95 -999 ? ZN ZN C3003 >ASP~C 209 69.95 31.44 71.41 69.59 29.32 71.50 69.77 30.38 71.45 2 0 20.88 -999 ? ZN ZN C3003 >VAL~C 210 71.29 35.61 71.86 70.21 37.11 72.98 70.75 36.36 72.42 3 0 14.59 -999 ? ZN ZN C3003 >LEU~C 211 75.86 35.22 73.38 76.26 36.23 75.23 76.06 35.72 74.30 3 0 17.65 -999 ? ZN ZN C3003 >LYS~C 212 75.48 33.17 69.38 74.85 27.23 68.82 75.16 30.20 69.10 2 0 25.20 -999 ? ZN ZN C3003 >VAL~C 213 73.37 35.38 67.03 71.22 35.75 66.68 72.29 35.56 66.86 3 0 18.13 -999 ? ZN ZN C3003 >ILE~C 214 75.74 39.04 69.22 75.62 40.10 70.12 75.68 39.57 69.67 3 0 15.97 -999 ? ZN ZN C3003 >ALA~C 215 78.73 36.35 67.17 79.15 35.19 67.94 78.94 35.77 67.56 2 0 21.72 -999 ? ZN ZN C3003 >ASN~C 216 75.96 34.24 63.81 75.98 32.17 64.47 75.97 33.21 64.14 2 0 23.50 -999 ? ZN ZN C3003 >ALA~C 217 76.32 38.56 62.87 75.25 39.37 63.59 75.79 38.97 63.23 2 0 19.15 -999 ? ZN ZN C3003 >VAL~C 218 79.85 39.87 63.65 81.01 40.36 65.40 80.43 40.12 64.53 3 0 21.61 -999 ? ZN ZN C3003 >ARG~C 219 82.07 33.54 61.10 83.17 33.14 64.00 82.62 33.34 62.55 2 0 27.33 -999 ? ZN ZN C3003 >TRP~C 220 75.89 37.90 56.49 74.45 41.47 57.33 75.17 39.68 56.91 3 0 23.94 -999 ? ZN ZN C3003 >ALA~C 221 79.14 41.79 58.87 78.51 42.63 60.02 78.82 42.21 59.44 2 0 22.31 -999 ? ZN ZN C3003 >ALA.C 222 82.98 41.67 58.50 83.76 40.36 58.52 83.37 41.01 58.51 2 0 27.50 -999 ? ZN ZN C3003 >PRO.C 223 85.03 45.38 57.59 84.05 43.76 56.43 84.54 44.57 57.01 3 0 28.05 -999 ? ZN ZN C3003 >VAL.C 224 84.89 43.04 52.22 83.30 41.78 51.15 84.10 42.41 51.69 3 0 30.24 -999 ? ZN ZN D3008 >ASN.C 225 85.88 45.55 48.70 85.96 43.94 47.34 85.92 44.74 48.02 2 0 27.84 -999 ? ZN ZN D3008 >ARG.C 226 87.39 48.59 56.53 87.19 49.50 59.42 87.29 49.05 57.97 2 0 28.16 -999 ? ZN ZN C3003 >GLY.C 227 87.88 51.51 51.85 87.09 51.40 51.58 87.48 51.46 51.72 1 0 26.79 -999 ? ZN ZN B3002 >GLU.C 228 88.66 55.76 48.21 89.13 57.61 47.23 88.90 56.68 47.72 2 0 21.76 -999 ? ZN ZN B3002 >ILE.C 229 83.27 53.99 46.87 82.17 53.14 46.83 82.72 53.56 46.85 3 0 20.00 -999 ? ZN ZN B3002 >VAL.C 230 85.76 56.26 43.75 87.38 55.97 42.34 86.57 56.11 43.04 3 0 18.86 -999 ? ZN ZN B3002 >PHE.C 231 81.66 58.27 44.64 80.58 56.40 46.38 81.12 57.34 45.51 3 0 15.93 -999 ? ZN ZN B3002 >GLY^C 232 83.19 61.95 40.61 83.05 61.29 40.17 83.12 61.62 40.39 1 0 12.25 -999 ? ZN ZN B3002 >ASN^C 233 84.45 64.53 36.85 84.38 65.07 34.81 84.41 64.80 35.83 2 0 11.48 -999 ? ZN ZN B3002 >VAL.C 234 85.32 60.28 34.88 84.16 58.70 35.88 84.74 59.49 35.38 3 0 14.07 -999 ? ZN ZN B3002 >LYS.C 235 86.66 59.92 31.33 91.93 63.32 30.70 89.29 61.62 31.01 2 0 19.91 -999 ? ZN ZN B3002 >PRO.C 236 84.96 59.41 27.32 85.10 58.22 29.24 85.03 58.81 28.28 3 0 16.67 -999 ? ZN ZN B3002 >LEU.C 237 85.26 52.91 29.25 85.79 52.68 31.36 85.52 52.79 30.30 3 0 20.09 -999 ? ZN ZN B3002 >GLU.C 238 82.62 52.35 25.60 83.79 50.68 25.04 83.20 51.51 25.32 2 0 21.26 -999 ? ZN ZN D3008 >PRO.C 239 84.79 55.18 20.67 84.47 56.24 22.59 84.63 55.71 21.63 3 0 21.95 -999 ? ZN ZN B3002 >ILE.C 240 81.41 60.25 23.48 80.81 60.60 24.64 81.11 60.42 24.06 3 0 16.12 -999 ? ZN ZN B3002 >LYS.C 241 80.48 60.66 18.89 78.44 58.60 15.67 79.46 59.63 17.28 2 0 22.98 -999 ? ZN ZN B3002 >ALA.C 242 80.89 64.44 18.98 82.29 65.11 19.01 81.59 64.78 18.99 2 0 19.55 -999 ? ZN ZN B3002 >THR.D 3 86.75 20.94 55.99 84.71 20.09 56.05 85.73 20.51 56.02 2 0 34.30 -999 ? ZN ZN D3008 >PRO.D 4 88.36 20.43 51.92 87.04 21.86 53.02 87.70 21.14 52.47 3 0 31.79 -999 ? ZN ZN D3008 >ILE.D 5 83.19 24.51 50.30 82.51 25.69 50.33 82.85 25.10 50.31 3 0 27.11 -999 ? ZN ZN D3008 >ARG^D 6 82.07 17.37 50.74 79.57 17.02 52.50 80.82 17.19 51.62 2 0 31.23 -999 ? ZN ZN D3008 >VAL^D 7 81.61 21.62 44.86 82.61 23.24 43.78 82.11 22.43 44.32 3 0 22.30 -999 ? ZN ZN D3008 >VAL^D 8 80.35 19.70 41.83 79.31 17.87 41.88 79.83 18.78 41.85 3 0 21.43 -999 ? ZN ZN D3008 >VAL^D 9 80.66 21.42 38.49 82.22 22.75 37.90 81.44 22.08 38.19 3 0 17.20 -999 ? ZN ZN D3008 >TRP^D 10 75.50 17.67 36.11 73.82 19.09 32.84 74.66 18.38 34.48 3 0 15.95 -999 ? ZN ZN D3008 >ASN^D 11 79.75 21.02 32.09 80.01 21.87 30.10 79.88 21.45 31.10 2 0 11.68 -999 ? ZN ZN D3008 >GLU.D 12 74.57 20.08 27.52 73.62 21.75 26.65 74.09 20.91 27.08 2 0 9.74 -999 ? ZN ZN D3008 >PHE.D 13 81.53 17.37 28.17 84.16 16.69 27.61 82.85 17.03 27.89 3 0 16.39 -999 ? ZN ZN D3008 >ARG~D 14 75.67 16.27 23.87 72.96 14.95 24.43 74.32 15.61 24.15 2 0 16.44 -999 ? ZN ZN D3008 >HIS~D 15 78.13 23.70 22.64 76.34 24.64 22.07 77.23 24.17 22.35 3 0 7.82 -999 ? ZN ZN D3008 >GLU~D 16 83.35 22.08 25.56 81.66 21.83 26.82 82.50 21.95 26.19 2 0 11.55 -999 ? ZN ZN D3008 >LYS~D 17 82.76 17.30 21.80 82.96 11.99 23.57 82.86 14.64 22.68 2 0 20.80 -999 ? ZN ZN D3008 >LYS~D 18 81.03 18.34 18.56 75.48 16.90 20.32 78.26 17.62 19.44 2 0 15.08 -999 ? ZN ZN D3008 >ASP~D 19 81.46 22.95 18.14 81.63 24.67 16.91 81.54 23.81 17.53 2 0 12.27 -999 ? ZN ZN D3008 >GLU~D 20 86.64 20.22 15.07 87.48 19.03 16.67 87.06 19.62 15.87 2 0 19.24 -999 ? ZN ZN D3008 >GLN~D 21 85.38 28.29 16.97 84.37 29.07 18.68 84.88 28.68 17.82 2 0 11.38 -999 ? ZN ZN D3008 >VAL~D 22 84.80 25.17 20.87 82.80 25.16 21.75 83.80 25.17 21.31 3 0 11.17 -999 ? ZN ZN D3008 >ARG~D 23 87.44 18.36 20.58 90.13 17.81 19.26 88.79 18.09 19.92 2 0 20.90 -999 ? ZN ZN D3008 >ALA~D 24 90.01 24.25 20.57 90.18 25.16 19.35 90.10 24.70 19.96 2 0 17.15 -999 ? ZN ZN D3008 >ILE.D 25 87.99 27.52 23.53 87.45 28.90 23.52 87.72 28.21 23.53 3 0 12.98 -999 ? ZN ZN D3008 >TYR.D 26 86.29 25.61 26.89 85.76 28.25 27.81 86.03 26.93 27.35 3 0 11.89 -999 ? ZN ZN D3008 >PRO.D 27 91.58 21.69 25.43 89.40 21.27 25.12 90.49 21.48 25.27 3 0 18.15 -999 ? ZN ZN D3008 >GLU.D 28 90.87 17.85 28.68 92.30 19.16 27.87 91.58 18.51 28.27 2 0 21.13 -999 ? ZN ZN D3008 >GLY~D 29 85.26 20.70 28.63 85.97 21.07 28.88 85.62 20.89 28.76 1 0 15.01 -999 ? ZN ZN D3008 >MET~D 30 84.38 23.94 30.44 81.76 26.47 28.42 83.07 25.20 29.43 2 0 8.79 -999 ? ZN ZN D3008 >HIS~D 31 83.25 19.52 32.97 83.62 18.04 31.53 83.43 18.78 32.25 3 0 16.58 -999 ? ZN ZN D3008 >THR~D 32 87.37 20.87 33.77 88.45 19.35 32.74 87.91 20.11 33.26 2 0 19.40 -999 ? ZN ZN D3008 >VAL~D 33 88.67 24.41 33.58 88.86 25.86 31.98 88.77 25.13 32.78 3 0 16.78 -999 ? ZN ZN D3008 >ILE~D 34 84.78 25.79 36.21 83.55 26.47 36.08 84.16 26.13 36.14 3 0 15.16 -999 ? ZN ZN D3008 >ALA~D 35 86.83 22.63 38.60 86.36 21.17 38.32 86.60 21.90 38.46 2 0 20.06 -999 ? ZN ZN D3008 >SER~D 36 90.65 22.89 38.26 92.82 23.06 37.25 91.74 22.98 37.76 2 0 22.95 -999 ? ZN ZN D3008 >TYR~D 37 89.96 28.98 39.28 90.38 31.42 40.52 90.17 30.20 39.90 3 0 21.13 -999 ? ZN ZN D3008 >LEU~D 38 86.88 25.17 42.11 85.13 26.41 41.73 86.01 25.79 41.92 3 0 20.77 -999 ? ZN ZN D3008 >ALA~D 39 90.65 22.92 43.41 91.01 21.70 42.64 90.83 22.31 43.02 2 0 25.51 -999 ? ZN ZN D3008 >GLU~D 40 94.80 25.08 41.11 95.80 26.03 39.51 95.30 25.55 40.31 2 0 25.72 -999 ? ZN ZN D3008 >ALA~D 41 91.35 27.81 45.35 90.15 28.53 44.82 90.75 28.17 45.09 2 0 24.95 -999 ? ZN ZN D3008 >GLY.D 42 91.11 25.14 48.05 90.53 25.11 47.50 90.82 25.12 47.77 1 0 28.64 -999 ? ZN ZN D3008 >PHE.D 43 86.27 25.62 46.59 85.65 28.22 47.19 85.96 26.92 46.89 3 0 24.74 -999 ? ZN ZN D3008 >ASP^D 44 86.54 19.13 48.39 86.27 17.05 48.06 86.40 18.09 48.23 2 0 29.22 -999 ? ZN ZN D3008 >ALA^D 45 85.91 19.92 43.53 86.47 21.07 42.67 86.19 20.50 43.10 2 0 23.27 -999 ? ZN ZN D3008 >ALA^D 46 84.39 17.25 41.29 83.63 16.25 42.09 84.01 16.75 41.69 2 0 24.22 -999 ? ZN ZN D3008 >THR^D 47 82.61 17.30 37.97 84.33 17.39 36.60 83.47 17.34 37.28 2 0 20.21 -999 ? ZN ZN D3008 >ALA^D 48 79.51 15.77 36.41 78.37 15.76 37.33 78.94 15.76 36.87 2 0 20.01 -999 ? ZN ZN D3008 >VAL^D 49 78.14 15.76 32.88 80.02 15.18 31.91 79.08 15.47 32.39 3 0 17.82 -999 ? ZN ZN D3008 >LEU.D 50 74.43 15.89 29.84 72.40 16.00 29.11 73.42 15.94 29.48 3 0 16.01 -999 ? ZN ZN D3008 >ASP.D 51 76.65 11.85 28.08 75.54 12.95 26.56 76.10 12.40 27.32 2 0 18.34 -999 ? ZN ZN D3008 >GLU~D 52 79.15 10.96 33.56 80.09 12.34 34.90 79.62 11.65 34.23 2 0 21.86 -999 ? ZN ZN D3008 >PRO~D 53 75.80 6.02 34.17 74.88 8.05 34.12 75.34 7.03 34.15 3 0 25.85 -999 ? ZN ZN D3008 >GLU~D 54 71.01 8.23 37.91 70.66 7.59 39.91 70.83 7.91 38.91 2 0 28.29 -999 ? ZN ZN D3008 >HIS~D 55 71.56 13.68 33.73 69.92 13.18 32.53 70.74 13.43 33.13 3 0 20.05 -999 ? ZN ZN D3008 >GLY~D 56 76.34 12.27 37.40 75.54 12.41 37.59 75.94 12.34 37.49 1 0 22.66 -999 ? ZN ZN D3008 >LEU~D 57 73.08 14.73 39.63 73.95 16.67 39.25 73.51 15.70 39.44 3 0 21.25 -999 ? ZN ZN D3008 >THR~D 58 72.91 10.48 42.11 74.55 9.09 42.00 73.73 9.78 42.06 2 0 27.90 -999 ? ZN ZN D3008 >ASP~D 59 70.70 9.90 46.35 68.68 9.98 45.62 69.69 9.94 45.99 2 0 30.29 -999 ? ZN ZN D3008 >GLU~D 60 75.01 7.33 46.97 73.03 6.96 46.16 74.02 7.14 46.57 2 0 32.25 -999 ? ZN ZN D3008 >VAL~D 61 76.78 12.64 44.88 77.51 12.83 42.85 77.14 12.73 43.86 3 0 26.46 -999 ? ZN ZN D3008 >LEU~D 62 72.81 15.45 45.27 72.28 16.28 43.32 72.54 15.87 44.30 3 0 24.77 -999 ? ZN ZN D3008 >ASP~D 63 73.94 13.06 50.08 71.79 12.60 49.85 72.87 12.83 49.97 2 0 31.21 -999 ? ZN ZN D3008 >ARG~D 64 80.59 12.46 48.44 79.83 10.24 46.47 80.21 11.35 47.45 2 0 30.35 -999 ? ZN ZN D3008 >CYH.D 65 77.68 18.24 47.38 77.10 19.54 44.99 77.39 18.89 46.18 2 0 23.19 -999 ? ZN ZN D3008 >ASP.D 66 78.95 22.16 49.93 79.59 20.85 51.48 79.27 21.50 50.70 2 0 28.75 -999 ? ZN ZN D3008 >VAL^D 67 77.41 23.72 46.06 78.11 25.70 46.21 77.76 24.71 46.14 3 0 22.23 -999 ? ZN ZN D3008 >LEU^D 68 75.06 22.01 42.30 74.60 20.54 40.80 74.83 21.27 41.55 3 0 19.28 -999 ? ZN ZN D3008 >VAL^D 69 77.53 24.73 39.55 79.43 25.87 39.39 78.48 25.30 39.47 3 0 15.94 -999 ? ZN ZN D3008 >TRP^D 70 72.74 23.75 34.50 71.67 20.34 36.10 72.21 22.05 35.30 3 0 14.09 -999 ? ZN ZN D3008 >TRP^D 71 78.24 27.57 31.08 77.31 26.12 27.56 77.77 26.84 29.32 3 0 6.65 -999 ? ZN ZN D3008 >GLY.D 72 73.81 23.94 29.83 73.94 24.77 29.81 73.88 24.35 29.82 1 0 8.83 -999 ? ZN ZN D3008 >HIS.D 73 73.58 26.63 24.66 73.41 27.92 23.02 73.49 27.27 23.84 3 0 4.47 -999 ? ZN ZN D3008 >ILE.D 74 72.40 22.62 22.39 73.59 22.63 21.68 73.00 22.62 22.04 3 0 9.37 -999 ? ZN ZN D3008 >ALA~D 75 70.21 19.84 25.63 71.20 18.69 25.61 70.71 19.27 25.62 2 0 13.17 -999 ? ZN ZN D3008 >HIS~D 76 68.64 23.85 28.68 70.00 25.43 28.96 69.32 24.64 28.82 3 0 9.60 -999 ? ZN ZN D3008 >ASP~D 77 64.64 19.02 26.36 65.98 18.60 24.74 65.31 18.81 25.55 2 0 15.63 -999 ? ZN ZN D3008 >GLU~D 78 68.44 15.68 25.75 69.95 14.87 24.51 69.20 15.28 25.13 2 0 17.19 -999 ? ZN ZN D3008 >VAL~D 79 68.01 16.37 31.82 69.10 17.82 32.98 68.56 17.09 32.40 3 0 17.26 -999 ? ZN ZN D3008 >LYS~D 80 65.55 13.94 33.36 66.39 9.75 30.16 65.97 11.84 31.76 2 0 23.77 -999 ? ZN ZN D3008 >ASP~D 81 61.31 15.28 35.22 60.61 16.51 33.53 60.96 15.90 34.37 2 0 22.39 -999 ? ZN ZN D3008 >GLU~D 82 64.29 10.69 39.41 64.39 8.59 39.24 64.34 9.64 39.33 2 0 28.82 -999 ? ZN ZN D3008 >VAL~D 83 67.18 14.45 38.50 69.02 13.96 37.53 68.10 14.20 38.01 3 0 22.55 -999 ? ZN ZN D3008 >VAL~D 84 65.78 18.01 38.34 64.96 19.38 36.82 65.37 18.70 37.58 3 0 20.26 -999 ? ZN ZN D3008 >GLU~D 85 61.21 16.53 40.31 60.04 18.14 41.01 60.62 17.34 40.66 2 0 23.94 -999 ? ZN ZN A3001 >ARG~D 86 68.87 12.72 42.93 68.34 10.56 40.86 68.61 11.64 41.89 2 0 26.91 -999 ? ZN ZN D3008 >VAL~D 87 68.42 18.81 42.75 69.81 19.48 41.18 69.11 19.14 41.97 3 0 21.67 -999 ? ZN ZN D3008 >HIS~D 88 63.11 21.99 43.31 61.68 23.32 44.05 62.39 22.65 43.68 3 0 23.21 -999 ? ZN ZN A3001 >ARG~D 89 62.65 16.22 47.15 62.83 14.18 44.84 62.74 15.20 45.99 2 0 25.61 -999 ? ZN ZN A3001 >ARG~D 90 70.27 17.12 48.56 72.17 18.99 50.16 71.22 18.06 49.36 2 0 28.11 -999 ? ZN ZN D3008 >VAL~D 91 68.62 23.35 47.06 68.82 24.60 45.34 68.72 23.98 46.20 3 0 23.28 -999 ? ZN ZN D3008 >LEU~D 92 64.11 23.42 49.05 62.79 24.42 47.60 63.45 23.92 48.33 3 0 21.99 -999 ? ZN ZN A3001 >GLU~D 93 66.19 19.66 52.14 66.33 17.54 51.90 66.26 18.60 52.02 2 0 25.22 -999 ? ZN ZN A3001 >GLY.D 94 70.37 24.30 51.68 70.39 23.79 51.14 70.38 24.04 51.41 1 0 27.87 -999 ? ZN ZN A3001 >MET.D 95 72.60 23.10 48.87 73.38 20.21 46.01 72.99 21.65 47.44 2 0 23.75 -999 ? ZN ZN D3008 >GLY^D 96 74.01 26.10 46.98 73.86 25.32 46.63 73.94 25.71 46.81 1 0 22.56 -999 ? ZN ZN D3008 >LEU^D 97 72.11 26.26 42.86 71.33 25.39 40.96 71.72 25.83 41.91 3 0 18.05 -999 ? ZN ZN D3008 >ILE^D 98 77.09 28.76 40.95 77.30 29.80 41.63 77.20 29.28 41.29 3 0 16.49 -999 ? ZN ZN D3008 >VAL^D 99 73.87 28.93 37.38 71.74 28.56 37.08 72.80 28.75 37.23 3 0 12.67 -999 ? ZN ZN D3008 >LEU^D 100 77.40 29.30 34.40 79.06 29.39 35.83 78.23 29.35 35.12 3 0 10.69 -999 ? ZN ZN D3008 >HIS.D 101 76.43 31.88 29.02 76.33 32.73 27.10 76.38 32.30 28.06 3 0 -3.42 -999 ? ZN ZN D3008s >SER~D 102 72.81 29.56 29.16 74.49 28.28 27.93 73.65 28.92 28.54 2 0 4.19 -999 ? ZN ZN D3008 >GLY~D 103 71.96 27.72 32.41 71.69 28.42 32.06 71.83 28.07 32.23 1 0 8.77 -999 ? ZN ZN D3008 >HIS~D 104 69.15 32.02 30.55 68.73 32.05 28.50 68.94 32.04 29.53 3 0 7.73 -999 ? ZN ZN D3008 >PHE~D 105 66.35 29.10 28.25 64.79 31.03 26.96 65.57 30.06 27.61 3 0 10.02 -999 ? ZN ZN D3008 >SER~D 106 67.98 24.98 32.52 69.02 25.66 34.67 68.50 25.32 33.60 2 0 12.72 -999 ? ZN ZN D3008 >LYS~D 107 65.00 23.10 33.88 63.40 17.57 31.40 64.20 20.34 32.64 2 0 19.13 -999 ? ZN ZN D3008 >ILE~D 108 67.70 23.03 38.06 67.84 23.13 38.83 67.77 23.08 38.44 3 0 17.35 -999 ? ZN ZN D3008 >PHE~D 109 67.93 29.61 36.78 68.16 32.24 37.52 68.04 30.92 37.15 3 0 14.07 -999 ? ZN ZN D3008 >LYS~D 110 63.40 27.84 35.60 61.71 26.65 30.13 62.55 27.25 32.86 2 0 15.12 -999 ? ZN ZN D3008 >LYS~D 111 61.81 25.64 38.29 59.06 21.60 40.47 60.43 23.62 39.38 2 0 22.70 -999 ? ZN ZN A3001 >LEU~D 112 64.80 27.67 41.50 65.88 26.22 42.68 65.34 26.95 42.09 3 0 20.15 -999 ? ZN ZN D3008 >MET~D 113 62.47 30.97 39.51 65.21 32.78 39.73 63.84 31.88 39.62 2 0 17.82 -999 ? ZN ZN D3008 >GLY~D 114 58.85 30.26 38.51 59.35 30.67 38.04 59.10 30.47 38.27 1 0 21.20 -999 ? ZN ZN D3008 >THR.D 115 59.20 32.39 35.32 60.25 33.97 36.35 59.73 33.18 35.83 2 0 18.93 -999 ? ZN ZN D3008 >THR.D 116 60.28 31.67 31.77 59.22 33.05 30.40 59.75 32.36 31.09 2 0 16.94 -999 ? ZN ZN D3008 >CYH.D 117 63.81 33.03 32.27 64.23 31.68 34.64 64.02 32.36 33.46 2 0 14.58 -999 ? ZN ZN D3008 >ASN.D 118 62.51 34.20 27.79 62.92 33.82 25.72 62.71 34.01 26.75 2 0 12.56 -999 ? ZN ZN D3008 >LEU.D 119 67.04 37.12 28.23 68.60 35.58 27.87 67.82 36.35 28.05 3 0 9.47 -999 ? ZN ZN D3008 >LYS^D 120 66.91 39.03 24.39 63.76 44.58 23.67 65.34 41.81 24.03 2 0 17.63 -999 ? ZN ZN D3008 >TRP^D 121 68.34 35.11 22.48 70.34 33.66 19.43 69.34 34.38 20.95 3 0 7.80 -999 ? ZN ZN D3008 >ARG^D 122 73.63 41.40 18.11 72.77 43.42 20.32 73.20 42.41 19.21 2 0 13.30 -999 ? ZN ZN D3008 >GLU^D 123 77.26 34.26 18.90 77.27 32.26 18.18 77.27 33.26 18.54 2 0 7.24 -999 ? ZN ZN D3008 >ALA^D 124 78.10 39.12 17.64 77.25 40.39 17.40 77.67 39.76 17.52 2 0 12.10 -999 ? ZN ZN D3008 >ASP^D 125 82.51 38.72 18.26 82.29 36.91 17.18 82.40 37.81 17.72 2 0 12.02 -999 ? ZN ZN D3008 >GLU^D 126 78.38 42.43 22.03 76.43 42.91 21.42 77.40 42.67 21.73 2 0 12.29 -999 ? ZN ZN D3008 >LYS^D 127 82.30 43.75 24.27 85.54 48.71 24.12 83.92 46.23 24.19 2 0 20.34 -999 ? ZN ZN D3008 >GLU^D 128 79.33 41.83 29.37 78.75 39.89 29.94 79.04 40.86 29.66 2 0 10.57 -999 ? ZN ZN D3008 >ARG^D 129 83.04 48.88 31.47 83.56 49.57 28.55 83.30 49.22 30.01 2 0 20.46 -999 ? ZN ZN D3008 >LEU^D 130 80.40 42.44 34.49 80.32 40.61 33.35 80.36 41.53 33.92 3 0 14.55 -999 ? ZN ZN D3008 >TRP^D 131 79.25 48.74 33.80 82.06 51.26 34.86 80.65 50.00 34.33 3 0 19.17 -999 ? ZN ZN B3002 >VAL^D 132 79.75 45.94 40.25 81.29 45.20 41.64 80.52 45.57 40.94 3 0 22.07 -999 ? ZN ZN D3008 >VAL.D 133 76.67 47.34 41.96 75.16 47.20 40.36 75.92 47.27 41.16 3 0 21.09 -999 ? ZN ZN B3002 >ALA.D 134 77.04 45.60 45.38 76.32 44.32 45.49 76.68 44.96 45.44 2 0 24.31 -999 ? ZN ZN D3008 >PRO.D 135 79.76 48.81 46.51 79.90 46.62 46.07 79.83 47.71 46.29 3 0 23.25 -999 ? ZN ZN B3002 >GLY.D 136 80.66 45.11 49.68 80.28 44.72 49.08 80.47 44.92 49.38 1 0 27.25 -999 ? ZN ZN B3002 >HIS~D 137 77.40 40.35 47.73 76.34 38.57 48.05 76.87 39.46 47.89 3 0 24.34 -999 ? ZN ZN D3008 >PRO~D 138 79.98 38.19 51.12 80.84 39.17 49.35 80.41 38.68 50.23 3 0 26.79 -999 ? ZN ZN D3008 >ILE~D 139 79.61 37.52 44.91 78.58 36.71 44.20 79.09 37.11 44.56 3 0 20.76 -999 ? ZN ZN D3008 >VAL~D 140 82.98 40.60 44.55 81.44 42.09 44.11 82.21 41.35 44.33 3 0 22.89 -999 ? ZN ZN D3008 >GLU~D 141 87.40 39.13 48.76 88.04 40.98 49.50 87.72 40.05 49.13 2 0 29.30 -999 ? ZN ZN D3008 >GLY.D 142 89.01 41.12 45.03 88.30 41.34 44.77 88.66 41.23 44.90 1 0 26.24 -999 ? ZN ZN D3008 >ILE.D 143 85.67 41.78 41.68 85.90 40.93 40.50 85.78 41.36 41.09 3 0 21.74 -999 ? ZN ZN D3008 >GLY.D 144 87.59 45.89 40.66 86.87 45.43 40.64 87.23 45.66 40.65 1 0 24.75 -999 ? ZN ZN D3008 >PRO.D 145 86.47 49.62 38.71 85.44 47.97 39.79 85.96 48.79 39.25 3 0 22.89 -999 ? ZN ZN B3002 >TYR^D 146 84.80 47.83 34.86 86.82 49.26 33.58 85.81 48.55 34.22 3 0 22.29 -999 ? ZN ZN D3008 >ILE^D 147 84.58 41.68 35.01 84.68 40.38 35.51 84.63 41.03 35.26 3 0 17.02 -999 ? ZN ZN D3008 >GLU^D 148 86.29 45.19 29.09 87.16 47.06 28.74 86.73 46.13 28.92 2 0 20.20 -999 ? ZN ZN D3008 >LEU^D 149 84.15 39.78 28.57 84.03 38.42 30.25 84.09 39.10 29.41 3 0 12.66 -999 ? ZN ZN D3008 >GLU^D 150 88.87 42.29 25.28 88.61 44.42 25.26 88.74 43.35 25.27 2 0 18.82 -999 ? ZN ZN D3008 >GLN^D 151 85.47 39.13 21.23 86.22 38.01 19.59 85.85 38.57 20.41 2 0 14.05 -999 ? ZN ZN D3008 >GLU^D 152 81.11 37.05 26.99 80.04 35.20 27.08 80.57 36.12 27.04 2 0 6.60 -999 ? ZN ZN D3008 >GLU^D 153 75.17 35.43 23.21 74.57 33.48 22.99 74.87 34.46 23.10 2 0 -3.11 -999 ? ZN ZN D3008s >MET^D 154 74.87 39.62 24.49 71.83 41.46 24.42 73.35 40.54 24.46 2 0 10.78 -999 ? ZN ZN D3008 >TYR^D 155 72.25 36.55 27.89 72.84 33.85 27.76 72.54 35.20 27.82 3 0 -5.53 -999 ? ZN ZN D3008s >GLY^D 156 69.62 41.90 27.25 69.23 41.20 27.46 69.43 41.55 27.35 1 0 12.23 -999 ? ZN ZN D3008 >GLU.D 157 67.81 43.99 31.46 67.15 42.62 32.96 67.48 43.31 32.21 2 0 16.04 -999 ? ZN ZN D3008 >PHE.D 158 61.92 41.85 31.40 60.76 40.77 33.66 61.34 41.31 32.53 3 0 18.70 -999 ? ZN ZN D3008 >PHE.D 159 67.14 37.80 32.90 68.38 35.44 33.82 67.76 36.62 33.36 3 0 12.39 -999 ? ZN ZN D3008 >ASP.D 160 61.23 36.54 31.88 59.28 36.08 32.75 60.25 36.31 32.31 2 0 18.33 -999 ? ZN ZN D3008 >ILE.D 161 64.76 36.44 36.71 66.02 36.82 36.60 65.39 36.63 36.65 3 0 16.13 -999 ? ZN ZN D3008 >PRO.D 162 62.03 34.94 40.24 62.09 36.90 39.18 62.06 35.92 39.71 3 0 20.24 -999 ? ZN ZN D3008 >GLU.D 163 63.63 42.67 42.38 62.51 43.96 43.62 63.07 43.31 43.00 2 0 25.84 -999 ? ZN ZN D3008 >PRO.D 164 67.83 39.91 40.63 66.28 39.52 42.32 67.06 39.71 41.47 3 0 20.20 -999 ? ZN ZN D3008 >ASP.D 165 68.03 38.16 47.24 66.55 36.72 47.75 67.29 37.44 47.49 2 0 24.91 -999 ? ZN ZN D3008 >GLU^D 166 71.39 41.44 47.71 73.03 41.81 49.03 72.21 41.63 48.37 2 0 26.31 -999 ? ZN ZN D3008 >THR^D 167 71.90 42.46 42.05 70.92 43.33 40.38 71.41 42.90 41.21 2 0 19.99 -999 ? ZN ZN D3008 >ILE^D 168 76.26 40.76 42.36 76.51 40.80 43.68 76.39 40.78 43.02 3 0 20.39 -999 ? ZN ZN D3008 >PHE^D 169 78.62 41.49 38.33 81.01 40.61 39.47 79.82 41.05 38.90 3 0 17.61 -999 ? ZN ZN D3008 >ILE^D 170 74.20 46.25 35.96 73.01 47.12 36.11 73.60 46.68 36.03 3 0 19.03 -999 ? ZN ZN D3008 >SER^D 171 76.42 44.48 32.31 76.99 42.05 32.22 76.70 43.26 32.26 2 0 13.11 -999 ? ZN ZN D3008 >TRP^D 172 77.30 50.43 28.64 79.75 49.64 25.69 78.52 50.04 27.16 3 0 19.22 -999 ? ZN ZN D3008 >PHE^D 173 75.95 43.51 26.36 75.98 41.25 27.90 75.96 42.38 27.13 3 0 11.37 -999 ? ZN ZN D3008 >GLU.D 174 80.29 47.47 21.12 81.89 46.43 20.12 81.09 46.95 20.62 2 0 17.33 -999 ? ZN ZN D3008 >GLY.D 175 75.36 46.91 20.98 75.36 47.22 21.67 75.36 47.06 21.33 1 0 16.20 -999 ? ZN ZN D3008 >GLY.D 176 73.24 49.05 23.27 73.32 48.33 23.63 73.28 48.69 23.45 1 0 18.01 -999 ? ZN ZN D3008 >GLU.D 177 70.57 45.10 24.13 71.76 45.08 22.33 71.16 45.09 23.23 2 0 14.53 -999 ? ZN ZN D3008 >VAL^D 178 72.09 46.10 29.54 71.18 47.86 30.42 71.63 46.98 29.98 3 0 16.89 -999 ? ZN ZN D3008 >PHE^D 179 71.50 40.49 31.19 70.17 38.15 31.50 70.83 39.32 31.35 3 0 11.14 -999 ? ZN ZN D3008 >ARG^D 180 67.95 43.24 36.91 65.32 41.83 36.34 66.64 42.54 36.62 2 0 18.37 -999 ? ZN ZN D3008 >SER^D 181 74.34 39.70 35.05 75.11 40.86 33.09 74.73 40.28 34.07 2 0 12.55 -999 ? ZN ZN D3008 >GLY^D 182 74.97 38.60 38.63 74.25 39.16 38.56 74.61 38.88 38.60 1 0 15.47 -999 ? ZN ZN D3008 >CYH^D 183 71.81 38.02 40.75 70.39 38.83 38.49 71.10 38.42 39.62 2 0 16.17 -999 ? ZN ZN D3008 >THR^D 184 71.42 36.26 44.08 72.52 37.31 45.52 71.97 36.78 44.80 2 0 21.53 -999 ? ZN ZN D3008 >PHE^D 185 67.55 34.44 42.79 67.58 35.62 40.29 67.57 35.03 41.54 3 0 18.57 -999 ? ZN ZN D3008 >THR^D 186 67.33 32.35 48.28 68.03 32.86 50.28 67.68 32.60 49.28 2 0 26.29 -999 ? ZN ZN D3008 >ARG^D 187 63.28 30.25 45.37 63.42 33.23 44.41 63.35 31.74 44.89 2 0 22.75 -999 ? ZN ZN D3008 >GLY.D 188 64.30 27.51 51.08 64.84 28.13 50.85 64.57 27.82 50.97 1 0 22.02 -999 ? ZN ZN A3001 >LYS.D 189 67.65 27.31 52.83 67.48 23.24 57.50 67.56 25.27 55.17 2 0 24.83 -999 ? ZN ZN A3001 >GLY^D 190 69.57 27.28 49.58 69.19 27.98 49.76 69.38 27.63 49.67 1 0 25.48 -999 ? ZN ZN D3008 >LYS^D 191 71.49 30.22 48.14 73.61 30.58 53.41 72.55 30.40 50.78 2 0 28.43 -999 ? ZN ZN D3008 >ILE^D 192 70.16 30.48 43.70 69.13 29.87 43.16 69.65 30.17 43.43 3 0 19.24 -999 ? ZN ZN D3008 >PHE^D 193 75.95 34.25 41.94 77.33 36.33 40.76 76.64 35.29 41.35 3 0 16.87 -999 ? ZN ZN D3008 >TYR^D 194 71.97 33.88 36.45 72.46 33.89 33.74 72.21 33.89 35.10 3 0 10.82 -999 ? ZN ZN D3008 >PHE^D 195 78.67 35.13 37.02 80.90 36.68 36.63 79.79 35.91 36.83 3 0 13.49 -999 ? ZN ZN D3008 >ARG.D 196 75.03 38.15 30.39 76.88 37.06 28.24 75.96 37.61 29.31 2 0 6.87 -999 ? ZN ZN D3008 >PRO.D 197 80.15 36.87 32.84 78.78 35.33 31.83 79.47 36.10 32.33 3 0 9.76 -999 ? ZN ZN D3008 >GLY.D 198 80.23 31.92 29.68 79.91 32.33 29.10 80.07 32.12 29.39 1 0 6.89 -999 ? ZN ZN D3008 >HIS.D 199 78.36 32.03 23.76 77.09 31.25 22.28 77.72 31.64 23.02 3 0 -3.27 -999 ? ZN ZN D3008s >GLU.D 200 79.47 27.29 22.96 77.55 28.14 23.10 78.51 27.72 23.03 2 0 4.35 -999 ? ZN ZN D3008 >THR.D 201 82.76 30.01 21.58 81.06 30.70 20.42 81.91 30.36 21.00 2 0 7.49 -999 ? ZN ZN D3008 >TYR.D 202 83.17 34.33 23.05 81.49 35.26 21.05 82.33 34.79 22.05 3 0 8.53 -999 ? ZN ZN D3008 >PRO~D 203 88.89 33.22 25.09 87.15 32.02 25.79 88.02 32.62 25.44 3 0 12.91 -999 ? ZN ZN D3008 >THR~D 204 85.44 33.38 29.11 83.49 34.32 29.07 84.46 33.85 29.09 2 0 9.73 -999 ? ZN ZN D3008 >TYR~D 205 84.07 29.59 32.04 81.31 29.99 32.24 82.69 29.79 32.14 3 0 10.43 -999 ? ZN ZN D3008 >HIS~D 206 90.57 29.79 29.33 90.56 27.78 28.72 90.56 28.78 29.03 3 0 16.07 -999 ? ZN ZN D3008 >HIS~D 207 88.50 37.32 32.29 88.87 39.31 32.85 88.68 38.31 32.57 3 0 17.00 -999 ? ZN ZN D3008 >PRO~D 208 92.41 36.84 35.00 90.74 35.40 35.23 91.58 36.12 35.12 3 0 19.85 -999 ? ZN ZN D3008 >ASP~D 209 87.82 39.10 36.85 89.35 40.51 37.38 88.59 39.81 37.11 2 0 20.96 -999 ? ZN ZN D3008 >VAL~D 210 85.34 35.48 35.98 84.40 35.16 34.07 84.87 35.32 35.02 3 0 14.50 -999 ? ZN ZN D3008 >LEU~D 211 88.16 31.78 37.41 88.50 30.31 35.86 88.33 31.04 36.64 3 0 17.53 -999 ? ZN ZN D3008 >LYS~D 212 87.43 34.53 40.92 89.64 37.33 45.18 88.54 35.93 43.05 2 0 25.53 -999 ? ZN ZN D3008 >VAL~D 213 83.73 35.49 41.02 82.42 36.92 39.95 83.07 36.21 40.48 3 0 18.04 -999 ? ZN ZN D3008 >ILE~D 214 83.01 30.95 39.49 82.60 30.16 38.43 82.81 30.55 38.96 3 0 15.88 -999 ? ZN ZN D3008 >ALA~D 215 85.06 30.87 43.56 86.54 31.07 43.57 85.80 30.97 43.57 2 0 21.73 -999 ? ZN ZN D3008 >ASN~D 216 83.74 35.17 45.39 85.65 36.11 45.39 84.69 35.64 45.39 2 0 23.40 -999 ? ZN ZN D3008 >ALA~D 217 80.11 32.64 44.88 79.51 32.75 43.50 79.81 32.70 44.19 2 0 19.02 -999 ? ZN ZN D3008 >VAL~D 218 80.86 29.00 45.81 81.80 27.28 44.87 81.33 28.14 45.34 3 0 21.43 -999 ? ZN ZN D3008 >ARG~D 219 84.92 32.24 51.13 86.56 32.71 48.49 85.74 32.48 49.81 2 0 26.10 -999 ? ZN ZN D3008 >TRP~D 220 77.00 35.31 49.89 74.32 33.85 47.44 75.66 34.58 48.66 3 0 23.86 -999 ? ZN ZN D3008 >ALA~D 221 76.59 29.80 48.66 76.38 29.46 47.18 76.48 29.63 47.92 2 0 22.25 -999 ? ZN ZN D3008 >ALA.D 222 77.90 27.15 51.11 79.20 27.25 51.88 78.55 27.20 51.50 2 0 27.43 -999 ? ZN ZN D3008 >PRO.D 223 75.60 23.65 52.08 75.65 25.78 52.73 75.62 24.72 52.41 3 0 28.13 -999 ? ZN ZN D3008 >VAL.D 224 74.21 26.72 56.66 73.99 28.89 57.07 74.10 27.81 56.86 3 0 30.28 -999 ? ZN ZN C3003 >ASN.D 225 70.76 25.65 59.22 71.29 26.88 60.86 71.03 26.26 60.04 2 0 27.80 -999 ? ZN ZN C3003 >ARG.D 226 73.28 20.60 52.88 74.24 19.02 50.50 73.76 19.81 51.69 2 0 28.25 -999 ? ZN ZN D3008 >GLY.D 227 68.75 19.63 56.21 68.46 20.33 55.90 68.60 19.98 56.06 1 0 26.65 -999 ? ZN ZN A3001 >GLU.D 228 63.02 17.57 57.39 62.63 16.12 58.92 62.83 16.85 58.16 2 0 22.28 -999 ? ZN ZN A3001 >ILE.D 229 62.42 23.06 56.53 62.47 24.43 56.16 62.45 23.75 56.35 3 0 19.73 -999 ? ZN ZN A3001 >VAL.D 230 60.05 20.86 59.78 60.05 20.11 61.83 60.05 20.49 60.81 3 0 18.72 -999 ? ZN ZN A3001 >PHE.D 231 57.40 22.40 56.41 59.23 23.85 54.94 58.31 23.13 55.67 3 0 15.71 -999 ? ZN ZN A3001 >GLY^D 232 53.01 20.31 59.31 53.21 20.94 59.74 53.11 20.63 59.53 1 0 12.12 -999 ? ZN ZN A3001 >ASN^D 233 49.48 19.02 62.22 47.84 19.42 63.52 48.66 19.22 62.87 2 0 11.25 -999 ? ZN ZN A3001 >VAL.D 234 51.95 21.49 65.47 53.22 22.97 64.52 52.59 22.23 64.99 3 0 13.90 -999 ? ZN ZN A3001 >LYS.D 235 50.74 21.74 69.04 48.80 17.50 68.78 49.77 19.62 68.91 2 0 16.58 -999 ? ZN ZN A3001 >PRO.D 236 48.25 24.42 71.41 50.25 24.53 70.31 49.25 24.47 70.86 3 0 16.45 -999 ? ZN ZN A3001 >LEU.D 237 54.31 27.53 71.90 55.84 26.71 70.64 55.07 27.12 71.27 3 0 19.78 -999 ? ZN ZN A3001 >GLU.D 238 51.73 30.85 73.62 53.29 31.16 75.00 52.51 31.01 74.31 2 0 21.21 -999 ? ZN ZN C3003 >PRO.D 239 48.09 28.26 78.06 47.84 28.20 75.84 47.96 28.23 76.95 3 0 21.92 -999 ? ZN ZN A3001 >ILE.D 240 44.20 27.89 72.21 44.32 27.69 70.86 44.26 27.79 71.54 3 0 15.94 -999 ? ZN ZN A3001 >LYS.D 241 41.06 29.87 75.09 42.79 29.13 78.11 41.92 29.50 76.60 2 0 22.57 -999 ? ZN ZN A3001 >ALA.D 242 37.59 28.29 74.63 36.93 27.37 75.67 37.26 27.83 75.15 2 0 20.81 -999 ? ZN ZN A3001 >THR.E 3 37.28 -13.49 127.94 36.47 -15.55 127.73 36.87 -14.52 127.84 2 0 35.85 -999 ? ZN ZN E3005 >PRO.E 4 34.29 -11.99 125.13 36.47 -11.94 125.30 35.38 -11.97 125.21 3 0 31.83 -999 ? ZN ZN E3005 >ILE.E 5 39.94 -9.15 122.32 41.11 -9.36 121.59 40.53 -9.25 121.96 3 0 26.83 -999 ? ZN ZN E3005 >ARG^E 6 37.55 -5.79 128.25 39.82 -5.66 130.32 38.69 -5.73 129.29 2 0 31.09 -999 ? ZN ZN E3005 >VAL^E 7 38.49 -3.05 121.65 38.15 -3.49 119.52 38.32 -3.27 120.59 3 0 22.07 -999 ? ZN ZN E3005 >VAL^E 8 37.78 0.70 121.64 37.82 2.07 123.28 37.80 1.38 122.46 3 0 21.27 -999 ? ZN ZN E3005 >VAL^E 9 37.43 2.24 118.15 36.63 1.30 116.41 37.03 1.77 117.28 3 0 16.99 -999 ? ZN ZN E3005 >TRP^E 10 39.28 8.17 120.72 40.48 10.83 118.10 39.88 9.50 119.41 3 0 15.81 -999 ? ZN ZN E3005 >ASN^E 11 36.26 7.77 114.84 35.89 8.61 112.90 36.07 8.19 113.87 2 0 11.55 -999 ? ZN ZN E3005 >GLU.E 12 38.85 14.00 113.84 40.31 14.39 112.34 39.58 14.19 113.09 2 0 9.65 -999 ? ZN ZN E3005 >PHE.E 13 32.08 11.35 114.77 29.37 10.84 114.46 30.73 11.10 114.62 3 0 16.22 -999 ? ZN ZN E3005 >ARG~E 14 35.34 17.91 114.24 37.20 19.24 116.30 36.27 18.57 115.27 2 0 16.22 -999 ? ZN ZN E3005 >HIS~E 15 36.42 14.27 107.31 38.21 15.10 106.62 37.31 14.69 106.96 3 0 7.64 -999 ? ZN ZN E3005 >GLU~E 16 32.04 10.39 109.21 33.60 10.25 110.62 32.82 10.32 109.91 2 0 11.46 -999 ? ZN ZN E3005 >LYS~E 17 29.36 15.86 110.32 31.20 14.80 116.12 30.28 15.33 113.22 2 0 17.45 -999 ? ZN ZN E3005 >LYS~E 18 31.00 18.44 107.93 35.63 21.16 108.59 33.31 19.80 108.26 2 0 13.76 -999 ? ZN ZN E3005 >ASP~E 19 31.96 16.26 103.93 31.95 16.11 101.71 31.95 16.18 102.82 2 0 12.52 -999 ? ZN ZN E3005 >GLU~E 20 25.64 17.42 103.79 25.12 16.70 105.74 25.38 17.06 104.76 2 0 18.93 -999 ? ZN ZN E3005 >GLN~E 21 30.58 12.61 98.85 32.25 11.44 99.46 31.42 12.02 99.15 2 0 11.58 -999 ? ZN ZN E3005 >VAL~E 22 30.99 11.54 103.70 32.90 12.00 104.69 31.95 11.77 104.20 3 0 11.03 -999 ? ZN ZN E3005 >ARG~E 23 25.51 14.01 107.79 23.57 14.30 110.16 24.54 14.15 108.98 2 0 20.67 -999 ? ZN ZN E3005 >ALA~E 24 26.03 9.58 103.23 25.81 10.07 101.79 25.92 9.83 102.51 2 0 17.22 -999 ? ZN ZN E3005 >ILE~E 25 30.09 6.86 102.85 31.13 6.69 101.93 30.61 6.78 102.39 3 0 12.91 -999 ? ZN ZN E3005 >TYR~E 26 31.62 6.25 106.77 33.47 4.65 105.41 32.54 5.45 106.09 3 0 11.70 -999 ? ZN ZN E3005 >PRO.E 27 24.98 6.45 107.94 26.49 8.00 108.36 25.73 7.23 108.15 3 0 17.97 -999 ? ZN ZN E3005 >GLU.E 28 24.77 6.27 112.76 23.97 4.52 113.57 24.37 5.40 113.17 2 0 22.06 -999 ? ZN ZN E3005 >GLY~E 29 30.66 7.65 111.74 30.28 7.00 111.45 30.47 7.33 111.59 1 0 14.79 -999 ? ZN ZN E3005 >MET~E 30 33.39 5.26 110.58 36.22 6.89 107.96 34.80 6.08 109.27 2 0 8.58 -999 ? ZN ZN E3005 >HIS~E 31 32.88 6.02 115.67 31.51 7.60 115.85 32.20 6.81 115.76 3 0 16.37 -999 ? ZN ZN E3005 >THR~E 32 30.27 2.76 114.24 28.43 3.72 114.74 29.35 3.24 114.49 2 0 19.28 -999 ? ZN ZN E3005 >VAL~E 33 30.81 0.70 111.11 30.71 1.11 108.98 30.76 0.90 110.04 3 0 16.61 -999 ? ZN ZN E3005 >ILE~E 34 35.47 0.07 112.50 36.80 0.39 112.19 36.14 0.23 112.34 3 0 14.88 -999 ? ZN ZN E3005 >ALA~E 35 32.91 -1.37 115.88 32.55 -0.30 116.92 32.73 -0.84 116.40 2 0 19.79 -999 ? ZN ZN E3005 >SER~E 36 29.72 -3.05 114.57 27.62 -3.29 113.39 28.67 -3.17 113.98 2 0 22.63 -999 ? ZN ZN E3005 >TYR~E 37 33.42 -6.28 110.72 34.57 -8.50 109.51 33.99 -7.39 110.12 3 0 20.88 -999 ? ZN ZN E3005 >LEU~E 38 35.02 -5.25 116.12 36.97 -4.71 115.30 35.99 -4.98 115.71 3 0 20.62 -999 ? ZN ZN E3005 >ALA~E 39 31.08 -6.89 117.73 29.97 -5.94 118.08 30.53 -6.42 117.90 2 0 25.23 -999 ? ZN ZN E3005 >GLU~E 40 27.84 -7.87 113.97 26.72 -7.43 112.23 27.28 -7.65 113.10 2 0 25.51 -999 ? ZN ZN E3005 >ALA~E 41 33.03 -10.93 115.01 34.26 -10.24 114.44 33.64 -10.58 114.73 2 0 24.77 -999 ? ZN ZN E3005 >GLY.E 42 32.88 -11.69 118.75 33.17 -11.00 118.58 33.02 -11.34 118.66 1 0 28.48 -999 ? ZN ZN E3005 >PHE.E 43 36.80 -8.39 118.57 38.81 -9.48 117.03 37.81 -8.94 117.80 3 0 24.39 -999 ? ZN ZN E3005 >ASP^E 44 34.15 -6.84 124.55 33.14 -5.55 125.97 33.65 -6.19 125.26 2 0 28.95 -999 ? ZN ZN E3005 >ALA^E 45 33.66 -3.39 121.09 33.39 -3.50 119.65 33.53 -3.45 120.37 2 0 23.08 -999 ? ZN ZN E3005 >ALA^E 46 33.06 0.23 122.13 33.44 0.49 123.50 33.25 0.36 122.81 2 0 23.93 -999 ? ZN ZN E3005 >THR^E 47 33.75 3.57 120.52 31.94 3.62 119.23 32.85 3.59 119.88 2 0 20.04 -999 ? ZN ZN E3005 >ALA^E 48 35.19 6.95 121.51 36.41 6.74 122.34 35.80 6.84 121.93 2 0 19.88 -999 ? ZN ZN E3005 >VAL^E 49 35.52 10.24 119.68 33.37 10.39 119.12 34.45 10.31 119.40 3 0 17.64 -999 ? ZN ZN E3005 >LEU.E 50 37.84 14.23 118.59 39.34 15.78 118.53 38.59 15.01 118.56 3 0 15.93 -999 ? ZN ZN E3005 >ASP.E 51 33.53 16.34 119.94 34.64 17.48 118.44 34.08 16.91 119.19 2 0 18.12 -999 ? ZN ZN E3005 >GLU~E 52 32.68 11.30 123.57 32.93 9.21 123.05 32.81 10.25 123.31 2 0 21.61 -999 ? ZN ZN E3005 >PRO~E 53 33.24 14.75 128.55 34.91 14.43 127.09 34.08 14.59 127.82 3 0 25.81 -999 ? ZN ZN E3005 >GLU~E 54 39.39 13.30 130.04 39.61 12.23 131.85 39.50 12.76 130.94 2 0 28.18 -999 ? ZN ZN E3005 >HIS~E 55 40.20 13.67 123.25 40.99 15.60 123.32 40.59 14.64 123.28 3 0 19.95 -999 ? ZN ZN E3005 >GLY~E 56 36.46 9.28 125.49 37.23 9.46 125.60 36.85 9.37 125.55 1 0 22.54 -999 ? ZN ZN E3005 >LEU~E 57 40.97 8.13 125.70 40.92 7.07 123.83 40.94 7.60 124.77 3 0 21.14 -999 ? ZN ZN E3005 >THR~E 58 39.64 8.25 130.45 37.51 8.15 131.00 38.58 8.20 130.72 2 0 27.71 -999 ? ZN ZN E3005 >ASP~E 59 42.35 6.54 134.13 44.09 7.76 134.12 43.22 7.15 134.13 2 0 30.35 -999 ? ZN ZN E3005 >GLU~E 60 36.25 3.47 133.66 34.35 4.43 133.63 35.30 3.95 133.65 2 0 31.51 -999 ? ZN ZN E3005 >VAL~E 61 38.20 3.37 129.68 37.13 4.40 128.05 37.67 3.89 128.86 3 0 26.32 -999 ? ZN ZN E3005 >LEU~E 62 42.96 3.77 128.79 43.33 5.05 127.10 43.15 4.41 127.95 3 0 24.78 -999 ? ZN ZN E3005 >ASP~E 63 42.36 0.62 133.26 43.78 2.24 133.94 43.07 1.43 133.60 2 0 31.14 -999 ? ZN ZN E3005 >ARG~E 64 36.17 -1.20 131.99 34.73 1.43 131.15 35.45 0.12 131.57 2 0 29.83 -999 ? ZN ZN E3005 >CYH.E 65 40.88 -1.48 126.75 41.31 -0.06 124.44 41.10 -0.77 125.60 2 0 23.12 -999 ? ZN ZN E3005 >ASP.E 66 42.45 -5.76 125.06 41.68 -6.68 126.83 42.06 -6.22 125.95 2 0 28.65 -999 ? ZN ZN E3005 >VAL^E 67 43.28 -2.81 121.83 43.70 -4.18 120.23 43.49 -3.49 121.03 3 0 22.08 -999 ? ZN ZN E3005 >LEU^E 68 43.46 1.89 121.34 42.70 3.85 121.72 43.08 2.87 121.53 3 0 19.18 -999 ? ZN ZN E3005 >VAL^E 69 41.94 1.49 116.96 40.79 0.17 115.65 41.36 0.83 116.30 3 0 15.77 -999 ? ZN ZN E3005 >TRP^E 70 44.19 8.05 115.82 43.91 8.96 119.61 44.05 8.51 117.72 3 0 13.99 -999 ? ZN ZN E3005 >TRP^E 71 40.25 6.22 109.58 39.51 9.96 108.69 39.88 8.09 109.14 3 0 6.48 -999 ? ZN ZN E3005 >GLY.E 72 42.06 10.93 112.61 42.34 10.52 111.91 42.20 10.73 112.26 1 0 8.75 -999 ? ZN ZN E3005 >HIS.E 73 42.18 13.72 107.47 42.56 14.51 105.55 42.37 14.11 106.51 3 0 4.52 -999 ? ZN ZN E3005 >ILE.E 74 40.74 17.75 109.33 39.55 17.63 108.61 40.14 17.69 108.97 3 0 9.24 -999 ? ZN ZN E3005 >ALA~E 75 42.06 17.63 113.95 40.66 17.62 114.56 41.36 17.62 114.26 2 0 13.02 -999 ? ZN ZN E3005 >HIS~E 76 46.05 14.35 113.18 45.66 12.78 111.84 45.86 13.57 112.51 3 0 9.61 -999 ? ZN ZN E3005 >ASP~E 77 46.57 20.17 116.38 44.77 21.14 115.60 45.67 20.65 115.99 2 0 15.94 -999 ? ZN ZN E3005 >GLU~E 78 41.58 20.28 117.67 39.59 20.61 117.08 40.59 20.45 117.37 2 0 16.95 -999 ? ZN ZN E3005 >VAL~E 79 43.94 15.66 120.93 43.90 13.60 120.32 43.92 14.63 120.62 3 0 17.25 -999 ? ZN ZN E3005 >LYS~E 80 45.26 16.84 124.28 41.15 20.18 124.97 43.20 18.51 124.63 2 0 23.26 -999 ? ZN ZN E3005 >ASP~E 81 49.93 17.03 125.50 50.60 18.01 123.67 50.26 17.52 124.59 2 0 22.51 -999 ? ZN ZN E3005 >GLU~E 82 46.65 14.57 130.90 45.39 15.48 132.33 46.02 15.02 131.62 2 0 28.97 -999 ? ZN ZN E3005 >VAL~E 83 45.51 11.98 126.68 43.36 11.98 126.12 44.43 11.98 126.40 3 0 22.59 -999 ? ZN ZN E3005 >VAL~E 84 48.31 11.19 124.19 49.11 12.12 122.35 48.71 11.66 123.27 3 0 20.24 -999 ? ZN ZN E3005 >GLU~E 85 52.08 12.69 127.52 52.34 14.52 128.58 52.21 13.61 128.05 2 0 25.90 -999 ? ZN ZN H3004 >ARG~E 86 44.41 8.39 130.16 43.32 11.19 130.73 43.87 9.79 130.45 2 0 26.83 -999 ? ZN ZN E3005 >VAL~E 87 47.59 6.22 125.68 46.42 6.43 123.84 47.01 6.33 124.76 3 0 21.64 -999 ? ZN ZN E3005 >HIS~E 88 53.71 6.97 124.75 55.76 6.56 124.60 54.73 6.77 124.67 3 0 23.32 -999 ? ZN ZN H3004 >ARG~E 89 52.11 6.88 131.76 50.43 9.47 131.64 51.27 8.18 131.70 2 0 25.92 -999 ? ZN ZN H3004 >ARG~E 90 46.72 1.87 130.06 46.59 -1.10 129.20 46.66 0.38 129.63 2 0 28.05 -999 ? ZN ZN E3005 >VAL~E 91 50.72 0.91 124.81 50.67 1.53 122.77 50.69 1.22 123.79 3 0 23.26 -999 ? ZN ZN E3005 >LEU~E 92 54.98 1.62 127.03 56.24 2.83 125.73 55.61 2.23 126.38 3 0 22.04 -999 ? ZN ZN H3004 >GLU~E 93 51.94 0.09 131.05 50.41 0.98 132.24 51.18 0.53 131.64 2 0 25.95 -999 ? ZN ZN H3004 >GLY.E 94 50.91 -3.91 126.60 50.55 -3.21 126.54 50.73 -3.56 126.57 1 0 27.78 -999 ? ZN ZN H3004 >MET.E 95 47.77 -2.30 125.14 44.96 0.76 125.36 46.36 -0.77 125.25 2 0 23.62 -999 ? ZN ZN E3005 >GLY^E 96 47.45 -2.91 121.35 47.15 -2.29 121.80 47.30 -2.60 121.57 1 0 22.44 -999 ? ZN ZN E3005 >LEU^E 97 48.11 1.02 119.20 47.78 3.15 118.84 47.95 2.08 119.02 3 0 18.00 -999 ? ZN ZN E3005 >ILE^E 98 44.62 -1.05 114.90 44.05 -2.25 114.37 44.33 -1.65 114.64 3 0 16.24 -999 ? ZN ZN E3005 >VAL^E 99 46.40 3.05 113.45 47.98 4.50 114.03 47.19 3.78 113.74 3 0 12.63 -999 ? ZN ZN E3005 >LEU^E 100 42.76 3.40 110.43 41.85 1.51 110.94 42.31 2.45 110.69 3 0 10.50 -999 ? ZN ZN E3005 >HIS.E 101 43.33 6.82 105.46 43.36 7.91 103.65 43.34 7.37 104.55 3 0 -3.19 -999 ? ZN ZN E3005s >SER~E 102 45.33 9.43 108.16 43.01 10.16 108.04 44.17 9.79 108.10 2 0 4.14 -999 ? ZN ZN E3005 >GLY~E 103 46.10 8.22 111.70 46.52 8.34 111.04 46.31 8.28 111.37 1 0 8.72 -999 ? ZN ZN E3005 >HIS~E 104 49.94 9.05 108.10 49.84 10.77 106.90 49.89 9.91 107.50 3 0 7.88 -999 ? ZN ZN E3005 >PHE~E 105 50.40 13.55 109.53 52.24 14.58 107.65 51.32 14.06 108.59 3 0 10.29 -999 ? ZN ZN E3005 >SER~E 106 48.20 11.42 114.83 48.13 9.03 115.35 48.16 10.22 115.09 2 0 12.66 -999 ? ZN ZN E3005 >LYS~E 107 50.11 12.58 117.81 48.27 17.64 120.99 49.19 15.11 119.40 2 0 19.29 -999 ? ZN ZN E3005 >ILE~E 108 48.96 8.27 119.80 49.15 7.57 120.19 49.06 7.92 120.00 3 0 17.41 -999 ? ZN ZN E3005 >PHE~E 109 51.59 6.20 113.97 52.78 4.41 112.31 52.19 5.31 113.14 3 0 14.07 -999 ? ZN ZN E3005 >LYS~E 110 54.18 10.10 115.73 53.53 15.62 113.53 53.86 12.86 114.63 2 0 15.24 -999 ? ZN ZN E3005 >LYS~E 111 55.18 9.79 119.34 56.04 11.37 124.36 55.61 10.58 121.85 2 0 23.01 -999 ? ZN ZN H3004 >LEU~E 112 54.42 5.06 119.06 53.20 4.20 120.59 53.81 4.63 119.82 3 0 20.16 -999 ? ZN ZN E3005 >MET~E 113 57.51 6.19 115.90 56.17 3.87 114.02 56.84 5.03 114.96 2 0 17.94 -999 ? ZN ZN E3005 >GLY~E 114 59.97 9.02 116.70 59.57 9.00 115.97 59.77 9.01 116.33 1 0 21.38 -999 ? ZN ZN E3005 >THR.E 115 59.80 10.32 113.09 59.95 8.39 112.18 59.87 9.36 112.63 2 0 19.06 -999 ? ZN ZN E3005 >THR.E 116 57.57 12.77 111.14 58.72 13.75 109.57 58.14 13.26 110.36 2 0 17.12 -999 ? ZN ZN E3005 >CYH.E 117 55.45 9.99 109.60 55.05 8.65 111.99 55.25 9.32 110.79 2 0 14.71 -999 ? ZN ZN E3005 >ASN.E 118 55.84 13.55 106.28 54.70 15.09 105.26 55.27 14.32 105.77 2 0 12.75 -999 ? ZN ZN E3005 >LEU.E 119 53.53 9.72 103.26 51.41 9.78 103.91 52.47 9.75 103.58 3 0 9.60 -999 ? ZN ZN E3005 >LYS^E 120 53.48 11.76 99.50 58.78 11.90 95.71 56.13 11.83 97.60 2 0 17.94 -999 ? ZN ZN E3005 >TRP^E 121 49.90 14.24 101.11 46.76 16.21 99.88 48.33 15.22 100.50 3 0 8.00 -999 ? ZN ZN E3005 >ARG^E 122 47.17 12.14 92.38 49.34 9.94 92.35 48.25 11.04 92.37 2 0 13.25 -999 ? ZN ZN E3005 >GLU^E 123 41.13 12.82 97.77 39.83 14.28 98.64 40.48 13.55 98.21 2 0 7.20 -999 ? ZN ZN E3005 >ALA^E 124 42.26 11.31 92.78 43.51 11.29 91.94 42.89 11.30 92.36 2 0 12.02 -999 ? ZN ZN E3005 >ASP^E 125 38.51 8.84 92.61 37.71 10.71 93.35 38.11 9.77 92.98 2 0 11.77 -999 ? ZN ZN E3005 >GLU^E 126 44.80 6.24 92.77 46.45 7.57 92.59 45.63 6.91 92.68 2 0 12.22 -999 ? ZN ZN E3005 >LYS^E 127 42.74 2.22 92.19 42.53 -1.52 87.72 42.64 0.35 89.95 2 0 20.14 -999 ? ZN ZN E3005 >GLU^E 128 45.71 0.67 97.44 45.46 1.47 99.41 45.58 1.07 98.43 2 0 10.37 -999 ? ZN ZN E3005 >ARG^E 129 46.66 -5.83 92.42 45.60 -4.33 89.99 46.13 -5.08 91.21 2 0 20.49 -999 ? ZN ZN E3005 >LEU^E 130 46.47 -3.94 99.82 45.38 -2.24 100.58 45.92 -3.09 100.20 3 0 14.37 -999 ? ZN ZN E3005 >TRP^E 131 50.38 -5.58 94.90 49.55 -8.91 92.94 49.96 -7.25 93.92 3 0 18.96 -999 ? ZN ZN G3007 >VAL^E 132 50.28 -9.45 100.77 49.02 -10.93 101.84 49.65 -10.19 101.31 3 0 21.88 -999 ? ZN ZN E3005 >VAL.E 133 53.97 -9.81 101.51 54.69 -7.84 101.04 54.33 -8.82 101.28 3 0 21.09 -999 ? ZN ZN G3007 >ALA.E 134 53.81 -11.76 104.81 53.83 -10.95 106.07 53.82 -11.36 105.44 2 0 24.14 -999 ? ZN ZN E3005 >PRO.E 135 53.39 -15.36 102.43 52.12 -14.14 103.81 52.75 -14.75 103.12 3 0 23.26 -999 ? ZN ZN G3007 >GLY.E 136 51.79 -16.65 106.94 51.72 -15.79 106.98 51.76 -16.22 106.96 1 0 27.26 -999 ? ZN ZN G3007 >HIS~E 137 51.56 -11.38 110.21 51.64 -10.29 112.01 51.60 -10.84 111.11 3 0 24.10 -999 ? ZN ZN E3005 >PRO~E 138 49.36 -14.14 113.33 48.59 -13.84 111.25 48.97 -13.99 112.29 3 0 26.55 -999 ? ZN ZN E3005 >ILE~E 139 47.64 -9.17 110.11 47.88 -7.83 110.48 47.76 -8.50 110.30 3 0 20.59 -999 ? ZN ZN E3005 >VAL~E 140 46.16 -11.92 106.72 48.03 -11.64 105.66 47.10 -11.78 106.19 3 0 22.74 -999 ? ZN ZN E3005 >GLU~E 141 43.07 -16.66 109.27 42.49 -17.30 111.18 42.78 -16.98 110.23 2 0 28.69 -999 ? ZN ZN E3005 >GLY.E 142 41.41 -15.42 105.24 42.06 -14.97 105.07 41.73 -15.20 105.16 1 0 25.95 -999 ? ZN ZN E3005 >ILE.E 143 43.65 -11.64 103.37 42.76 -10.50 103.30 43.20 -11.07 103.34 3 0 21.53 -999 ? ZN ZN E3005 >GLY.E 144 43.83 -13.71 99.22 44.18 -13.07 99.71 44.00 -13.39 99.46 1 0 24.64 -999 ? ZN ZN E3005 >PRO.E 145 46.07 -13.47 95.51 46.39 -12.85 97.64 46.23 -13.16 96.57 3 0 22.80 -999 ? ZN ZN G3007 >TYR^E 146 45.61 -8.72 94.82 44.38 -9.47 92.46 45.00 -9.10 93.64 3 0 22.19 -999 ? ZN ZN E3005 >ILE^E 147 42.85 -6.05 99.71 42.27 -5.93 101.03 42.56 -5.99 100.37 3 0 16.83 -999 ? ZN ZN E3005 >GLU^E 148 41.55 -4.06 92.97 41.53 -4.98 91.10 41.54 -4.52 92.04 2 0 20.11 -999 ? ZN ZN E3005 >LEU^E 149 40.49 -0.23 97.40 40.42 -0.89 99.50 40.46 -0.56 98.45 3 0 12.54 -999 ? ZN ZN E3005 >GLU^E 150 36.81 -1.02 92.30 38.19 -1.75 90.79 37.50 -1.38 91.55 2 0 18.53 -999 ? ZN ZN E3005 >GLN^E 151 37.15 5.13 93.11 35.43 6.43 92.89 36.29 5.78 93.00 2 0 13.91 -999 ? ZN ZN E3005 >GLU^E 152 41.33 3.59 99.25 41.27 4.93 100.91 41.30 4.26 100.08 2 0 6.50 -999 ? ZN ZN E3005 >GLU^E 153 44.46 10.19 99.63 44.22 11.82 100.95 44.34 11.00 100.29 2 0 -3.52 -999 ? ZN ZN E3005s >MET^E 154 46.99 7.61 97.33 50.47 8.29 96.57 48.73 7.95 96.95 2 0 10.77 -999 ? ZN ZN E3005 >TYR^E 155 48.77 7.62 102.26 46.95 8.64 104.10 47.86 8.13 103.18 3 0 -5.53 -999 ? ZN ZN E3005s >GLY^E 156 53.33 7.10 98.52 53.38 7.41 99.28 53.35 7.26 98.90 1 0 12.21 -999 ? ZN ZN E3005 >GLU.E 157 57.02 3.77 99.85 57.24 3.64 102.00 57.13 3.70 100.92 2 0 16.00 -999 ? ZN ZN E3005 >PHE.E 158 60.98 7.78 102.76 61.99 7.06 105.25 61.49 7.42 104.01 3 0 18.84 -999 ? ZN ZN E3005 >PHE.E 159 55.01 5.83 105.54 53.13 5.65 107.64 54.07 5.74 106.59 3 0 12.42 -999 ? ZN ZN E3005 >ASP.E 160 59.06 10.05 107.40 60.65 10.58 108.74 59.85 10.31 108.07 2 0 18.40 -999 ? ZN ZN E3005 >ILE.E 161 57.40 4.64 109.51 56.45 3.88 108.86 56.92 4.26 109.19 3 0 16.22 -999 ? ZN ZN E3005 >PRO.E 162 60.03 4.14 113.33 60.57 4.01 111.25 60.30 4.07 112.29 3 0 20.35 -999 ? ZN ZN E3005 >GLU.E 163 62.81 -1.81 108.59 64.71 -2.78 108.42 63.76 -2.30 108.50 2 0 25.92 -999 ? ZN ZN E3005 >PRO.E 164 57.65 -1.34 108.48 59.10 -1.53 110.18 58.38 -1.44 109.33 3 0 20.26 -999 ? ZN ZN E3005 >ASP.E 165 58.26 -5.51 113.68 58.87 -4.64 115.56 58.56 -5.07 114.62 2 0 24.87 -999 ? ZN ZN E3005 >GLU^E 166 57.37 -9.02 110.84 56.59 -10.99 111.10 56.98 -10.00 110.97 2 0 26.44 -999 ? ZN ZN E3005 >THR^E 167 55.74 -5.38 106.43 56.60 -4.06 104.94 56.17 -4.72 105.69 2 0 19.99 -999 ? ZN ZN E3005 >ILE^E 168 51.28 -7.03 106.82 51.40 -8.18 107.57 51.34 -7.61 107.20 3 0 20.21 -999 ? ZN ZN E3005 >PHE^E 169 48.54 -5.59 103.27 46.51 -7.27 104.03 47.52 -6.43 103.65 3 0 17.51 -999 ? ZN ZN E3005 >ILE^E 170 53.97 -3.64 99.28 55.35 -3.47 98.97 54.66 -3.55 99.13 3 0 18.91 -999 ? ZN ZN E3005 >SER^E 171 50.25 -1.15 97.88 48.57 -0.33 99.50 49.41 -0.74 98.69 2 0 12.96 -999 ? ZN ZN E3005 >TRP^E 172 51.38 -1.55 90.96 48.19 -0.23 89.17 49.79 -0.89 90.07 3 0 19.18 -999 ? ZN ZN E3005 >PHE^E 173 48.49 3.93 95.25 47.94 3.70 97.89 48.22 3.81 96.57 3 0 11.24 -999 ? ZN ZN E3005 >GLU.E 174 45.38 3.92 87.97 43.28 4.30 87.74 44.33 4.11 87.86 2 0 17.31 -999 ? ZN ZN E3005 >GLY.E 175 49.11 6.74 89.45 49.49 6.09 89.69 49.30 6.41 89.57 1 0 16.17 -999 ? ZN ZN E3005 >GLY.E 176 52.59 5.13 89.86 52.30 5.21 90.50 52.44 5.17 90.18 1 0 17.88 -999 ? ZN ZN E3005 >GLU.E 177 53.05 7.48 93.95 51.64 8.29 92.55 52.34 7.88 93.25 2 0 14.50 -999 ? ZN ZN E3005 >VAL^E 178 53.87 2.24 96.10 55.64 1.23 95.38 54.76 1.73 95.74 3 0 16.84 -999 ? ZN ZN E3005 >PHE^E 179 52.13 3.80 101.39 52.14 5.20 103.75 52.14 4.50 102.57 3 0 11.08 -999 ? ZN ZN E3005 >ARG^E 180 57.95 0.03 103.70 59.48 2.35 104.94 58.71 1.19 104.32 2 0 18.49 -999 ? ZN ZN E3005 >SER^E 181 50.44 -0.17 103.69 49.75 0.55 101.46 50.10 0.19 102.58 2 0 12.30 -999 ? ZN ZN E3005 >GLY^E 182 50.48 -2.73 106.51 51.27 -2.50 106.19 50.88 -2.62 106.35 1 0 15.44 -999 ? ZN ZN E3005 >CYH^E 183 53.31 -2.47 108.99 54.20 -0.38 107.39 53.75 -1.42 108.19 2 0 16.04 -999 ? ZN ZN E3005 >THR^E 184 53.75 -3.92 112.50 53.64 -6.04 112.24 53.70 -4.98 112.37 2 0 21.38 -999 ? ZN ZN E3005 >PHE^E 185 55.79 -0.31 114.00 55.65 1.05 111.54 55.72 0.37 112.77 3 0 18.57 -999 ? ZN ZN E3005 >THR^E 186 56.33 -3.34 119.03 56.57 -5.38 119.76 56.45 -4.36 119.39 2 0 26.25 -999 ? ZN ZN E3005 >ARG^E 187 57.93 1.73 119.74 59.10 1.17 116.89 58.51 1.45 118.32 2 0 22.74 -999 ? ZN ZN E3005 >GLY.E 188 57.38 -1.86 125.17 57.16 -2.23 124.40 57.27 -2.05 124.79 1 0 21.92 -999 ? ZN ZN H3004 >LYS.E 189 54.96 -4.70 125.55 54.55 -6.41 131.43 54.75 -5.55 128.49 2 0 24.58 -999 ? ZN ZN H3004 >GLY^E 190 52.46 -3.15 123.09 53.19 -3.44 122.74 52.82 -3.30 122.92 1 0 25.38 -999 ? ZN ZN E3005 >LYS^E 191 51.85 -4.37 119.53 51.43 -9.32 121.81 51.64 -6.85 120.67 2 0 28.01 -999 ? ZN ZN E3005 >ILE^E 192 51.92 -0.53 116.89 52.31 0.61 117.27 52.11 0.04 117.08 3 0 19.15 -999 ? ZN ZN E3005 >PHE^E 193 48.35 -3.70 111.66 47.89 -4.32 109.03 48.12 -4.01 110.34 3 0 16.67 -999 ? ZN ZN E3005 >TYR^E 194 50.11 2.52 109.54 48.95 4.33 107.74 49.53 3.42 108.64 3 0 10.76 -999 ? ZN ZN E3005 >PHE^E 195 45.12 -1.79 107.33 43.97 -3.26 105.30 44.54 -2.53 106.32 3 0 13.30 -999 ? ZN ZN E3005 >ARG.E 196 47.92 3.54 101.87 45.28 4.81 101.03 46.60 4.18 101.45 2 0 6.77 -999 ? ZN ZN E3005 >PRO.E 197 43.74 -0.08 103.07 43.85 1.96 103.96 43.80 0.94 103.51 3 0 9.57 -999 ? ZN ZN E3005 >GLY.E 198 40.41 4.39 104.96 40.72 4.79 104.40 40.57 4.59 104.68 1 0 6.64 -999 ? ZN ZN E3005 >HIS.E 199 40.38 9.58 101.69 40.77 11.64 101.62 40.58 10.61 101.65 3 0 -3.24 -999 ? ZN ZN E3005s >GLU.E 200 36.92 11.87 104.61 39.01 12.16 104.37 37.97 12.01 104.49 2 0 4.26 -999 ? ZN ZN E3005 >THR.E 201 35.09 9.93 101.00 36.45 11.43 100.11 35.77 10.68 100.55 2 0 7.54 -999 ? ZN ZN E3005 >TYR.E 202 37.22 6.76 98.43 38.51 8.69 96.89 37.86 7.73 97.66 3 0 8.48 -999 ? ZN ZN E3005 >PRO~E 203 32.64 2.86 99.16 33.61 3.80 100.93 33.13 3.33 100.05 3 0 12.69 -999 ? ZN ZN E3005 >THR~E 204 36.56 1.50 102.31 38.59 2.17 102.04 37.57 1.83 102.17 2 0 9.53 -999 ? ZN ZN E3005 >TYR~E 205 36.70 1.77 107.24 39.23 2.78 107.71 37.97 2.27 107.48 3 0 10.19 -999 ? ZN ZN E3005 >HIS~E 206 30.55 0.37 104.00 29.53 1.73 105.22 30.04 1.05 104.61 3 0 15.94 -999 ? ZN ZN E3005 >HIS~E 207 36.71 -4.12 100.44 37.52 -5.56 99.14 37.11 -4.84 99.79 3 0 16.87 -999 ? ZN ZN E3005 >PRO~E 208 33.74 -7.83 101.67 34.69 -6.54 103.22 34.21 -7.19 102.45 3 0 19.72 -999 ? ZN ZN E3005 >ASP~E 209 39.32 -7.89 102.07 38.89 -9.58 100.86 39.11 -8.73 101.47 2 0 20.65 -999 ? ZN ZN E3005 >VAL~E 210 39.50 -4.45 104.89 39.46 -2.36 104.19 39.48 -3.41 104.54 3 0 14.29 -999 ? ZN ZN E3005 >LEU~E 211 35.77 -5.30 107.84 34.38 -3.69 107.94 35.08 -4.49 107.89 3 0 17.33 -999 ? ZN ZN E3005 >LYS~E 212 38.65 -8.77 108.13 38.15 -13.97 107.28 38.40 -11.37 107.71 2 0 25.11 -999 ? ZN ZN E3005 >VAL~E 213 42.25 -7.42 108.28 43.78 -6.64 106.93 43.01 -7.03 107.60 3 0 17.87 -999 ? ZN ZN E3005 >ILE~E 214 40.22 -3.92 110.98 39.83 -2.57 111.05 40.02 -3.25 111.02 3 0 15.70 -999 ? ZN ZN E3005 >ALA~E 215 39.56 -7.90 113.04 38.41 -8.76 112.57 38.98 -8.33 112.80 2 0 21.55 -999 ? ZN ZN E3005 >ASN~E 216 43.21 -10.50 111.15 42.10 -11.91 109.98 42.65 -11.20 110.57 2 0 23.19 -999 ? ZN ZN E3005 >ALA~E 217 44.93 -7.35 113.64 45.08 -6.05 112.98 45.01 -6.70 113.31 2 0 18.96 -999 ? ZN ZN E3005 >VAL~E 218 42.87 -6.73 116.81 40.96 -5.73 117.35 41.91 -6.23 117.08 3 0 21.28 -999 ? ZN ZN E3005 >ARG~E 219 42.15 -13.98 116.77 40.75 -13.25 114.11 41.45 -13.62 115.44 2 0 25.89 -999 ? ZN ZN E3005 >TRP~E 220 50.03 -10.62 115.41 51.12 -6.87 115.64 50.57 -8.74 115.52 3 0 23.71 -999 ? ZN ZN E3005 >ALA~E 221 47.54 -7.04 118.93 47.08 -5.70 118.37 47.31 -6.37 118.65 2 0 22.08 -999 ? ZN ZN E3005 >ALA~E 222 45.87 -8.30 122.09 44.92 -9.41 122.21 45.39 -8.85 122.15 2 0 27.08 -999 ? ZN ZN E3005 >PRO.E 223 46.44 -6.30 125.79 47.51 -7.93 124.73 46.97 -7.12 125.26 3 0 27.95 -999 ? ZN ZN E3005 >VAL.E 224 50.31 -10.48 126.71 51.76 -11.59 125.40 51.03 -11.04 126.06 3 0 30.20 -999 ? ZN ZN F3006 >ASN.E 225 53.31 -10.25 130.09 53.91 -12.30 129.92 53.61 -11.27 130.00 2 0 27.83 -999 ? ZN ZN F3006 >ARG.E 226 47.03 -4.48 129.44 45.05 -2.25 128.86 46.04 -3.37 129.15 2 0 28.08 -999 ? ZN ZN E3005 >GLY.E 227 51.26 -4.36 133.16 51.79 -4.32 132.48 51.53 -4.34 132.82 1 0 26.53 -999 ? ZN ZN H3004 >GLU.E 228 54.47 -0.28 135.93 54.79 0.46 137.88 54.63 0.09 136.90 2 0 21.95 -999 ? ZN ZN H3004 >ILE.E 229 58.56 -3.58 132.31 59.50 -4.86 131.92 59.03 -4.22 132.11 3 0 19.55 -999 ? ZN ZN H3004 >VAL.E 230 60.27 -3.48 136.57 60.53 -4.71 138.35 60.40 -4.09 137.46 3 0 18.44 -999 ? ZN ZN H3004 >PHE.E 231 62.16 -0.22 133.80 60.97 -0.69 131.33 61.57 -0.46 132.56 3 0 15.59 -999 ? ZN ZN H3004 >GLY^E 232 65.82 0.60 138.11 65.99 -0.14 137.90 65.90 0.23 138.01 1 0 11.78 -999 ? ZN ZN H3004 >ASN^E 233 68.82 0.48 141.85 70.64 -0.07 142.68 69.73 0.20 142.27 2 0 11.25 -999 ? ZN ZN H3004 >VAL.E 234 68.87 -4.20 141.24 68.22 -4.84 139.24 68.55 -4.52 140.24 3 0 13.68 -999 ? ZN ZN H3004 >LYS.E 235 71.01 -6.33 143.48 72.94 -3.83 147.35 71.98 -5.08 145.41 2 0 16.20 -999 ? ZN ZN H3004 >PRO.E 236 74.89 -8.14 143.48 72.99 -8.36 142.26 73.94 -8.25 142.87 3 0 16.21 -999 ? ZN ZN H3004 >LEU.E 237 71.40 -12.85 139.96 69.35 -12.16 139.58 70.37 -12.50 139.77 3 0 19.52 -999 ? ZN ZN H3004 >GLU.E 238 74.95 -14.85 138.86 74.53 -16.74 139.67 74.74 -15.79 139.27 2 0 21.25 -999 ? ZN ZN F3006 >PRO.E 239 79.17 -15.23 143.16 78.51 -13.22 142.44 78.84 -14.23 142.80 3 0 21.59 -999 ? ZN ZN H3004 >ILE.E 240 80.33 -8.36 141.83 79.72 -7.29 141.22 80.03 -7.82 141.53 3 0 15.61 -999 ? ZN ZN H3004 >LYS.E 241 84.50 -10.90 142.37 83.86 -13.40 137.81 84.18 -12.15 140.09 2 0 20.74 -999 ? ZN ZN H3004 >ALA.E 242 87.60 -9.28 143.74 88.35 -9.72 145.00 87.97 -9.50 144.37 2 0 22.30 -999 ? ZN ZN H3004 >THR.F 3 40.20 -27.35 116.84 38.47 -26.08 117.50 39.34 -26.71 117.17 2 0 36.18 -999 ? ZN ZN F3006 >PRO.F 4 42.07 -30.58 119.43 42.55 -28.49 118.63 42.31 -29.53 119.03 3 0 31.87 -999 ? ZN ZN F3006 >ILE.F 5 47.50 -26.54 117.75 48.21 -25.36 117.60 47.85 -25.95 117.68 3 0 27.07 -999 ? ZN ZN F3006 >ARG^F 6 45.54 -31.93 113.54 45.35 -31.10 110.63 45.45 -31.52 112.08 2 0 31.32 -999 ? ZN ZN F3006 >VAL^F 7 51.81 -31.13 117.14 52.68 -30.53 119.10 52.24 -30.83 118.12 3 0 22.28 -999 ? ZN ZN F3006 >VAL^F 8 54.40 -33.78 116.37 54.36 -35.12 114.69 54.38 -34.45 115.53 3 0 21.40 -999 ? ZN ZN F3006 >VAL^F 9 57.36 -34.08 118.70 57.34 -33.55 120.81 57.35 -33.82 119.76 3 0 17.21 -999 ? ZN ZN F3006 >TRP^F 10 60.91 -36.87 113.66 64.80 -36.83 114.17 62.86 -36.85 113.91 3 0 15.91 -999 ? ZN ZN F3006 >ASN^F 11 62.95 -37.03 120.04 64.54 -37.38 121.42 63.74 -37.21 120.73 2 0 11.64 -999 ? ZN ZN F3006 >GLU.F 12 69.03 -38.72 117.34 70.63 -37.36 117.56 69.83 -38.04 117.45 2 0 9.58 -999 ? ZN ZN F3006 >PHE.F 13 64.06 -42.43 121.33 62.93 -44.03 123.30 63.50 -43.23 122.32 3 0 16.27 -999 ? ZN ZN F3006 >ARG~F 14 70.33 -43.71 117.73 70.93 -43.72 114.69 70.63 -43.72 116.21 2 0 16.07 -999 ? ZN ZN F3006 >HIS~F 15 72.07 -38.75 123.57 73.67 -37.63 122.82 72.87 -38.19 123.19 3 0 7.54 -999 ? ZN ZN F3006 >GLU~F 16 66.50 -40.24 125.90 66.23 -39.33 124.02 66.37 -39.78 124.96 2 0 11.47 -999 ? ZN ZN F3006 >LYS~F 17 68.58 -45.87 124.63 63.96 -47.63 121.94 66.27 -46.75 123.29 2 0 19.64 -999 ? ZN ZN F3006 >LYS~F 18 72.35 -45.95 125.28 72.42 -47.45 121.25 72.39 -46.70 123.26 2 0 16.96 -999 ? ZN ZN F3006 >ASP~F 19 73.69 -42.11 127.55 74.57 -41.85 125.58 74.13 -41.98 126.56 2 0 11.31 -999 ? ZN ZN F3006 >GLU~F 20 72.85 -45.86 133.68 73.72 -44.72 135.24 73.29 -45.29 134.46 2 0 18.15 -999 ? ZN ZN F3006 >GLN~F 21 73.87 -39.24 133.88 73.16 -37.47 132.95 73.51 -38.35 133.41 2 0 11.47 -999 ? ZN ZN F3006 >VAL~F 22 70.29 -39.92 130.19 70.65 -39.12 128.24 70.47 -39.52 129.21 3 0 10.91 -999 ? ZN ZN F3006 >ARG~F 23 67.84 -46.69 129.50 66.04 -48.74 127.99 66.94 -47.71 128.75 2 0 20.08 -999 ? ZN ZN F3006 >ALA~F 24 67.57 -42.24 134.18 68.72 -42.11 135.17 68.14 -42.18 134.67 2 0 16.95 -999 ? ZN ZN F3006 >ILE~F 25 67.08 -37.56 132.93 67.78 -36.28 133.12 67.43 -36.92 133.03 3 0 12.90 -999 ? ZN ZN F3006 >TYR~F 26 64.87 -37.30 129.41 65.06 -34.54 129.85 64.96 -35.92 129.63 3 0 11.86 -999 ? ZN ZN F3006 >PRO.F 27 62.36 -42.77 132.51 63.46 -42.55 130.56 62.91 -42.66 131.53 3 0 17.97 -999 ? ZN ZN F3006 >GLU.F 28 58.73 -43.76 129.03 57.77 -42.63 130.57 58.25 -43.19 129.80 2 0 21.13 -999 ? ZN ZN F3006 >GLY~F 29 62.64 -40.38 125.59 62.21 -40.18 126.32 62.43 -40.28 125.96 1 0 14.89 -999 ? ZN ZN F3006 >MET~F 30 62.55 -36.65 125.80 66.23 -34.66 125.63 64.39 -35.65 125.72 2 0 8.76 -999 ? ZN ZN F3006 >HIS~F 31 60.02 -38.94 122.01 60.58 -40.95 122.15 60.30 -39.94 122.08 3 0 16.43 -999 ? ZN ZN F3006 >THR~F 32 57.46 -38.50 125.53 57.28 -40.53 126.06 57.37 -39.51 125.79 2 0 19.36 -999 ? ZN ZN F3006 >VAL~F 33 58.02 -35.88 128.24 59.56 -35.51 129.75 58.79 -35.70 129.00 3 0 16.69 -999 ? ZN ZN F3006 >ILE~F 34 58.31 -32.49 124.82 59.24 -31.60 124.21 58.77 -32.05 124.51 3 0 15.12 -999 ? ZN ZN F3006 >ALA~F 35 54.33 -34.52 124.14 54.30 -35.71 123.21 54.31 -35.12 123.68 2 0 20.15 -999 ? ZN ZN F3006 >SER~F 36 52.78 -35.49 127.47 52.63 -36.42 129.71 52.71 -35.96 128.59 2 0 22.74 -999 ? ZN ZN F3006 >TYR~F 37 53.96 -29.66 129.36 53.43 -27.09 130.22 53.70 -28.37 129.79 3 0 21.15 -999 ? ZN ZN F3006 >LEU~F 38 52.18 -30.75 124.03 53.77 -29.39 123.34 52.98 -30.07 123.69 3 0 20.85 -999 ? ZN ZN F3006 >ALA~F 39 48.63 -33.16 125.56 48.76 -34.64 125.72 48.70 -33.90 125.64 2 0 25.43 -999 ? ZN ZN F3006 >GLU~F 40 48.99 -33.45 130.78 50.26 -33.44 132.47 49.63 -33.45 131.63 2 0 25.28 -999 ? ZN ZN F3006 >ALA~F 41 47.97 -28.40 127.86 49.21 -27.75 127.47 48.59 -28.07 127.66 2 0 25.07 -999 ? ZN ZN F3006 >GLY.F 42 45.23 -29.08 125.28 45.93 -29.32 125.03 45.58 -29.20 125.16 1 0 28.67 -999 ? ZN ZN F3006 >PHE.F 43 49.04 -28.24 122.21 49.78 -25.59 122.64 49.41 -26.91 122.43 3 0 24.73 -999 ? ZN ZN F3006 >ASP^F 44 45.83 -32.99 118.68 45.69 -34.92 117.79 45.76 -33.95 118.24 2 0 29.03 -999 ? ZN ZN F3006 >ALA^F 45 50.18 -34.29 120.46 50.81 -33.91 121.77 50.50 -34.10 121.12 2 0 23.30 -999 ? ZN ZN F3006 >ALA^F 46 52.02 -37.16 118.80 51.52 -37.50 117.46 51.77 -37.33 118.13 2 0 24.12 -999 ? ZN ZN F3006 >THR^F 47 55.64 -38.27 118.63 55.87 -39.30 120.51 55.76 -38.79 119.57 2 0 20.14 -999 ? ZN ZN F3006 >ALA^F 48 58.06 -39.38 115.88 57.83 -38.67 114.67 57.94 -39.03 115.28 2 0 20.00 -999 ? ZN ZN F3006 >VAL^F 49 61.61 -40.75 116.08 61.32 -42.16 117.71 61.46 -41.45 116.89 3 0 17.71 -999 ? ZN ZN F3006 >LEU.F 50 66.03 -41.00 114.15 67.76 -40.64 112.96 66.89 -40.82 113.56 3 0 15.89 -999 ? ZN ZN F3006 >ASP.F 51 65.20 -45.88 114.66 67.32 -45.19 114.87 66.26 -45.53 114.76 2 0 18.15 -999 ? ZN ZN F3006 >GLU~F 52 59.11 -44.66 114.46 57.84 -43.26 115.44 58.48 -43.96 114.95 2 0 21.91 -999 ? ZN ZN F3006 >PRO~F 53 58.85 -47.69 109.29 60.10 -45.81 109.50 59.47 -46.75 109.39 3 0 25.82 -999 ? ZN ZN F3006 >GLU~F 54 59.32 -42.79 105.01 57.57 -42.44 103.83 58.44 -42.62 104.42 2 0 28.21 -999 ? ZN ZN F3006 >HIS~F 55 63.79 -40.29 109.48 65.47 -40.79 108.35 64.63 -40.54 108.92 3 0 19.97 -999 ? ZN ZN F3006 >GLY~F 56 57.98 -41.10 111.40 58.34 -40.68 110.82 58.16 -40.89 111.11 1 0 22.56 -999 ? ZN ZN F3006 >LEU~F 57 58.63 -37.18 109.06 59.02 -35.92 110.82 58.83 -36.55 109.94 3 0 21.15 -999 ? ZN ZN F3006 >THR~F 58 55.46 -39.70 106.17 54.39 -41.31 107.06 54.93 -40.50 106.61 2 0 27.67 -999 ? ZN ZN F3006 >ASP~F 59 53.14 -37.77 102.43 54.66 -37.11 101.04 53.90 -37.44 101.74 2 0 30.34 -999 ? ZN ZN F3006 >GLU~F 60 49.39 -40.61 104.62 50.93 -41.34 103.30 50.16 -40.98 103.96 2 0 32.44 -999 ? ZN ZN F3006 >VAL~F 61 51.78 -37.58 109.16 53.07 -38.54 110.63 52.42 -38.06 109.90 3 0 26.48 -999 ? ZN ZN F3006 >LEU~F 62 54.27 -34.07 107.01 56.35 -33.89 107.61 55.31 -33.98 107.31 3 0 24.92 -999 ? ZN ZN F3006 >ASP~F 63 49.28 -34.05 105.03 50.54 -33.90 103.25 49.91 -33.98 104.14 2 0 31.14 -999 ? ZN ZN F3006 >ARG~F 64 47.11 -37.02 111.14 48.65 -39.71 110.87 47.88 -38.37 111.01 2 0 29.64 -999 ? ZN ZN F3006 >CYH.F 65 50.88 -31.83 111.51 53.47 -31.71 112.52 52.18 -31.77 112.02 2 0 23.22 -999 ? ZN ZN F3006 >ASP.F 66 49.26 -27.60 113.21 47.27 -28.18 112.59 48.27 -27.89 112.90 2 0 28.88 -999 ? ZN ZN F3006 >VAL^F 67 53.63 -27.76 114.25 53.69 -26.14 115.70 53.66 -26.95 114.98 3 0 22.27 -999 ? ZN ZN F3006 >LEU^F 68 57.44 -30.26 112.97 58.45 -32.12 112.50 57.95 -31.19 112.73 3 0 19.29 -999 ? ZN ZN F3006 >VAL^F 69 59.07 -29.94 117.27 58.49 -29.52 119.35 58.78 -29.73 118.31 3 0 16.00 -999 ? ZN ZN F3006 >TRP^F 70 65.41 -31.77 114.86 63.78 -33.64 111.77 64.59 -32.70 113.31 3 0 14.02 -999 ? ZN ZN F3006 >TRP^F 71 66.29 -31.59 122.28 69.28 -34.22 122.15 67.78 -32.90 122.22 3 0 6.58 -999 ? ZN ZN F3006 >GLY.F 72 68.63 -34.02 117.50 68.79 -33.39 117.99 68.71 -33.70 117.75 1 0 8.72 -999 ? ZN ZN F3006 >HIS.F 73 73.62 -34.19 120.54 75.42 -33.57 121.40 74.52 -33.88 120.97 3 0 4.22 -999 ? ZN ZN F3006 >ILE.F 74 74.92 -38.21 118.55 74.83 -38.82 119.80 74.87 -38.52 119.17 3 0 9.07 -999 ? ZN ZN F3006 >ALA~F 75 72.66 -38.53 114.28 71.73 -39.71 114.62 72.20 -39.12 114.45 2 0 12.94 -999 ? ZN ZN F3006 >HIS~F 76 72.21 -33.36 113.72 71.77 -32.22 115.43 71.99 -32.79 114.58 3 0 9.52 -999 ? ZN ZN F3006 >ASP~F 77 74.84 -37.16 109.13 75.96 -35.33 109.52 75.40 -36.25 109.33 2 0 15.05 -999 ? ZN ZN F3006 >GLU~F 78 72.40 -41.43 110.85 72.36 -42.98 112.26 72.38 -42.21 111.55 2 0 16.82 -999 ? ZN ZN F3006 >VAL~F 79 67.95 -38.02 108.58 66.80 -36.60 109.70 67.38 -37.31 109.14 3 0 17.22 -999 ? ZN ZN F3006 >LYS~F 80 67.43 -38.80 104.89 67.77 -43.90 105.92 67.60 -41.35 105.41 2 0 22.93 -999 ? ZN ZN F3006 >ASP~F 81 68.49 -35.70 101.30 70.49 -35.16 101.91 69.49 -35.43 101.61 2 0 22.48 -999 ? ZN ZN F3006 >GLU~F 82 62.35 -38.39 99.99 61.82 -40.27 99.17 62.08 -39.33 99.58 2 0 28.92 -999 ? ZN ZN F3006 >VAL~F 83 62.53 -36.42 104.43 62.12 -37.75 106.05 62.32 -37.08 105.24 3 0 22.64 -999 ? ZN ZN F3006 >VAL~F 84 64.39 -33.10 105.07 66.40 -32.51 105.64 65.39 -32.81 105.35 3 0 20.28 -999 ? ZN ZN F3006 >GLU~F 85 64.93 -32.17 100.04 65.84 -33.60 98.75 65.38 -32.89 99.39 2 0 26.13 -999 ? ZN ZN G3007 >ARG~F 86 57.58 -36.11 103.55 58.75 -38.84 102.85 58.17 -37.47 103.20 2 0 26.96 -999 ? ZN ZN F3006 >VAL~F 87 59.64 -31.11 105.94 60.34 -31.65 107.97 59.99 -31.38 106.96 3 0 21.71 -999 ? ZN ZN F3006 >HIS~F 88 62.86 -26.74 102.95 63.41 -24.92 102.04 63.14 -25.83 102.49 3 0 23.38 -999 ? ZN ZN G3007 >ARG~F 89 58.30 -30.00 98.52 58.19 -33.04 99.19 58.25 -31.52 98.85 2 0 26.75 -999 ? ZN ZN G3007 >ARG~F 90 53.58 -30.54 104.46 51.76 -28.69 106.22 52.67 -29.61 105.34 2 0 28.20 -999 ? ZN ZN F3006 >VAL~F 91 57.36 -25.35 106.53 59.00 -25.15 107.96 58.18 -25.25 107.24 3 0 23.34 -999 ? ZN ZN F3006 >LEU~F 92 58.08 -23.17 102.22 60.23 -22.68 102.13 59.16 -22.92 102.17 3 0 22.24 -999 ? ZN ZN G3007 >GLU~F 93 53.35 -25.73 101.26 52.83 -27.70 100.85 53.09 -26.72 101.05 2 0 26.07 -999 ? ZN ZN G3007 >GLY.F 94 52.89 -22.92 106.58 53.25 -23.60 106.59 53.07 -23.26 106.58 1 0 28.10 -999 ? ZN ZN G3007 >MET.F 95 53.72 -25.73 109.01 54.80 -29.71 109.41 54.26 -27.72 109.21 2 0 23.80 -999 ? ZN ZN F3006 >GLY^F 96 55.27 -24.38 112.20 55.39 -25.14 111.89 55.33 -24.76 112.05 1 0 22.72 -999 ? ZN ZN F3006 >LEU^F 97 59.67 -25.65 112.23 61.36 -27.05 111.99 60.51 -26.35 112.11 3 0 18.17 -999 ? ZN ZN F3006 >ILE^F 98 59.30 -25.77 118.16 58.88 -24.56 118.51 59.09 -25.17 118.34 3 0 16.62 -999 ? ZN ZN F3006 >VAL^F 99 63.83 -26.35 116.95 65.18 -26.31 115.17 64.51 -26.33 116.06 3 0 12.81 -999 ? ZN ZN F3006 >LEU^F 100 64.53 -28.37 121.15 62.54 -28.10 121.93 63.53 -28.24 121.54 3 0 10.79 -999 ? ZN ZN F3006 >HIS.F 101 70.12 -28.45 123.47 71.89 -28.68 124.56 71.01 -28.57 124.02 3 0 -3.55 -999 ? ZN ZN F3006s >SER~F 102 71.20 -29.39 119.55 71.05 -31.48 120.79 71.12 -30.43 120.17 2 0 4.08 -999 ? ZN ZN F3006 >GLY~F 103 68.52 -29.15 116.83 69.17 -28.68 117.02 68.84 -28.92 116.92 1 0 8.81 -999 ? ZN ZN F3006 >HIS~F 104 72.67 -25.71 117.06 74.54 -26.50 117.51 73.61 -26.10 117.28 3 0 7.90 -999 ? ZN ZN F3006 >PHE~F 105 75.25 -28.43 114.34 77.66 -27.04 114.53 76.45 -27.73 114.43 3 0 10.08 -999 ? ZN ZN F3006 >SER~F 106 69.83 -30.45 112.23 67.75 -29.17 112.58 68.79 -29.81 112.41 2 0 12.75 -999 ? ZN ZN F3006 >LYS~F 107 69.73 -30.68 108.46 70.92 -35.81 105.31 70.32 -33.25 106.88 2 0 19.29 -999 ? ZN ZN F3006 >ILE~F 108 64.98 -29.56 109.03 64.28 -29.10 108.83 64.63 -29.33 108.93 3 0 17.44 -999 ? ZN ZN F3006 >PHE~F 109 67.72 -24.63 112.64 67.79 -22.15 113.82 67.75 -23.39 113.23 3 0 14.14 -999 ? ZN ZN F3006 >LYS~F 110 70.56 -25.52 108.63 75.43 -28.96 109.10 73.00 -27.24 108.86 2 0 14.79 -999 ? ZN ZN F3006 >LYS~F 111 68.63 -25.69 105.33 67.08 -27.65 100.49 67.86 -26.67 102.91 2 0 22.99 -999 ? ZN ZN G3007 >LEU~F 112 65.03 -23.26 107.55 63.00 -24.18 107.35 64.01 -23.72 107.45 3 0 20.22 -999 ? ZN ZN F3006 >MET~F 113 68.75 -20.74 107.92 67.69 -19.83 110.80 68.22 -20.29 109.36 2 0 17.95 -999 ? ZN ZN F3006 >GLY~F 114 71.24 -20.95 105.02 71.43 -20.94 105.78 71.34 -20.94 105.40 1 0 21.23 -999 ? ZN ZN F3006 >THR.F 115 74.22 -20.64 107.39 73.28 -19.10 108.57 73.75 -19.87 107.98 2 0 19.08 -999 ? ZN ZN F3006 >THR.F 116 76.32 -23.21 109.32 78.39 -22.46 109.51 77.35 -22.83 109.41 2 0 17.04 -999 ? ZN ZN F3006 >CYH.F 117 74.47 -22.65 112.58 71.91 -22.87 111.40 73.19 -22.76 111.99 2 0 14.71 -999 ? ZN ZN F3006 >ASN.F 118 79.11 -23.32 113.65 80.51 -24.74 114.48 79.81 -24.03 114.06 2 0 12.87 -999 ? ZN ZN F3006 >LEU.F 119 77.17 -22.00 118.43 76.15 -23.78 119.18 76.66 -22.89 118.80 3 0 9.66 -999 ? ZN ZN F3006 >LYS^F 120 80.84 -22.12 120.76 84.78 -16.97 120.89 82.81 -19.55 120.83 2 0 17.81 -999 ? ZN ZN F3006 >TRP^F 121 80.52 -26.64 120.66 81.55 -29.82 122.72 81.04 -28.23 121.69 3 0 7.90 -999 ? ZN ZN F3006 >ARG^F 122 83.04 -24.78 129.52 82.26 -21.87 128.93 82.65 -23.33 129.22 2 0 13.31 -999 ? ZN ZN F3006 >GLU^F 123 78.58 -31.49 129.17 78.33 -33.54 128.56 78.46 -32.51 128.86 2 0 7.22 -999 ? ZN ZN F3006 >ALA^F 124 80.55 -28.04 132.28 81.41 -26.82 132.26 80.98 -27.43 132.27 2 0 12.10 -999 ? ZN ZN F3006 >ASP^F 125 77.61 -29.10 135.53 78.12 -31.11 135.15 77.87 -30.10 135.34 2 0 12.24 -999 ? ZN ZN F3006 >GLU^F 126 77.68 -23.27 132.29 79.39 -22.68 131.13 78.54 -22.97 131.71 2 0 12.30 -999 ? ZN ZN F3006 >LYS^F 127 74.28 -22.03 135.30 73.40 -18.93 140.28 73.84 -20.48 137.79 2 0 20.36 -999 ? ZN ZN F3006 >GLU^F 128 71.13 -20.60 130.18 70.46 -21.84 128.60 70.79 -21.22 129.39 2 0 10.69 -999 ? ZN ZN F3006 >ARG^F 129 69.32 -14.71 135.54 71.76 -15.56 137.25 70.54 -15.14 136.39 2 0 20.44 -999 ? ZN ZN F3006 >LEU^F 130 66.59 -17.99 129.34 67.00 -20.01 128.91 66.80 -19.00 129.13 3 0 14.70 -999 ? ZN ZN F3006 >TRP^F 131 69.53 -12.69 131.52 67.93 -10.79 134.58 68.73 -11.74 133.05 3 0 18.65 -999 ? ZN ZN H3004 >VAL^F 132 63.32 -12.13 128.34 61.19 -12.51 128.72 62.26 -12.32 128.53 3 0 22.27 -999 ? ZN ZN F3006 >VAL.F 133 63.94 -9.39 125.80 65.99 -9.90 125.09 64.96 -9.64 125.45 3 0 20.65 -999 ? ZN ZN H3004 >ALA.F 134 60.53 -9.35 124.00 60.50 -10.24 122.75 60.52 -9.79 123.37 2 0 24.45 -999 ? ZN ZN F3006 >PRO.F 135 59.19 -6.96 127.31 58.72 -8.96 126.49 58.95 -7.96 126.90 3 0 22.85 -999 ? ZN ZN H3004 >GLY.F 136 55.06 -8.64 125.03 55.59 -9.21 124.79 55.33 -8.93 124.91 1 0 26.82 -999 ? ZN ZN H3004 >HIS~F 137 56.90 -12.89 121.00 56.75 -14.04 119.24 56.83 -13.47 120.12 3 0 24.48 -999 ? ZN ZN F3006 >PRO~F 138 52.35 -13.83 120.81 53.46 -13.93 122.75 52.90 -13.88 121.78 3 0 26.92 -999 ? ZN ZN F3006 >ILE~F 139 57.26 -17.15 122.56 58.11 -17.88 121.68 57.68 -17.51 122.12 3 0 20.91 -999 ? ZN ZN F3006 >VAL~F 140 56.67 -15.54 126.94 58.13 -14.01 126.61 57.40 -14.77 126.78 3 0 23.09 -999 ? ZN ZN F3006 >GLU~F 141 50.50 -15.76 128.25 48.77 -16.68 127.46 49.64 -16.22 127.86 2 0 28.96 -999 ? ZN ZN F3006 >GLY.F 142 53.26 -16.50 131.83 53.90 -16.21 131.46 53.58 -16.35 131.65 1 0 26.29 -999 ? ZN ZN F3006 >ILE.F 143 57.89 -16.50 130.71 58.33 -17.82 130.88 58.11 -17.16 130.80 3 0 21.93 -999 ? ZN ZN F3006 >GLY.F 144 58.73 -13.90 134.50 59.07 -14.18 133.73 58.90 -14.04 134.11 1 0 25.05 -999 ? ZN ZN F3006 >PRO.F 145 61.87 -11.33 136.05 61.22 -12.08 134.01 61.55 -11.70 135.03 3 0 22.35 -999 ? ZN ZN H3004 >TYR^F 146 65.63 -14.35 135.27 65.95 -14.13 137.99 65.79 -14.24 136.63 3 0 22.23 -999 ? ZN ZN H3004 >ILE^F 147 63.80 -19.48 132.21 62.93 -20.36 131.49 63.37 -19.92 131.85 3 0 17.10 -999 ? ZN ZN F3006 >GLU^F 148 68.57 -18.99 137.38 68.35 -17.82 139.09 68.46 -18.41 138.24 2 0 20.82 -999 ? ZN ZN F3006 >LEU^F 149 68.65 -23.79 133.38 66.93 -24.17 132.11 67.79 -23.98 132.74 3 0 12.80 -999 ? ZN ZN F3006 >GLU^F 150 69.55 -24.58 139.65 70.47 -22.74 140.30 70.01 -23.66 139.98 2 0 18.73 -999 ? ZN ZN F3006 >GLN^F 151 73.68 -28.03 137.17 74.03 -29.89 138.10 73.85 -28.96 137.63 2 0 14.43 -999 ? ZN ZN F3006 >GLU^F 152 70.69 -26.15 130.32 70.65 -27.48 128.71 70.67 -26.81 129.52 2 0 6.77 -999 ? ZN ZN F3006 >GLU^F 153 76.50 -27.92 126.31 76.41 -29.34 124.82 76.46 -28.63 125.57 2 0 -3.16 -999 ? ZN ZN F3006s >MET^F 154 76.78 -23.61 127.36 79.00 -21.41 125.75 77.89 -22.51 126.55 2 0 10.86 -999 ? ZN ZN F3006 >TYR^F 155 74.54 -23.94 122.67 73.58 -26.46 121.98 74.06 -25.20 122.33 3 0 -5.70 -999 ? ZN ZN F3006s >GLY^F 156 77.83 -19.04 123.05 77.68 -19.43 122.34 77.75 -19.24 122.69 1 0 12.37 -999 ? ZN ZN F3006 >GLU.F 157 76.07 -14.75 120.97 74.84 -15.16 119.28 75.45 -14.95 120.13 2 0 16.21 -999 ? ZN ZN F3006 >PHE.F 158 78.63 -15.12 115.33 77.07 -14.60 113.07 77.85 -14.86 114.20 3 0 18.92 -999 ? ZN ZN F3006 >PHE.F 159 73.53 -19.20 117.17 71.53 -21.12 116.74 72.53 -20.16 116.96 3 0 12.59 -999 ? ZN ZN F3006 >ASP.F 160 77.10 -19.25 112.14 77.23 -18.79 110.08 77.16 -19.02 111.11 2 0 18.42 -999 ? ZN ZN F3006 >ILE.F 161 71.31 -17.92 113.21 70.84 -17.99 114.42 71.07 -17.95 113.81 3 0 16.38 -999 ? ZN ZN F3006 >PRO.F 162 69.39 -16.84 109.09 70.91 -15.72 110.27 70.15 -16.28 109.68 3 0 20.46 -999 ? ZN ZN F3006 >GLU.F 163 69.01 -9.87 112.95 69.08 -7.91 112.25 69.04 -8.89 112.60 2 0 25.96 -999 ? ZN ZN F3006 >PRO.F 164 67.47 -13.93 115.69 66.89 -13.22 113.67 67.18 -13.58 114.68 3 0 20.48 -999 ? ZN ZN F3006 >ASP.F 165 61.54 -12.54 112.79 61.23 -13.17 110.82 61.38 -12.86 111.80 2 0 25.14 -999 ? ZN ZN F3006 >GLU^F 166 60.37 -10.46 116.47 58.63 -9.76 117.40 59.50 -10.11 116.93 2 0 26.64 -999 ? ZN ZN F3006 >THR^F 167 65.02 -12.23 119.66 67.19 -11.94 119.82 66.11 -12.08 119.74 2 0 20.30 -999 ? ZN ZN F3006 >ILE^F 168 62.05 -14.67 122.35 60.76 -14.18 122.10 61.41 -14.43 122.22 3 0 20.54 -999 ? ZN ZN F3006 >PHE^F 169 64.10 -16.47 126.14 61.73 -17.30 127.28 62.91 -16.88 126.71 3 0 17.88 -999 ? ZN ZN F3006 >ILE^F 170 69.76 -12.43 125.52 70.49 -11.36 124.89 70.12 -11.90 125.21 3 0 19.25 -999 ? ZN ZN F3006 >SER^F 171 71.08 -16.30 127.90 70.11 -18.47 127.35 70.60 -17.39 127.62 2 0 13.31 -999 ? ZN ZN F3006 >TRP^F 172 75.22 -13.08 132.62 76.19 -15.78 135.36 75.71 -14.43 133.99 3 0 19.37 -999 ? ZN ZN F3006 >PHE^F 173 75.72 -19.81 129.25 73.78 -20.95 127.61 74.75 -20.38 128.43 3 0 11.42 -999 ? ZN ZN F3006 >GLU.F 174 78.93 -20.04 136.51 78.56 -21.74 137.69 78.74 -20.89 137.10 2 0 17.30 -999 ? ZN ZN F3006 >GLY.F 175 81.48 -19.19 132.30 80.96 -18.65 132.10 81.22 -18.92 132.20 1 0 16.31 -999 ? ZN ZN F3006 >GLY.F 176 81.23 -15.75 130.69 80.79 -16.26 130.27 81.01 -16.00 130.48 1 0 18.12 -999 ? ZN ZN F3006 >GLU.F 177 80.92 -18.07 126.34 81.73 -19.28 127.96 81.32 -18.67 127.15 2 0 14.56 -999 ? ZN ZN F3006 >VAL^F 178 75.98 -15.11 126.13 76.23 -12.95 125.91 76.10 -14.03 126.02 3 0 17.01 -999 ? ZN ZN F3006 >PHE^F 179 73.35 -18.84 122.54 73.14 -20.41 120.32 73.24 -19.62 121.43 3 0 11.35 -999 ? ZN ZN F3006 >ARG^F 180 71.37 -13.02 118.71 72.95 -13.67 116.19 72.16 -13.35 117.45 2 0 18.65 -999 ? ZN ZN F3006 >SER^F 181 68.54 -18.49 123.06 70.01 -18.71 124.94 69.28 -18.60 124.00 2 0 12.67 -999 ? ZN ZN F3006 >GLY^F 182 65.06 -17.77 121.78 65.71 -17.26 121.43 65.38 -17.51 121.60 1 0 15.75 -999 ? ZN ZN F3006 >CYH^F 183 64.81 -16.65 118.16 67.65 -16.60 118.24 66.23 -16.63 118.20 2 0 16.34 -999 ? ZN ZN F3006 >THR^F 184 61.91 -16.44 115.68 60.49 -15.12 116.62 61.20 -15.78 116.15 2 0 21.71 -999 ? ZN ZN F3006 >PHE^F 185 64.44 -17.65 112.25 66.75 -17.67 113.79 65.59 -17.66 113.02 3 0 18.76 -999 ? ZN ZN F3006 >THR^F 186 59.56 -16.89 109.11 57.73 -15.71 109.17 58.64 -16.30 109.14 2 0 26.36 -999 ? ZN ZN F3006 >ARG^F 187 63.46 -18.84 106.04 65.04 -16.84 107.78 64.25 -17.84 106.91 2 0 22.87 -999 ? ZN ZN F3006 >GLY.F 188 57.54 -18.84 103.39 57.60 -18.60 104.18 57.57 -18.72 103.79 1 0 22.23 -999 ? ZN ZN G3007 >LYS.F 189 54.28 -19.10 105.36 49.46 -20.35 101.64 51.87 -19.73 103.50 2 0 25.12 -999 ? ZN ZN G3007 >GLY^F 190 55.95 -21.14 108.17 56.19 -20.35 108.07 56.07 -20.75 108.12 1 0 25.53 -999 ? ZN ZN F3006 >LYS^F 191 56.86 -19.74 111.56 51.76 -18.20 111.48 54.31 -18.97 111.52 2 0 28.15 -999 ? ZN ZN F3006 >ILE^F 192 61.21 -21.18 112.29 62.07 -21.68 111.42 61.64 -21.43 111.85 3 0 19.36 -999 ? ZN ZN F3006 >PHE^F 193 60.65 -20.32 119.28 61.47 -19.49 121.81 61.06 -19.91 120.54 3 0 17.01 -999 ? ZN ZN F3006 >TYR^F 194 67.11 -22.09 117.91 69.00 -23.52 119.44 68.06 -22.81 118.68 3 0 11.00 -999 ? ZN ZN F3006 >PHE^F 195 63.38 -22.57 123.80 62.99 -22.01 126.46 63.19 -22.29 125.13 3 0 13.64 -999 ? ZN ZN F3006 >ARG.F 196 71.60 -22.08 124.57 72.00 -24.50 126.42 71.80 -23.29 125.49 2 0 7.03 -999 ? ZN ZN F3006 >PRO.F 197 66.67 -23.33 127.33 67.62 -24.81 125.87 67.14 -24.07 126.60 3 0 9.86 -999 ? ZN ZN F3006 >GLY.F 198 67.57 -29.09 126.53 68.34 -28.92 126.47 67.96 -29.00 126.50 1 0 7.05 -999 ? ZN ZN F3006 >HIS.F 199 73.29 -31.15 127.17 74.90 -32.15 126.28 74.10 -31.65 126.72 3 0 -3.19 -999 ? ZN ZN F3006s >GLU.F 200 72.11 -35.90 126.19 73.22 -34.59 124.95 72.67 -35.25 125.57 2 0 4.11 -999 ? ZN ZN F3006 >THR.F 201 72.16 -35.12 130.61 74.24 -34.69 130.01 73.20 -34.91 130.31 2 0 7.47 -999 ? ZN ZN F3006 >TYR.F 202 71.99 -30.93 132.38 74.72 -30.61 132.28 73.35 -30.77 132.33 3 0 8.66 -999 ? ZN ZN F3006 >PRO~F 203 66.97 -32.24 135.59 67.05 -32.56 133.42 67.01 -32.40 134.51 3 0 12.89 -999 ? ZN ZN F3006 >THR~F 204 65.65 -29.41 131.46 66.99 -28.19 130.27 66.32 -28.80 130.86 2 0 9.81 -999 ? ZN ZN F3006 >TYR~F 205 63.10 -30.93 127.50 64.50 -29.83 125.36 63.80 -30.38 126.43 3 0 10.38 -999 ? ZN ZN F3006 >HIS~F 206 61.68 -33.60 133.91 61.56 -35.56 133.18 61.62 -34.58 133.54 3 0 16.14 -999 ? ZN ZN F3006 >HIS~F 207 62.64 -25.32 134.51 62.56 -23.46 135.50 62.60 -24.39 135.01 3 0 17.14 -999 ? ZN ZN F3006 >PRO~F 208 58.09 -26.45 136.51 58.52 -26.23 134.32 58.31 -26.34 135.42 3 0 19.93 -999 ? ZN ZN F3006 >ASP~F 209 59.93 -21.70 133.04 59.16 -20.58 134.70 59.55 -21.14 133.87 2 0 20.95 -999 ? ZN ZN F3006 >VAL~F 210 60.84 -24.46 129.67 62.80 -25.44 129.50 61.82 -24.95 129.59 3 0 14.56 -999 ? ZN ZN F3006 >LEU~F 211 57.17 -27.64 129.91 57.82 -29.68 130.04 57.49 -28.66 129.98 3 0 17.61 -999 ? ZN ZN F3006 >LYS~F 212 55.47 -23.45 129.15 51.45 -21.05 130.27 53.46 -22.25 129.71 2 0 25.24 -999 ? ZN ZN F3006 >VAL~F 213 57.66 -21.70 126.54 59.52 -20.58 126.50 58.59 -21.14 126.52 3 0 18.21 -999 ? ZN ZN F3006 >ILE~F 214 57.98 -26.08 124.46 58.79 -27.22 124.24 58.39 -26.65 124.35 3 0 15.97 -999 ? ZN ZN F3006 >ALA~F 215 53.60 -24.78 124.57 52.84 -24.99 125.85 53.22 -24.88 125.21 2 0 21.85 -999 ? ZN ZN F3006 >ASN~F 216 54.05 -19.92 124.75 53.32 -19.57 126.77 53.69 -19.74 125.76 2 0 23.54 -999 ? ZN ZN F3006 >ALA~F 217 55.57 -21.39 120.90 56.94 -21.73 120.93 56.26 -21.56 120.91 2 0 19.32 -999 ? ZN ZN F3006 >VAL~F 218 53.46 -24.17 119.45 53.21 -26.35 119.84 53.33 -25.26 119.65 3 0 21.58 -999 ? ZN ZN F3006 >ARG~F 219 47.88 -20.55 122.29 49.59 -21.11 124.91 48.74 -20.83 123.60 2 0 26.09 -999 ? ZN ZN F3006 >TRP~F 220 53.99 -16.09 117.74 56.97 -17.64 115.73 55.48 -16.86 116.73 3 0 24.01 -999 ? ZN ZN F3006 >ALA~F 221 53.70 -21.16 115.32 54.86 -22.13 115.55 54.28 -21.65 115.44 2 0 22.35 -999 ? ZN ZN F3006 >ALA~F 222 50.29 -22.58 114.28 49.04 -22.51 115.10 49.67 -22.54 114.69 2 0 27.48 -999 ? ZN ZN F3006 >PRO.F 223 49.97 -24.56 110.53 49.77 -22.54 111.21 49.87 -23.55 110.87 3 0 28.09 -999 ? ZN ZN F3006 >VAL.F 224 47.65 -19.57 108.89 48.23 -17.47 109.41 47.94 -18.52 109.15 3 0 29.88 -999 ? ZN ZN E3005 >ASN.F 225 47.12 -18.46 104.54 45.89 -16.76 104.96 46.51 -17.61 104.75 2 0 27.40 -999 ? ZN ZN E3005 >ARG.F 226 49.41 -26.30 107.02 50.66 -28.95 107.90 50.03 -27.62 107.46 2 0 28.08 -999 ? ZN ZN F3006 >GLY.F 227 48.92 -24.46 101.52 49.52 -23.87 101.74 49.22 -24.16 101.63 1 0 26.92 -999 ? ZN ZN G3007 >GLU.F 228 50.34 -25.93 96.89 51.03 -27.86 96.19 50.69 -26.90 96.54 2 0 24.28 -999 ? ZN ZN G3007 >ILE.F 229 52.48 -19.24 97.68 51.97 -17.72 97.93 52.23 -18.48 97.81 3 0 20.06 -999 ? ZN ZN G3007 >VAL.F 230 50.86 -19.34 93.44 49.02 -19.10 92.33 49.94 -19.22 92.88 3 0 18.88 -999 ? ZN ZN G3007 >PHE.F 231 55.55 -19.07 93.57 56.05 -18.98 96.28 55.80 -19.02 94.92 3 0 16.04 -999 ? ZN ZN G3007 >GLY^F 232 55.08 -18.48 87.91 54.84 -17.78 88.16 54.96 -18.13 88.04 1 0 12.27 -999 ? ZN ZN G3007 >ASN^F 233 54.60 -17.52 83.31 54.70 -16.32 81.61 54.65 -16.92 82.46 2 0 10.91 -999 ? ZN ZN G3007 >VAL.F 234 51.35 -14.45 85.00 51.61 -13.97 87.09 51.48 -14.21 86.04 3 0 13.68 -999 ? ZN ZN G3007 >LYS.F 235 49.35 -12.23 82.70 50.12 -14.85 78.06 49.73 -13.54 80.38 2 0 15.76 -999 ? ZN ZN G3007 >PRO.F 236 49.47 -8.16 81.28 48.97 -9.21 83.19 49.22 -8.68 82.23 3 0 16.07 -999 ? ZN ZN G3007 >LEU.F 237 46.31 -7.10 87.35 46.45 -8.89 88.65 46.38 -8.00 88.00 3 0 19.52 -999 ? ZN ZN G3007 >GLU.F 238 46.98 -2.81 86.37 45.07 -2.19 87.02 46.03 -2.50 86.69 2 0 21.22 -999 ? ZN ZN E3005 >PRO.F 239 44.39 -1.80 80.79 46.34 -2.78 81.17 45.36 -2.29 80.98 3 0 22.08 -999 ? ZN ZN G3007 >ILE.F 240 51.14 -3.64 79.38 52.23 -4.37 79.91 51.69 -4.00 79.64 3 0 16.06 -999 ? ZN ZN G3007 >LYS.F 241 50.74 0.30 76.86 50.50 4.32 73.94 50.62 2.31 75.40 2 0 24.00 -999 ? ZN ZN G3007 >ALA.F 242 52.60 -0.38 73.63 51.95 -0.58 72.29 52.28 -0.48 72.96 2 0 20.73 -999 ? ZN ZN G3007 >LYS.F 243 55.73 1.63 72.83 57.14 0.23 77.85 56.44 0.93 75.34 2 0 15.85 -999 ? ZN ZN G3007 >THR.G 3 93.41 -0.83 98.34 93.71 0.84 99.76 93.56 0.01 99.05 2 0 35.85 -999 ? ZN ZN G3007 >PRO.G 4 92.50 -0.51 93.93 91.46 -1.01 95.85 91.98 -0.76 94.89 3 0 31.81 -999 ? ZN ZN G3007 >ILE.G 5 86.50 -3.02 96.57 85.44 -2.87 97.34 85.97 -2.94 96.95 3 0 26.94 -999 ? ZN ZN G3007 >ARG^G 6 91.71 -7.84 95.30 92.19 -9.43 97.85 91.95 -8.63 96.57 2 0 31.17 -999 ? ZN ZN G3007 >VAL^G 7 85.10 -7.54 92.37 83.65 -6.19 91.38 84.37 -6.87 91.88 3 0 22.10 -999 ? ZN ZN G3007 >VAL^G 8 84.37 -10.61 90.22 85.33 -12.56 90.25 84.85 -11.58 90.24 3 0 21.24 -999 ? ZN ZN G3007 >VAL^G 9 81.32 -10.20 87.95 80.65 -8.35 87.01 80.99 -9.27 87.48 3 0 17.03 -999 ? ZN ZN G3007 >TRP^G 10 80.84 -17.04 87.97 77.40 -18.42 86.76 79.12 -17.73 87.37 3 0 15.77 -999 ? ZN ZN G3007 >ASN^G 11 77.78 -13.19 83.31 76.22 -12.97 81.88 77.00 -13.08 82.60 2 0 11.54 -999 ? ZN ZN G3007 >GLU.G 12 74.10 -18.93 82.40 72.04 -18.96 82.79 73.07 -18.94 82.60 2 0 9.71 -999 ? ZN ZN G3007 >PHE.G 13 78.82 -15.21 78.17 79.79 -13.82 75.99 79.30 -14.51 77.08 3 0 15.93 -999 ? ZN ZN G3007 >ARG~G 14 75.37 -21.59 78.03 75.77 -24.24 79.55 75.57 -22.91 78.79 2 0 16.51 -999 ? ZN ZN G3007 >HIS~G 15 69.90 -15.69 77.81 68.24 -16.61 78.71 69.07 -16.15 78.26 3 0 7.57 -999 ? ZN ZN G3007 >GLU~G 16 74.70 -12.00 76.50 74.95 -12.85 78.37 74.82 -12.43 77.44 2 0 11.32 -999 ? ZN ZN G3007 >LYS~G 17 75.50 -16.45 72.41 78.85 -18.42 75.74 77.18 -17.44 74.07 2 0 17.04 -999 ? ZN ZN G3007 >LYS~G 18 72.22 -18.15 71.48 68.91 -18.46 75.20 70.57 -18.30 73.34 2 0 10.89 -999 ? ZN ZN G3007 >ASP~G 19 69.12 -14.72 72.27 67.29 -13.68 71.81 68.21 -14.20 72.04 2 0 11.85 -999 ? ZN ZN G3007 >GLU~G 20 70.87 -11.24 66.15 72.86 -10.60 66.49 71.87 -10.92 66.32 2 0 18.78 -999 ? ZN ZN G3007 >GLN~G 21 66.23 -8.71 70.60 65.55 -8.66 72.62 65.89 -8.69 71.61 2 0 11.42 -999 ? ZN ZN G3007 >VAL~G 22 70.39 -10.32 73.26 70.09 -11.60 74.96 70.24 -10.96 74.11 3 0 10.83 -999 ? ZN ZN G3007 >ARG~G 23 75.87 -11.68 68.61 76.24 -14.63 69.43 76.05 -13.16 69.02 2 0 18.14 -999 ? ZN ZN G3007 >ALA~G 24 72.93 -7.06 69.89 71.71 -6.79 69.03 72.32 -6.93 69.46 2 0 16.90 -999 ? ZN ZN G3007 >ILE~G 25 71.34 -5.51 74.21 70.16 -5.32 74.81 70.75 -5.41 74.51 3 0 12.81 -999 ? ZN ZN G3007 >TYR~G 26 73.98 -7.07 77.09 72.39 -5.64 78.89 73.18 -6.35 77.99 3 0 11.71 -999 ? ZN ZN G3007 >PRO.G 27 78.00 -5.73 71.78 77.43 -7.72 72.72 77.72 -6.73 72.25 3 0 17.99 -999 ? ZN ZN G3007 >GLU.G 28 82.30 -7.59 73.70 83.07 -5.61 73.67 82.69 -6.60 73.68 2 0 21.81 -999 ? ZN ZN G3007 >GLY~G 29 78.06 -10.22 77.51 78.24 -9.38 77.39 78.15 -9.80 77.45 1 0 14.68 -999 ? ZN ZN G3007 >MET~G 30 76.46 -8.35 80.41 72.44 -9.47 81.13 74.45 -8.91 80.77 2 0 8.53 -999 ? ZN ZN G3007 >HIS~G 31 80.72 -11.07 81.42 81.12 -12.03 79.59 80.92 -11.55 80.51 3 0 16.41 -999 ? ZN ZN G3007 >THR~G 32 81.67 -6.93 80.36 82.74 -7.31 78.56 82.21 -7.12 79.46 2 0 19.30 -999 ? ZN ZN G3007 >VAL~G 33 79.32 -3.98 80.63 77.53 -3.35 79.55 78.42 -3.67 80.09 3 0 16.58 -999 ? ZN ZN G3007 >ILE~G 34 78.47 -5.30 85.21 77.38 -5.79 86.06 77.93 -5.54 85.63 3 0 15.06 -999 ? ZN ZN G3007 >ALA~G 35 82.85 -4.92 84.98 83.53 -6.15 84.60 83.19 -5.53 84.79 2 0 19.84 -999 ? ZN ZN G3007 >SER~G 36 83.80 -2.02 82.68 84.06 -2.86 80.48 83.93 -2.44 81.58 2 0 21.75 -999 ? ZN ZN G3007 >TYR~G 37 79.61 1.50 85.68 78.61 3.58 87.19 79.11 2.54 86.44 3 0 21.02 -999 ? ZN ZN G3007 >LEU~G 38 82.87 -2.30 88.53 81.08 -2.88 89.64 81.98 -2.59 89.09 3 0 20.67 -999 ? ZN ZN G3007 >ALA~G 39 86.65 -0.55 86.56 87.21 -1.19 85.26 86.93 -0.87 85.91 2 0 25.20 -999 ? ZN ZN G3007 >GLU~G 40 85.33 3.71 83.22 83.66 4.19 82.03 84.50 3.95 82.63 2 0 25.25 -999 ? ZN ZN G3007 >ALA~G 41 84.60 3.60 89.09 83.32 2.99 89.55 83.96 3.30 89.32 2 0 24.96 -999 ? ZN ZN G3007 >GLY.G 42 87.99 2.54 90.49 87.44 1.98 90.43 87.71 2.26 90.46 1 0 28.58 -999 ? ZN ZN G3007 >PHE.G 43 84.83 -1.05 92.31 82.90 0.21 93.88 83.86 -0.42 93.09 3 0 24.61 -999 ? ZN ZN G3007 >ASP^G 44 90.67 -4.44 91.55 91.94 -5.93 90.70 91.31 -5.19 91.12 2 0 28.90 -999 ? ZN ZN G3007 >ALA^G 45 87.11 -5.77 88.36 86.08 -4.91 87.64 86.60 -5.34 88.00 2 0 23.02 -999 ? ZN ZN G3007 >ALA^G 46 87.32 -9.21 86.74 88.22 -10.19 87.42 87.77 -9.70 87.08 2 0 23.90 -999 ? ZN ZN G3007 >THR^G 47 84.74 -11.39 85.06 84.63 -10.44 83.08 84.68 -10.92 84.07 2 0 19.95 -999 ? ZN ZN G3007 >ALA^G 48 83.89 -15.12 85.26 84.05 -15.58 86.72 83.97 -15.35 85.99 2 0 19.80 -999 ? ZN ZN G3007 >VAL^G 49 81.43 -17.27 83.42 81.87 -16.63 81.41 81.65 -16.95 82.42 3 0 17.46 -999 ? ZN ZN G3007 >LEU.G 50 78.33 -20.98 83.20 77.08 -22.58 83.77 77.71 -21.78 83.48 3 0 15.89 -999 ? ZN ZN G3007 >ASP.G 51 81.57 -22.32 79.61 79.61 -23.23 79.21 80.59 -22.77 79.41 2 0 18.74 -999 ? ZN ZN G3007 >GLU~G 52 85.80 -19.06 82.25 85.91 -17.16 83.23 85.85 -18.11 82.74 2 0 21.63 -999 ? ZN ZN G3007 >PRO~G 53 88.94 -23.38 83.99 86.74 -23.80 84.22 87.84 -23.59 84.10 3 0 25.58 -999 ? ZN ZN G3007 >GLU~G 54 87.15 -25.49 89.22 88.74 -25.44 90.54 87.95 -25.46 89.88 2 0 28.16 -999 ? ZN ZN G3007 >HIS~G 55 80.95 -23.13 87.32 80.17 -25.07 87.09 80.56 -24.10 87.20 3 0 19.95 -999 ? ZN ZN G3007 >GLY~G 56 85.78 -19.30 87.00 85.49 -19.73 87.63 85.64 -19.52 87.32 1 0 22.36 -999 ? ZN ZN G3007 >LEU~G 57 84.08 -19.53 91.21 82.86 -17.76 90.94 83.47 -18.65 91.08 3 0 21.13 -999 ? ZN ZN G3007 >THR~G 58 88.55 -21.50 91.88 90.01 -21.23 90.36 89.28 -21.36 91.12 2 0 27.59 -999 ? ZN ZN G3007 >ASP~G 59 90.64 -22.12 96.27 89.50 -23.72 97.06 90.07 -22.92 96.66 2 0 30.40 -999 ? ZN ZN G3007 >GLU~G 60 94.31 -18.28 92.25 95.00 -18.83 90.34 94.65 -18.56 91.30 2 0 31.65 -999 ? ZN ZN G3007 >VAL~G 61 90.04 -16.53 92.43 89.04 -16.42 90.49 89.54 -16.48 91.46 3 0 26.35 -999 ? ZN ZN G3007 >LEU~G 62 86.82 -17.65 95.89 84.86 -18.15 95.07 85.84 -17.90 95.48 3 0 24.89 -999 ? ZN ZN G3007 >ASP~G 63 91.56 -16.77 98.36 90.87 -18.76 99.03 91.22 -17.77 98.70 2 0 31.08 -999 ? ZN ZN G3007 >ARG~G 64 93.28 -12.45 92.81 92.34 -13.79 90.19 92.81 -13.12 91.50 2 0 28.42 -999 ? ZN ZN G3007 >CYH.G 65 87.53 -11.69 95.53 85.02 -12.05 94.38 86.28 -11.87 94.95 2 0 23.06 -999 ? ZN ZN G3007 >ASP.G 66 86.51 -7.68 98.00 88.59 -7.47 98.45 87.55 -7.57 98.22 2 0 28.65 -999 ? ZN ZN G3007 >VAL^G 67 82.65 -8.98 96.25 81.48 -7.17 96.57 82.06 -8.08 96.41 3 0 22.12 -999 ? ZN ZN G3007 >LEU^G 68 80.97 -12.98 94.21 81.06 -14.65 92.89 81.01 -13.82 93.55 3 0 19.22 -999 ? ZN ZN G3007 >VAL^G 69 78.33 -10.29 91.51 78.13 -8.22 90.71 78.23 -9.26 91.11 3 0 15.87 -999 ? ZN ZN G3007 >TRP^G 70 74.47 -15.95 90.04 77.46 -18.35 90.90 75.96 -17.15 90.47 3 0 14.04 -999 ? ZN ZN G3007 >TRP^G 71 71.82 -10.74 85.38 70.59 -13.32 82.72 71.20 -12.03 84.05 3 0 6.48 -999 ? ZN ZN G3007 >GLY.G 72 72.17 -16.51 85.85 71.58 -15.91 86.01 71.88 -16.21 85.93 1 0 8.76 -999 ? ZN ZN G3007 >HIS.G 73 67.32 -16.68 82.61 65.30 -16.49 82.12 66.31 -16.58 82.37 3 0 4.44 -999 ? ZN ZN G3007 >ILE.G 74 68.61 -20.59 80.43 68.68 -19.94 79.18 68.65 -20.27 79.80 3 0 9.35 -999 ? ZN ZN G3007 >ALA~G 75 71.60 -22.92 83.42 72.84 -22.96 82.52 72.22 -22.94 82.97 2 0 13.21 -999 ? ZN ZN G3007 >HIS~G 76 69.69 -20.79 87.76 69.17 -18.77 87.65 69.43 -19.78 87.70 3 0 9.66 -999 ? ZN ZN G3007 >ASP~G 77 70.46 -27.09 86.62 70.13 -26.15 84.64 70.30 -26.62 85.63 2 0 14.70 -999 ? ZN ZN G3007 >GLU~G 78 74.28 -26.72 83.25 74.82 -26.27 81.22 74.55 -26.49 82.23 2 0 17.15 -999 ? ZN ZN G3007 >VAL~G 79 76.72 -24.78 88.46 76.59 -22.72 89.16 76.65 -23.75 88.81 3 0 17.23 -999 ? ZN ZN G3007 >LYS~G 80 78.40 -27.68 90.29 79.74 -30.84 86.11 79.07 -29.26 88.20 2 0 23.81 -999 ? ZN ZN G3007 >ASP~G 81 76.91 -29.38 94.53 74.81 -29.55 94.05 75.86 -29.46 94.29 2 0 22.47 -999 ? ZN ZN G3007 >GLU~G 82 82.68 -28.90 92.97 83.35 -30.73 92.05 83.02 -29.81 92.51 2 0 27.42 -999 ? ZN ZN G3007 >VAL~G 83 81.53 -24.64 93.61 82.19 -23.93 91.70 81.86 -24.29 92.66 3 0 22.73 -999 ? ZN ZN G3007 >VAL~G 84 78.25 -23.50 95.24 76.10 -23.77 94.82 77.17 -23.63 95.03 3 0 20.33 -999 ? ZN ZN G3007 >GLU~G 85 78.65 -27.22 98.95 77.37 -26.81 100.60 78.01 -27.01 99.77 2 0 23.69 -999 ? ZN ZN F3006 >ARG~G 86 85.88 -22.74 95.53 86.19 -25.12 93.64 86.03 -23.93 94.58 2 0 26.89 -999 ? ZN ZN G3007 >VAL~G 87 81.19 -19.71 97.33 80.36 -18.76 95.55 80.78 -19.24 96.44 3 0 21.74 -999 ? ZN ZN G3007 >HIS~G 88 77.07 -21.47 101.66 75.94 -21.55 103.44 76.50 -21.51 102.55 3 0 23.22 -999 ? ZN ZN F3006 >ARG~G 89 83.55 -24.09 103.21 83.59 -25.74 100.57 83.57 -24.92 101.89 2 0 25.59 -999 ? ZN ZN F3006 >ARG~G 90 86.38 -17.64 100.18 86.64 -14.67 101.00 86.51 -16.16 100.59 2 0 28.18 -999 ? ZN ZN G3007 >VAL~G 91 80.30 -15.52 101.88 78.44 -15.11 100.77 79.37 -15.32 101.33 3 0 23.33 -999 ? ZN ZN G3007 >LEU~G 92 79.75 -18.11 105.92 77.76 -19.01 105.96 78.75 -18.56 105.94 3 0 22.08 -999 ? ZN ZN F3006 >GLU~G 93 85.17 -17.85 105.76 86.50 -18.78 104.37 85.84 -18.32 105.06 2 0 26.02 -999 ? ZN ZN F3006 >GLY~G 94 82.99 -12.12 104.82 82.93 -12.63 104.19 82.96 -12.37 104.50 1 0 28.05 -999 ? ZN ZN F3006 >MET.G 95 82.96 -12.13 100.97 83.68 -14.09 97.47 83.32 -13.11 99.22 2 0 23.65 -999 ? ZN ZN G3007 >GLY^G 96 80.22 -9.84 99.67 80.57 -10.46 99.24 80.39 -10.15 99.46 1 0 22.63 -999 ? ZN ZN G3007 >LEU^G 97 77.02 -12.46 97.62 76.31 -14.10 96.26 76.66 -13.28 96.94 3 0 18.07 -999 ? ZN ZN G3007 >ILE^G 98 76.00 -7.83 94.05 75.71 -6.79 94.79 75.85 -7.31 94.42 3 0 16.51 -999 ? ZN ZN G3007 >VAL^G 99 72.71 -11.23 93.18 72.06 -13.09 94.03 72.39 -12.16 93.61 3 0 12.78 -999 ? ZN ZN G3007 >LEU^G 100 72.06 -9.21 89.03 73.40 -7.55 89.20 72.73 -8.38 89.12 3 0 10.66 -999 ? ZN ZN G3007 >HIS.G 101 66.88 -10.08 86.04 65.09 -10.20 84.94 65.98 -10.14 85.49 3 0 -3.43 -999 ? ZN ZN G3007s >SER~G 102 67.38 -14.02 87.50 68.19 -13.90 85.23 67.79 -13.96 86.37 2 0 4.14 -999 ? ZN ZN G3007 >GLY~G 103 70.16 -14.88 89.95 69.34 -14.72 90.10 69.75 -14.80 90.02 1 0 8.84 -999 ? ZN ZN G3007 >HIS~G 104 64.94 -14.94 91.46 63.58 -15.83 90.12 64.26 -15.38 90.79 3 0 8.00 -999 ? ZN ZN G3007 >PHE~G 105 64.74 -19.45 90.33 62.05 -20.02 90.71 63.40 -19.73 90.52 3 0 10.27 -999 ? ZN ZN G3007 >SER~G 106 70.77 -19.44 91.50 71.81 -17.69 92.81 71.29 -18.57 92.16 2 0 12.88 -999 ? ZN ZN G3007 >LYS~G 107 71.85 -22.36 93.66 73.90 -27.70 91.37 72.88 -25.03 92.51 2 0 19.44 -999 ? ZN ZN G3007 >ILE~G 108 75.20 -19.14 95.30 75.61 -18.75 95.93 75.41 -18.95 95.61 3 0 17.46 -999 ? ZN ZN G3007 >PHE~G 109 69.56 -15.40 96.20 68.03 -13.42 97.34 68.79 -14.41 96.77 3 0 14.14 -999 ? ZN ZN G3007 >LYS~G 110 68.64 -20.23 97.24 66.52 -24.04 93.15 67.58 -22.14 95.19 2 0 15.23 -999 ? ZN ZN G3007 >LYS~G 111 71.13 -21.85 99.56 74.49 -25.55 101.48 72.81 -23.70 100.52 2 0 22.81 -999 ? ZN ZN F3006 >LEU~G 112 72.52 -17.44 100.92 74.66 -17.04 100.86 73.59 -17.24 100.89 3 0 20.20 -999 ? ZN ZN G3007 >MET~G 113 68.08 -17.77 101.66 67.85 -14.64 100.89 67.96 -16.20 101.28 2 0 17.94 -999 ? ZN ZN G3007 >GLY~G 114 66.77 -21.15 102.78 66.39 -20.72 102.19 66.58 -20.93 102.49 1 0 21.36 -999 ? ZN ZN G3007 >THR.G 115 63.60 -20.73 100.68 63.32 -18.69 101.38 63.46 -19.71 101.03 2 0 19.13 -999 ? ZN ZN G3007 >THR.G 116 62.57 -21.39 97.08 60.38 -21.81 97.01 61.47 -21.60 97.04 2 0 17.10 -999 ? ZN ZN G3007 >CYH.G 117 63.15 -17.81 95.95 65.58 -17.54 97.20 64.37 -17.67 96.58 2 0 14.76 -999 ? ZN ZN G3007 >ASN.G 118 59.21 -19.49 93.65 58.48 -20.11 91.73 58.85 -19.80 92.69 2 0 12.95 -999 ? ZN ZN G3007 >LEU.G 119 59.08 -14.29 92.28 60.63 -14.07 90.71 59.86 -14.18 91.50 3 0 9.67 -999 ? ZN ZN G3007 >LYS^G 120 55.49 -14.26 89.77 51.42 -14.90 93.44 53.45 -14.58 91.60 2 0 16.93 -999 ? ZN ZN G3007 >TRP^G 121 58.10 -16.32 86.49 58.40 -16.58 82.58 58.25 -16.45 84.53 3 0 7.72 -999 ? ZN ZN G3007 >ARG^G 122 52.98 -9.71 81.92 52.35 -8.52 84.70 52.67 -9.12 83.31 2 0 13.13 -999 ? ZN ZN G3007 >GLU^G 123 60.11 -10.83 78.43 61.12 -12.13 77.12 60.61 -11.48 77.77 2 0 7.23 -999 ? ZN ZN G3007 >ALA^G 124 56.00 -7.88 78.49 54.62 -7.84 79.08 55.31 -7.86 78.79 2 0 11.98 -999 ? ZN ZN G3007 >ASP^G 125 58.30 -4.62 76.42 58.93 -6.26 75.17 58.62 -5.44 75.80 2 0 11.84 -999 ? ZN ZN G3007 >GLU^G 126 55.91 -4.27 82.76 54.58 -5.75 83.46 55.24 -5.01 83.11 2 0 12.25 -999 ? ZN ZN G3007 >LYS^G 127 57.57 -0.01 82.76 54.74 5.32 82.28 56.15 2.65 82.52 2 0 20.50 -999 ? ZN ZN G3007 >GLU^G 128 60.74 -1.75 87.80 62.20 -3.34 87.99 61.47 -2.55 87.89 2 0 10.61 -999 ? ZN ZN G3007 >ARG^G 129 57.87 5.67 89.44 55.92 5.56 87.08 56.89 5.62 88.26 2 0 20.49 -999 ? ZN ZN G3007 >LEU^G 130 63.42 0.85 91.35 64.18 -0.61 89.96 63.80 0.12 90.65 3 0 14.64 -999 ? ZN ZN G3007 >TRP^G 131 57.81 3.45 93.31 57.55 7.38 93.27 57.68 5.41 93.29 3 0 18.90 -999 ? ZN ZN E3005 >VAL^G 132 63.66 4.20 97.24 65.57 5.32 97.24 64.62 4.76 97.24 3 0 22.19 -999 ? ZN ZN G3007 >VAL.G 133 62.43 3.21 100.67 61.18 1.51 100.14 61.80 2.36 100.41 3 0 20.87 -999 ? ZN ZN E3005 >ALA.G 134 65.78 3.44 102.56 66.61 2.21 102.65 66.20 2.82 102.61 2 0 24.36 -999 ? ZN ZN G3007 >PRO.G 135 64.91 7.69 103.00 66.42 6.42 101.93 65.67 7.05 102.46 3 0 23.07 -999 ? ZN ZN E3005 >GLY.G 136 69.83 7.23 103.78 69.66 6.53 103.43 69.74 6.88 103.60 1 0 27.13 -999 ? ZN ZN E3005 >HIS~G 137 71.22 1.37 102.67 72.29 -0.41 102.98 71.76 0.48 102.82 3 0 24.44 -999 ? ZN ZN G3007 >PRO~G 138 75.53 2.96 103.25 74.21 3.76 101.63 74.87 3.36 102.44 3 0 26.81 -999 ? ZN ZN G3007 >ILE~G 139 72.58 0.50 98.43 72.43 -0.89 98.21 72.50 -0.20 98.32 3 0 20.88 -999 ? ZN ZN G3007 >VAL~G 140 71.27 4.77 97.21 69.38 4.47 98.16 70.33 4.62 97.69 3 0 23.04 -999 ? ZN ZN G3007 >GLU~G 141 76.13 8.60 97.71 77.93 8.49 98.70 77.03 8.55 98.21 2 0 29.16 -999 ? ZN ZN G3007 >GLY.G 142 73.38 9.69 94.38 72.82 9.24 94.63 73.10 9.47 94.50 1 0 26.25 -999 ? ZN ZN G3007 >ILE.G 143 69.74 6.63 93.86 69.90 5.93 92.60 69.82 6.28 93.23 3 0 21.84 -999 ? ZN ZN G3007 >GLY.G 144 66.83 10.20 93.22 66.89 9.37 93.47 66.86 9.78 93.34 1 0 24.86 -999 ? ZN ZN G3007 >PRO.G 145 62.56 10.97 93.45 63.99 9.51 94.36 63.28 10.24 93.91 3 0 22.71 -999 ? ZN ZN E3005 >TYR^G 146 61.08 7.38 90.76 60.01 9.36 89.16 60.55 8.37 89.96 3 0 22.33 -999 ? ZN ZN G3007 >ILE^G 147 65.88 3.68 89.19 67.21 3.18 89.12 66.54 3.43 89.15 3 0 17.08 -999 ? ZN ZN G3007 >GLU^G 148 60.60 5.29 84.77 59.11 6.76 84.59 59.86 6.03 84.68 2 0 20.14 -999 ? ZN ZN G3007 >LEU^G 149 63.53 0.33 83.97 65.44 -0.04 84.91 64.49 0.14 84.44 3 0 12.72 -999 ? ZN ZN G3007 >GLU^G 150 60.33 3.01 78.06 60.97 3.55 76.11 60.65 3.28 77.08 2 0 18.04 -999 ? ZN ZN G3007 >GLN^G 151 60.71 -1.43 77.15 60.83 -2.24 75.15 60.77 -1.83 76.15 2 0 13.73 -999 ? ZN ZN G3007 >GLU^G 152 63.64 -4.03 83.58 64.76 -5.84 83.57 64.20 -4.94 83.58 2 0 6.69 -999 ? ZN ZN G3007 >GLU^G 153 60.68 -10.59 83.36 61.79 -12.26 83.02 61.23 -11.42 83.19 2 0 -3.03 -999 ? ZN ZN G3007s >MET^G 154 58.03 -7.96 85.80 55.49 -9.22 87.90 56.76 -8.59 86.85 2 0 10.87 -999 ? ZN ZN G3007 >TYR^G 155 61.22 -10.78 88.93 63.37 -11.93 87.69 62.30 -11.36 88.31 3 0 5.68 -999 ? ZN ZN G3007 >GLY^G 156 55.90 -9.83 91.47 56.41 -10.44 91.69 56.16 -10.14 91.58 1 0 12.34 -999 ? ZN ZN G3007 >GLU.G 157 56.08 -8.66 96.35 57.65 -9.44 97.55 56.86 -9.05 96.95 2 0 16.20 -999 ? ZN ZN G3007 >PHE.G 158 55.28 -14.33 98.99 56.97 -14.99 101.13 56.12 -14.66 100.06 3 0 18.95 -999 ? ZN ZN G3007 >PHE.G 159 61.07 -12.34 96.08 63.78 -12.62 95.37 62.42 -12.48 95.72 3 0 12.61 -999 ? ZN ZN G3007 >ASP.G 160 59.29 -17.84 98.17 59.51 -19.25 99.73 59.40 -18.54 98.95 2 0 18.49 -999 ? ZN ZN G3007 >ILE.G 161 63.37 -13.73 99.94 63.49 -12.59 99.27 63.43 -13.16 99.61 3 0 16.34 -999 ? ZN ZN G3007 >PRO.G 162 65.40 -15.35 103.72 63.35 -14.70 103.48 64.37 -15.03 103.60 3 0 20.42 -999 ? ZN ZN G3007 >GLU.G 163 61.37 -9.12 106.63 59.83 -8.70 107.99 60.60 -8.91 107.31 2 0 25.43 -999 ? ZN ZN G3007 >PRO.G 164 64.00 -8.19 102.41 64.68 -9.09 104.33 64.34 -8.64 103.37 3 0 20.41 -999 ? ZN ZN G3007 >ASP.G 165 69.04 -7.11 106.98 69.89 -9.08 107.51 69.46 -8.09 107.24 2 0 24.94 -999 ? ZN ZN G3007 >GLU^G 166 67.24 -1.45 105.07 68.60 -0.18 106.09 67.92 -0.81 105.58 2 0 26.16 -999 ? ZN ZN G3007 >THR^G 167 64.39 -3.17 101.96 62.50 -4.01 101.50 63.44 -3.59 101.73 2 0 20.19 -999 ? ZN ZN G3007 >ILE^G 168 67.48 -0.82 99.25 68.40 -0.13 100.11 67.94 -0.47 99.68 3 0 20.55 -999 ? ZN ZN G3007 >PHE^G 169 65.60 0.19 95.00 67.75 1.85 94.37 66.67 1.02 94.69 3 0 17.77 -999 ? ZN ZN G3007 >ILE^G 170 59.04 -1.13 97.10 58.04 -1.47 98.10 58.54 -1.30 97.60 3 0 19.19 -999 ? ZN ZN G3007 >SER^G 171 59.22 -1.63 92.45 61.17 -2.67 91.30 60.20 -2.15 91.87 2 0 13.17 -999 ? ZN ZN G3007 >TRP^G 172 53.05 1.31 90.90 52.91 1.93 87.06 52.98 1.62 88.98 3 0 19.27 -999 ? ZN ZN G3007 >PHE^G 173 56.57 -4.39 87.77 59.13 -5.17 88.37 57.85 -4.78 88.07 3 0 11.43 -999 ? ZN ZN G3007 >GLU.G 174 52.33 -0.25 82.53 53.11 0.16 80.61 52.72 -0.04 81.57 2 0 17.46 -999 ? ZN ZN G3007 >GLY.G 175 50.78 -4.44 84.89 50.98 -4.10 85.59 50.88 -4.27 85.24 1 0 16.25 -999 ? ZN ZN G3007 >GLY.G 176 49.75 -4.13 88.51 50.43 -4.39 88.49 50.09 -4.26 88.50 1 0 17.98 -999 ? ZN ZN G3007 >GLU.G 177 52.23 -8.18 89.38 51.73 -7.75 87.29 51.98 -7.96 88.34 2 0 14.45 -999 ? ZN ZN G3007 >VAL^G 178 54.99 -4.82 93.14 53.76 -4.16 94.77 54.37 -4.49 93.95 3 0 16.90 -999 ? ZN ZN G3007 >PHE^G 179 59.80 -7.93 93.08 61.22 -10.29 93.36 60.51 -9.11 93.22 3 0 11.30 -999 ? ZN ZN G3007 >ARG^G 180 59.54 -7.23 100.35 59.30 -10.23 100.98 59.42 -8.73 100.66 2 0 18.61 -999 ? ZN ZN G3007 >SER^G 181 63.56 -5.13 94.30 61.83 -4.44 92.77 62.70 -4.78 93.53 2 0 12.77 -999 ? ZN ZN G3007 >GLY^G 182 66.57 -4.11 96.47 65.84 -4.38 96.93 66.20 -4.24 96.70 1 0 15.70 -999 ? ZN ZN G3007 >CYH^G 183 67.00 -6.30 99.60 64.71 -7.61 98.82 65.85 -6.96 99.21 2 0 16.24 -999 ? ZN ZN G3007 >THR^G 184 70.00 -6.64 101.88 70.41 -4.69 102.70 70.20 -5.67 102.29 2 0 21.63 -999 ? ZN ZN G3007 >PHE^G 185 69.27 -10.96 102.55 66.95 -11.00 100.94 68.11 -10.98 101.74 3 0 18.77 -999 ? ZN ZN G3007 >THR^G 186 73.75 -10.61 106.24 74.78 -9.30 107.59 74.27 -9.95 106.91 2 0 26.42 -999 ? ZN ZN G3007 >ARG^G 187 72.17 -15.85 105.46 69.49 -14.29 105.66 70.83 -15.07 105.56 2 0 22.88 -999 ? ZN ZN G3007 >GLY.G 188 77.78 -14.92 108.68 77.42 -14.19 108.38 77.60 -14.56 108.53 1 0 22.15 -999 ? ZN ZN F3006 >LYS.G 189 80.18 -12.03 108.08 85.68 -12.98 110.57 82.93 -12.50 109.32 2 0 25.06 -999 ? ZN ZN F3006 >GLY^G 190 79.12 -11.65 104.41 78.59 -11.50 105.03 78.85 -11.58 104.72 1 0 25.50 -999 ? ZN ZN G3007 >LYS^G 191 76.81 -8.94 103.17 80.32 -5.65 105.95 78.57 -7.29 104.56 2 0 28.29 -999 ? ZN ZN G3007 >ILE^G 192 73.63 -11.09 100.55 73.43 -12.35 100.56 73.53 -11.72 100.56 3 0 19.33 -999 ? ZN ZN G3007 >PHE^G 193 72.06 -5.07 97.14 70.28 -3.19 96.09 71.17 -4.13 96.62 3 0 16.96 -999 ? ZN ZN G3007 >TYR^G 194 67.74 -9.95 94.99 66.49 -10.46 92.60 67.12 -10.20 93.79 3 0 10.96 -999 ? ZN ZN G3007 >PHE^G 195 69.70 -3.94 92.06 69.03 -1.51 90.90 69.37 -2.72 91.48 3 0 13.54 -999 ? ZN ZN G3007 >ARG.G 196 62.46 -7.04 89.90 62.75 -6.84 86.93 62.60 -6.94 88.41 2 0 7.02 -999 ? ZN ZN G3007 >PRO.G 197 66.70 -3.21 88.53 66.65 -5.41 88.04 66.67 -4.31 88.29 3 0 9.77 -999 ? ZN ZN G3007 >GLY.G 198 68.56 -6.97 84.52 67.85 -7.20 84.37 68.20 -7.08 84.44 1 0 6.82 -999 ? ZN ZN G3007 >HIS.G 199 64.45 -10.10 81.00 63.69 -11.90 80.25 64.07 -11.00 80.62 3 0 -3.19 -999 ? ZN ZN G3007s >GLU.G 200 68.05 -12.37 78.33 66.74 -13.18 79.74 67.39 -12.77 79.04 2 0 4.14 -999 ? ZN ZN G3007 >THR.G 201 66.47 -8.69 76.27 64.60 -9.84 76.44 65.54 -9.26 76.36 2 0 7.40 -999 ? ZN ZN G3007 >TYR.G 202 64.20 -5.33 78.48 61.79 -6.72 78.22 63.00 -6.03 78.35 3 0 8.39 -999 ? ZN ZN G3007 >PRO~G 203 68.31 -1.14 76.65 68.94 -2.98 77.74 68.63 -2.06 77.19 3 0 12.73 -999 ? ZN ZN G3007 >THR~G 204 69.14 -2.41 81.67 67.73 -3.29 83.00 68.43 -2.85 82.33 2 0 9.70 -999 ? ZN ZN G3007 >TYR~G 205 72.96 -4.85 83.56 71.83 -6.57 85.38 72.40 -5.71 84.47 3 0 10.28 -999 ? ZN ZN G3007 >HIS~G 206 73.89 -0.51 77.99 75.10 -1.79 76.88 74.49 -1.15 77.44 3 0 16.08 -999 ? ZN ZN G3007 >HIS~G 207 68.98 3.25 83.59 67.94 4.87 84.43 68.46 4.06 84.01 3 0 17.00 -999 ? ZN ZN G3007 >PRO~G 208 73.05 6.42 82.78 72.92 4.67 84.10 72.99 5.55 83.44 3 0 19.85 -999 ? ZN ZN G3007 >ASP~G 209 69.98 5.15 88.06 69.69 7.28 87.92 69.84 6.21 87.99 2 0 20.91 -999 ? ZN ZN G3007 >VAL~G 210 71.29 0.88 87.70 70.26 -0.60 86.49 70.78 0.14 87.10 3 0 14.51 -999 ? ZN ZN G3007 >LEU~G 211 75.88 1.38 86.14 76.26 0.22 84.30 76.07 0.80 85.22 3 0 17.56 -999 ? ZN ZN G3007 >LYS~G 212 75.47 3.38 90.10 76.95 6.97 93.36 76.21 5.17 91.73 2 0 25.07 -999 ? ZN ZN G3007 >VAL~G 213 73.41 1.20 92.50 71.27 0.79 92.87 72.34 0.99 92.69 3 0 18.09 -999 ? ZN ZN G3007 >ILE~G 214 75.71 -2.51 90.31 75.58 -3.55 89.40 75.65 -3.03 89.86 3 0 15.83 -999 ? ZN ZN G3007 >ALA~G 215 78.80 0.21 92.29 79.22 1.44 91.60 79.01 0.83 91.95 2 0 21.72 -999 ? ZN ZN G3007 >ASN~G 216 76.05 2.36 95.74 76.05 4.36 95.01 76.05 3.36 95.38 2 0 23.42 -999 ? ZN ZN G3007 >ALA~G 217 76.38 -1.95 96.62 75.33 -2.77 95.86 75.86 -2.36 96.24 2 0 19.06 -999 ? ZN ZN G3007 >VAL~G 218 79.86 -3.29 95.86 81.04 -3.85 94.13 80.45 -3.57 94.99 3 0 21.48 -999 ? ZN ZN G3007 >ARG~G 219 82.28 2.97 98.62 82.26 3.70 95.62 82.27 3.33 97.12 2 0 26.82 -999 ? ZN ZN G3007 >TRP~G 220 76.04 -1.23 103.02 74.73 -4.80 102.19 75.39 -3.02 102.61 3 0 23.96 -999 ? ZN ZN G3007 >ALA~G 221 79.23 -5.24 100.60 78.63 -6.03 99.46 78.93 -5.64 100.03 2 0 22.23 -999 ? ZN ZN G3007 >ALA~G 222 83.07 -5.14 100.93 83.89 -3.86 100.82 83.48 -4.50 100.88 2 0 27.31 -999 ? ZN ZN G3007 >PRO.G 223 85.15 -8.79 101.92 84.28 -7.14 103.06 84.71 -7.96 102.49 3 0 28.01 -999 ? ZN ZN G3007 >VAL.G 224 85.06 -6.38 107.25 83.91 -4.94 108.40 84.48 -5.66 107.82 3 0 30.04 -999 ? ZN ZN H3004 >ASN.G 225 85.99 -8.84 110.68 86.14 -7.31 112.15 86.07 -8.07 111.42 2 0 27.60 -999 ? ZN ZN H3004 >ARG.G 226 87.50 -11.84 102.89 87.53 -12.71 100.02 87.51 -12.27 101.46 2 0 28.20 -999 ? ZN ZN G3007 >GLY.G 227 88.29 -14.78 107.68 87.47 -14.66 107.87 87.88 -14.72 107.77 1 0 26.84 -999 ? ZN ZN F3006 >GLU.G 228 87.48 -20.53 109.30 87.98 -22.19 110.58 87.73 -21.36 109.94 2 0 21.11 -999 ? ZN ZN F3006 >ILE.G 229 83.71 -17.01 112.93 82.84 -16.11 114.03 83.27 -16.56 113.48 3 0 19.86 -999 ? ZN ZN F3006 >VAL.G 230 86.12 -19.47 115.91 87.68 -19.26 117.43 86.90 -19.37 116.67 3 0 18.70 -999 ? ZN ZN F3006 >PHE.G 231 82.03 -21.54 114.85 80.90 -19.61 113.08 81.46 -20.58 113.97 3 0 16.00 -999 ? ZN ZN F3006 >GLY^G 232 83.57 -25.29 118.86 83.44 -24.63 119.33 83.51 -24.96 119.09 1 0 12.17 -999 ? ZN ZN F3006 >ASN^G 233 85.11 -27.84 122.65 84.65 -28.62 124.61 84.88 -28.23 123.63 2 0 11.08 -999 ? ZN ZN F3006 >VAL.G 234 85.82 -23.56 124.44 84.61 -21.91 123.51 85.21 -22.73 123.98 3 0 13.93 -999 ? ZN ZN F3006 >LYS.G 235 87.34 -23.15 127.89 90.14 -27.08 126.94 88.74 -25.12 127.42 2 0 17.04 -999 ? ZN ZN F3006 >PRO.G 236 85.79 -22.46 131.99 85.83 -21.48 129.99 85.81 -21.97 130.99 3 0 16.55 -999 ? ZN ZN F3006 >LEU.G 237 85.86 -16.23 129.98 86.40 -15.85 127.93 86.13 -16.04 128.96 3 0 19.88 -999 ? ZN ZN F3006 >GLU.G 238 83.67 -15.31 133.82 84.86 -13.72 134.57 84.27 -14.51 134.19 2 0 21.15 -999 ? ZN ZN H3004 >PRO.G 239 85.64 -18.07 138.66 85.23 -19.34 136.80 85.43 -18.70 137.73 3 0 21.84 -999 ? ZN ZN F3006 >ILE.G 240 82.11 -23.32 135.93 81.48 -23.68 134.74 81.79 -23.50 135.33 3 0 15.86 -999 ? ZN ZN F3006 >LYS.G 241 81.31 -23.92 140.51 79.03 -21.73 145.84 80.17 -22.83 143.17 2 0 24.46 -999 ? ZN ZN F3006 >ALA.G 242 81.00 -27.69 141.07 81.85 -28.54 141.97 81.43 -28.12 141.52 2 0 20.09 -999 ? ZN ZN F3006 >LYS.G 243 77.29 -28.49 141.24 78.00 -24.63 138.25 77.64 -26.56 139.75 2 0 16.33 -999 ? ZN ZN F3006 >GLN.G 244 76.25 -30.87 145.98 76.34 -29.33 147.45 76.29 -30.10 146.72 2 0 23.94 -999 ? ZN ZN F3006 >THR.H 3 86.60 15.46 102.94 88.14 14.93 101.42 87.37 15.20 102.18 2 0 36.43 -999 ? ZN ZN H3004 >PRO.H 4 88.24 16.33 107.03 87.09 14.73 105.96 87.66 15.53 106.49 3 0 31.92 -999 ? ZN ZN H3004 >ILE.H 5 83.42 12.14 108.82 82.78 10.97 108.80 83.10 11.55 108.81 3 0 27.27 -999 ? ZN ZN H3004 >ARG^H 6 82.37 19.19 108.37 79.88 19.61 106.62 81.13 19.40 107.50 2 0 31.44 -999 ? ZN ZN H3004 >VAL^H 7 81.96 15.11 114.31 83.01 13.51 115.43 82.49 14.31 114.87 3 0 22.44 -999 ? ZN ZN H3004 >VAL^H 8 80.72 17.07 117.29 79.55 18.91 117.26 80.14 17.99 117.28 3 0 21.65 -999 ? ZN ZN H3004 >VAL^H 9 81.14 15.38 120.72 82.71 13.96 121.26 81.92 14.67 120.99 3 0 17.36 -999 ? ZN ZN H3004 >TRP^H 10 76.05 19.16 123.14 74.45 17.81 126.46 75.25 18.48 124.80 3 0 16.21 -999 ? ZN ZN H3004 >ASN^H 11 80.23 15.91 127.14 80.63 15.06 129.07 80.43 15.49 128.11 2 0 11.98 -999 ? ZN ZN H3004 >GLU.H 12 75.32 16.91 131.80 74.34 15.26 132.67 74.83 16.09 132.23 2 0 10.10 -999 ? ZN ZN H3004 >PHE.H 13 82.19 19.57 130.91 84.81 20.38 131.41 83.50 19.98 131.16 3 0 16.73 -999 ? ZN ZN H3004 >ARG~H 14 76.49 20.76 135.25 73.78 22.10 134.68 75.14 21.43 134.96 2 0 16.81 -999 ? ZN ZN H3004 >HIS~H 15 78.99 13.34 136.50 77.25 12.27 136.97 78.12 12.80 136.73 3 0 8.05 -999 ? ZN ZN H3004 >GLU~H 16 84.11 15.05 133.62 82.43 15.16 132.32 83.27 15.10 132.97 2 0 11.91 -999 ? ZN ZN H3004 >LYS~H 17 83.57 19.64 137.46 84.26 23.38 133.83 83.91 21.51 135.65 2 0 19.81 -999 ? ZN ZN H3004 >LYS~H 18 81.87 18.64 140.69 76.90 16.15 142.36 79.39 17.40 141.53 2 0 13.40 -999 ? ZN ZN H3004 >ASP~H 19 82.41 13.95 140.91 82.69 12.15 142.06 82.55 13.05 141.49 2 0 12.26 -999 ? ZN ZN H3004 >GLU~H 20 89.06 15.15 143.60 89.77 16.35 142.01 89.42 15.75 142.81 2 0 19.24 -999 ? ZN ZN H3004 >GLN~H 21 86.80 8.61 141.79 85.44 7.17 141.06 86.12 7.89 141.43 2 0 11.78 -999 ? ZN ZN H3004 >VAL~H 22 85.59 11.79 138.03 83.57 11.81 137.23 84.58 11.80 137.63 3 0 11.25 -999 ? ZN ZN H3004 >ARG~H 23 88.99 18.26 138.89 87.60 20.91 138.09 88.29 19.58 138.49 2 0 19.76 -999 ? ZN ZN H3004 >ALA~H 24 90.80 12.66 138.26 90.96 11.80 139.53 90.88 12.23 138.90 2 0 17.15 -999 ? ZN ZN H3004 >ILE~H 25 88.75 9.37 135.35 88.20 8.05 135.43 88.48 8.71 135.39 3 0 13.05 -999 ? ZN ZN H3004 >TYR~H 26 86.94 11.30 132.12 86.40 8.72 131.20 86.67 10.01 131.66 3 0 12.03 -999 ? ZN ZN H3004 >PRO.H 27 92.29 15.41 133.28 90.12 15.64 133.75 91.20 15.53 133.51 3 0 18.36 -999 ? ZN ZN H3004 >GLU.H 28 91.60 18.69 129.88 92.92 17.91 128.38 92.26 18.30 129.13 2 0 21.95 -999 ? ZN ZN H3004 >GLY~H 29 85.90 16.25 130.39 86.61 15.87 130.15 86.25 16.06 130.27 1 0 15.27 -999 ? ZN ZN H3004 >MET~H 30 85.03 12.98 128.58 82.47 10.41 130.70 83.75 11.70 129.64 2 0 9.04 -999 ? ZN ZN H3004 >HIS~H 31 83.78 17.35 126.15 84.18 18.86 127.56 83.98 18.11 126.86 3 0 16.82 -999 ? ZN ZN H3004 >THR~H 32 87.96 16.09 125.15 88.99 17.62 126.19 88.48 16.85 125.67 2 0 19.69 -999 ? ZN ZN H3004 >VAL~H 33 89.22 12.51 125.39 89.59 11.19 127.07 89.41 11.85 126.23 3 0 17.04 -999 ? ZN ZN H3004 >ILE~H 34 85.25 11.05 122.97 84.03 10.38 123.10 84.64 10.72 123.03 3 0 15.28 -999 ? ZN ZN H3004 >ALA~H 35 87.24 14.18 120.43 86.79 15.65 120.69 87.01 14.92 120.56 2 0 20.27 -999 ? ZN ZN H3004 >SER~H 36 91.06 13.89 120.74 91.83 15.28 122.46 91.45 14.58 121.60 2 0 22.22 -999 ? ZN ZN H3004 >TYR~H 37 90.43 7.84 119.80 90.77 5.38 118.51 90.60 6.61 119.15 3 0 21.21 -999 ? ZN ZN H3004 >LEU~H 38 87.25 11.60 116.90 85.54 10.28 117.29 86.39 10.94 117.10 3 0 20.97 -999 ? ZN ZN H3004 >ALA~H 39 91.08 13.76 115.67 91.53 14.94 116.47 91.30 14.35 116.07 2 0 25.62 -999 ? ZN ZN H3004 >GLU~H 40 95.25 11.30 117.98 95.57 10.52 119.96 95.41 10.91 118.97 2 0 24.93 -999 ? ZN ZN H3004 >ALA~H 41 91.66 8.89 113.74 90.44 8.26 114.31 91.05 8.57 114.03 2 0 24.96 -999 ? ZN ZN H3004 >GLY.H 42 91.37 11.45 110.92 90.86 11.54 111.49 91.12 11.50 111.20 1 0 28.75 -999 ? ZN ZN H3004 >PHE.H 43 86.65 11.17 112.53 85.86 8.55 112.08 86.26 9.86 112.30 3 0 24.80 -999 ? ZN ZN H3004 >ASP^H 44 86.75 17.54 110.80 86.51 19.60 111.08 86.63 18.57 110.94 2 0 29.27 -999 ? ZN ZN H3004 >ALA^H 45 86.30 16.74 115.58 86.99 15.76 116.39 86.64 16.25 115.99 2 0 23.53 -999 ? ZN ZN H3004 >ALA^H 46 84.85 19.46 117.84 84.09 20.53 117.14 84.47 20.00 117.49 2 0 24.35 -999 ? ZN ZN H3004 >THR^H 47 83.07 19.48 121.12 84.84 19.36 122.43 83.95 19.42 121.77 2 0 20.43 -999 ? ZN ZN H3004 >ALA^H 48 80.01 21.03 122.67 78.86 21.03 121.73 79.44 21.03 122.20 2 0 20.31 -999 ? ZN ZN H3004 >VAL^H 49 78.70 21.19 126.24 80.59 21.65 127.21 79.64 21.42 126.73 3 0 18.12 -999 ? ZN ZN H3004 >LEU.H 50 75.04 21.08 129.38 73.02 20.87 130.16 74.03 20.98 129.77 3 0 16.32 -999 ? ZN ZN H3004 >ASP.H 51 77.44 25.06 130.93 76.38 24.10 132.55 76.91 24.58 131.74 2 0 18.76 -999 ? ZN ZN H3004 >GLU~H 52 79.63 25.84 125.39 80.57 24.51 124.01 80.10 25.18 124.70 2 0 22.22 -999 ? ZN ZN H3004 >PRO~H 53 76.53 30.74 124.54 75.51 28.81 124.84 76.02 29.78 124.69 3 0 26.20 -999 ? ZN ZN H3004 >GLU~H 54 71.54 28.55 121.26 71.43 29.30 119.28 71.48 28.92 120.27 2 0 28.59 -999 ? ZN ZN H3004 >HIS~H 55 72.08 23.11 125.50 70.49 23.69 126.74 71.28 23.40 126.12 3 0 20.31 -999 ? ZN ZN H3004 >GLY~H 56 76.79 24.46 121.74 76.01 24.33 121.60 76.40 24.39 121.67 1 0 22.87 -999 ? ZN ZN H3004 >LEU~H 57 73.46 22.01 119.55 74.48 20.13 120.01 73.97 21.07 119.78 3 0 21.48 -999 ? ZN ZN H3004 >THR~H 58 73.35 26.29 117.11 75.05 27.63 117.23 74.20 26.96 117.17 2 0 28.06 -999 ? ZN ZN H3004 >ASP~H 59 71.00 26.83 112.95 68.99 26.75 113.62 70.00 26.79 113.28 2 0 30.55 -999 ? ZN ZN H3004 >GLU~H 60 75.31 29.34 111.88 73.55 29.96 112.95 74.43 29.65 112.42 2 0 32.66 -999 ? ZN ZN H3004 >VAL~H 61 77.15 24.13 114.29 77.93 23.91 116.31 77.54 24.02 115.30 3 0 26.70 -999 ? ZN ZN H3004 >LEU~H 62 73.18 21.33 113.93 72.59 20.54 115.83 72.89 20.94 114.88 3 0 25.10 -999 ? ZN ZN H3004 >ASP~H 63 74.21 23.71 109.12 72.08 24.17 109.38 73.15 23.94 109.25 2 0 31.48 -999 ? ZN ZN H3004 >ARG~H 64 80.93 24.16 110.92 80.65 26.20 113.22 80.79 25.18 112.07 2 0 30.04 -999 ? ZN ZN H3004 >CYH.H 65 77.99 18.42 111.82 77.42 17.18 114.22 77.70 17.80 113.02 2 0 23.39 -999 ? ZN ZN H3004 >ASP.H 66 79.13 14.51 109.19 79.77 15.84 107.65 79.45 15.18 108.42 2 0 28.96 -999 ? ZN ZN H3004 >VAL^H 67 77.70 13.03 113.18 78.40 10.91 113.00 78.05 11.97 113.09 3 0 22.38 -999 ? ZN ZN H3004 >LEU^H 68 75.50 14.82 116.89 75.02 16.25 118.41 75.26 15.53 117.65 3 0 19.56 -999 ? ZN ZN H3004 >VAL^H 69 77.93 12.07 119.72 79.80 10.92 119.77 78.86 11.50 119.74 3 0 16.13 -999 ? ZN ZN H3004 >TRP^H 70 73.23 13.09 124.83 72.16 16.51 123.17 72.70 14.80 124.00 3 0 14.34 -999 ? ZN ZN H3004 >TRP^H 71 78.85 9.31 128.16 78.04 10.80 131.69 78.45 10.05 129.92 3 0 6.92 -999 ? ZN ZN H3004 >GLY.H 72 74.46 13.00 129.46 74.61 12.14 129.49 74.53 12.57 129.48 1 0 9.14 -999 ? ZN ZN H3004 >HIS.H 73 74.34 10.41 134.65 74.15 9.17 136.33 74.24 9.79 135.49 3 0 4.79 -999 ? ZN ZN H3004 >ILE.H 74 73.30 14.30 136.88 74.47 14.44 137.67 73.89 14.37 137.27 3 0 9.60 -999 ? ZN ZN H3004 >ALA~H 75 70.92 17.01 133.70 71.87 18.19 133.75 71.40 17.60 133.73 2 0 13.39 -999 ? ZN ZN H3004 >HIS~H 76 69.35 13.06 130.68 70.68 11.48 130.35 70.02 12.27 130.52 3 0 9.81 -999 ? ZN ZN H3004 >ASP~H 77 65.31 17.94 132.97 64.31 16.10 133.50 64.81 17.02 133.24 2 0 15.77 -999 ? ZN ZN H3004 >GLU~H 78 69.25 21.41 133.59 70.92 22.25 134.54 70.08 21.83 134.07 2 0 17.54 -999 ? ZN ZN H3004 >VAL~H 79 68.57 20.52 127.58 69.64 19.04 126.36 69.11 19.78 126.97 3 0 17.52 -999 ? ZN ZN H3004 >LYS~H 80 66.04 22.90 126.05 66.44 26.63 129.22 66.24 24.77 127.64 2 0 23.78 -999 ? ZN ZN H3004 >ASP~H 81 61.83 21.55 124.28 61.29 20.38 125.99 61.56 20.96 125.13 2 0 22.52 -999 ? ZN ZN H3004 >GLU~H 82 65.36 26.03 121.79 66.01 27.88 120.93 65.68 26.96 121.36 2 0 27.98 -999 ? ZN ZN H3004 >VAL~H 83 67.59 22.38 120.85 69.51 22.93 121.69 68.55 22.66 121.27 3 0 22.86 -999 ? ZN ZN H3004 >VAL~H 84 66.22 18.79 121.07 65.51 17.46 122.67 65.86 18.12 121.87 3 0 20.45 -999 ? ZN ZN H3004 >GLU~H 85 61.56 20.17 119.18 60.56 18.42 118.52 61.06 19.30 118.85 2 0 24.27 -999 ? ZN ZN E3005 >ARG~H 86 69.27 23.92 116.31 68.74 26.15 118.43 69.00 25.04 117.37 2 0 27.11 -999 ? ZN ZN H3004 >VAL~H 87 68.76 18.00 116.62 70.21 17.32 118.13 69.48 17.66 117.37 3 0 21.91 -999 ? ZN ZN H3004 >HIS~H 88 63.54 14.70 116.19 62.09 13.35 115.50 62.82 14.03 115.84 3 0 23.50 -999 ? ZN ZN E3005 >ARG~H 89 62.83 20.60 112.51 63.47 22.60 114.77 63.15 21.60 113.64 2 0 26.24 -999 ? ZN ZN E3005 >ARG~H 90 70.38 19.72 110.78 72.20 17.76 109.12 71.29 18.74 109.95 2 0 28.35 -999 ? ZN ZN H3004 >VAL~H 91 68.93 13.46 112.28 69.17 12.18 114.04 69.05 12.82 113.16 3 0 23.50 -999 ? ZN ZN H3004 >LEU~H 92 64.40 13.31 110.33 63.09 12.37 111.81 63.75 12.84 111.07 3 0 22.17 -999 ? ZN ZN E3005 >GLU~H 93 66.68 17.14 107.64 67.15 19.22 107.38 66.91 18.18 107.51 2 0 26.02 -999 ? ZN ZN E3005 >GLY.H 94 70.68 12.57 107.58 70.62 12.93 108.20 70.65 12.75 107.89 1 0 28.11 -999 ? ZN ZN E3005 >MET.H 95 72.87 13.62 110.46 73.70 16.55 113.27 73.29 15.08 111.86 2 0 23.96 -999 ? ZN ZN H3004 >GLY^H 96 74.31 10.60 112.30 74.21 11.39 112.63 74.26 11.00 112.46 1 0 22.74 -999 ? ZN ZN H3004 >LEU^H 97 72.44 10.51 116.45 71.75 11.38 118.32 72.09 10.94 117.39 3 0 18.27 -999 ? ZN ZN H3004 >ILE^H 98 77.53 8.02 118.38 77.70 6.89 117.71 77.61 7.45 118.05 3 0 16.55 -999 ? ZN ZN H3004 >VAL^H 99 74.42 7.91 121.90 72.25 8.31 122.30 73.33 8.11 122.10 3 0 12.84 -999 ? ZN ZN H3004 >LEU^H 100 77.96 7.54 124.89 79.55 7.44 123.43 78.75 7.49 124.16 3 0 10.82 -999 ? ZN ZN H3004 >HIS.H 101 77.11 5.10 130.32 76.95 4.33 132.27 77.03 4.72 131.29 3 0 -3.38 -999 ? ZN ZN H3004s >SER~H 102 73.48 7.31 130.16 75.11 8.59 131.43 74.29 7.95 130.80 2 0 4.39 -999 ? ZN ZN H3004 >GLY~H 103 72.53 9.11 126.99 72.29 8.43 127.30 72.41 8.77 127.14 1 0 8.92 -999 ? ZN ZN H3004 >HIS~H 104 69.82 4.92 128.85 69.43 4.81 130.91 69.63 4.87 129.88 3 0 7.73 -999 ? ZN ZN H3004 >PHE~H 105 67.10 7.73 131.16 65.60 5.87 132.58 66.35 6.80 131.87 3 0 9.95 -999 ? ZN ZN H3004 >SER~H 106 68.53 11.90 126.91 69.57 11.19 124.78 69.05 11.54 125.84 2 0 12.86 -999 ? ZN ZN H3004 >LYS~H 107 65.59 13.80 125.54 63.96 19.31 128.09 64.78 16.55 126.82 2 0 19.35 -999 ? ZN ZN H3004 >ILE~H 108 68.15 13.86 121.40 68.26 13.72 120.56 68.21 13.79 120.98 3 0 17.57 -999 ? ZN ZN H3004 >PHE~H 109 68.42 7.21 122.72 68.57 4.52 122.08 68.49 5.87 122.40 3 0 14.09 -999 ? ZN ZN H3004 >LYS~H 110 63.88 9.07 123.93 62.15 9.93 129.48 63.02 9.50 126.71 2 0 15.26 -999 ? ZN ZN H3004 >LYS~H 111 62.23 11.19 121.25 59.64 15.25 119.03 60.93 13.22 120.14 2 0 23.06 -999 ? ZN ZN E3005 >LEU~H 112 65.23 9.18 118.03 66.24 10.55 116.76 65.73 9.86 117.39 3 0 20.29 -999 ? ZN ZN H3004 >MET~H 113 62.95 5.87 120.08 65.61 3.99 119.79 64.28 4.93 119.93 2 0 17.91 -999 ? ZN ZN H3004 >GLY~H 114 59.34 6.59 121.12 59.84 6.19 121.62 59.59 6.39 121.37 1 0 21.24 -999 ? ZN ZN H3004 >THR.H 115 59.71 4.46 124.31 60.75 2.85 123.26 60.23 3.65 123.79 2 0 18.96 -999 ? ZN ZN H3004 >THR.H 116 60.93 5.17 127.85 59.81 3.84 129.21 60.37 4.51 128.53 2 0 16.97 -999 ? ZN ZN H3004 >CYH.H 117 64.40 3.79 127.24 64.76 5.20 124.86 64.58 4.50 126.05 2 0 14.65 -999 ? ZN ZN H3004 >ASN.H 118 63.20 2.76 131.83 63.72 3.19 133.90 63.46 2.98 132.86 2 0 12.38 -999 ? ZN ZN H3004 >LEU.H 119 67.78 -0.28 131.34 69.30 1.24 131.53 68.54 0.48 131.44 3 0 9.34 -999 ? ZN ZN H3004 >LYS^H 120 67.76 -2.17 135.12 64.11 -7.42 136.06 65.93 -4.80 135.59 2 0 17.51 -999 ? ZN ZN H3004 >TRP^H 121 69.21 1.87 137.04 71.38 3.18 140.06 70.29 2.52 138.55 3 0 7.55 -999 ? ZN ZN H3004 >ARG^H 122 74.67 -4.50 141.26 73.84 -6.52 139.04 74.25 -5.51 140.15 2 0 12.99 -999 ? ZN ZN H3004 >GLU^H 123 78.57 2.51 140.33 78.84 4.63 140.46 78.70 3.57 140.39 2 0 6.80 -999 ? ZN ZN H3004 >ALA^H 124 79.11 -2.21 141.61 78.26 -3.50 141.91 78.69 -2.86 141.76 2 0 11.92 -999 ? ZN ZN H3004 >ASP^H 125 83.42 -1.86 140.89 83.31 0.08 141.85 83.37 -0.89 141.37 2 0 11.80 -999 ? ZN ZN H3004 >GLU^H 126 79.36 -5.51 137.13 77.42 -6.00 137.82 78.39 -5.76 137.48 2 0 12.04 -999 ? ZN ZN H3004 >LYS^H 127 83.20 -6.79 134.85 86.22 -11.64 134.93 84.71 -9.21 134.89 2 0 19.96 -999 ? ZN ZN H3004 >GLU^H 128 80.00 -4.89 129.86 79.39 -2.96 129.30 79.69 -3.93 129.58 2 0 10.42 -999 ? ZN ZN H3004 >ARG^H 129 83.59 -12.06 127.83 84.20 -12.70 130.76 83.90 -12.38 129.29 2 0 20.28 -999 ? ZN ZN H3004 >LEU^H 130 80.91 -5.62 124.75 80.88 -3.77 125.88 80.90 -4.70 125.32 3 0 14.49 -999 ? ZN ZN H3004 >TRP^H 131 79.85 -11.95 125.62 82.61 -14.52 124.40 81.23 -13.23 125.01 3 0 19.05 -999 ? ZN ZN F3006 >VAL^H 132 80.17 -9.19 119.11 81.65 -8.42 117.69 80.91 -8.80 118.40 3 0 21.99 -999 ? ZN ZN H3004 >VAL.H 133 77.02 -10.62 117.46 75.56 -10.36 119.06 76.29 -10.49 118.26 3 0 21.09 -999 ? ZN ZN F3006 >ALA.H 134 77.29 -8.87 114.10 76.53 -7.61 113.96 76.91 -8.24 114.03 2 0 24.24 -999 ? ZN ZN H3004 >PRO.H 135 79.91 -12.12 112.90 80.12 -9.92 113.26 80.02 -11.02 113.08 3 0 23.23 -999 ? ZN ZN F3006 >GLY.H 136 80.76 -8.45 109.60 80.44 -8.00 110.25 80.60 -8.23 109.92 1 0 27.26 -999 ? ZN ZN F3006 >HIS~H 137 77.65 -3.53 111.59 76.63 -1.73 111.33 77.14 -2.63 111.46 3 0 24.34 -999 ? ZN ZN H3004 >PRO~H 138 80.24 -1.46 108.10 81.11 -2.46 109.92 80.67 -1.96 109.01 3 0 26.86 -999 ? ZN ZN H3004 >ILE~H 139 79.89 -0.75 114.32 78.92 0.07 115.11 79.41 -0.34 114.72 3 0 20.80 -999 ? ZN ZN H3004 >VAL~H 140 83.32 -3.89 114.72 81.82 -5.44 115.01 82.57 -4.67 114.86 3 0 22.98 -999 ? ZN ZN H3004 >GLU~H 141 87.61 -2.59 110.38 88.02 -1.02 109.06 87.81 -1.81 109.72 2 0 28.81 -999 ? ZN ZN H3004 >GLY.H 142 89.34 -4.32 114.12 88.64 -4.53 114.40 88.99 -4.43 114.26 1 0 26.21 -999 ? ZN ZN H3004 >ILE.H 143 86.11 -5.09 117.54 86.30 -4.20 118.69 86.21 -4.64 118.12 3 0 21.74 -999 ? ZN ZN H3004 >GLY.H 144 88.01 -9.19 118.48 87.30 -8.73 118.55 87.66 -8.96 118.51 1 0 24.78 -999 ? ZN ZN H3004 >PRO.H 145 87.03 -12.86 120.52 85.92 -11.24 119.46 86.47 -12.05 119.99 3 0 22.87 -999 ? ZN ZN F3006 >TYR^H 146 85.36 -11.03 124.41 87.34 -12.47 125.67 86.35 -11.75 125.04 3 0 22.18 -999 ? ZN ZN H3004 >ILE^H 147 85.07 -4.95 124.17 85.17 -3.61 123.64 85.12 -4.28 123.91 3 0 17.01 -999 ? ZN ZN H3004 >GLU^H 148 87.08 -8.27 130.11 87.93 -10.18 130.44 87.51 -9.22 130.28 2 0 20.10 -999 ? ZN ZN H3004 >LEU^H 149 84.82 -2.91 130.50 84.76 -1.63 128.74 84.79 -2.27 129.62 3 0 12.70 -999 ? ZN ZN H3004 >GLU^H 150 89.75 -5.27 133.88 89.38 -7.37 133.80 89.56 -6.32 133.84 2 0 18.61 -999 ? ZN ZN H3004 >GLN^H 151 86.31 -2.21 137.98 87.01 -1.01 139.59 86.66 -1.61 138.78 2 0 13.87 -999 ? ZN ZN H3004 >GLU^H 152 81.87 -0.13 132.18 80.80 1.75 132.17 81.34 0.81 132.18 2 0 6.53 -999 ? ZN ZN H3004 >GLU^H 153 76.06 1.48 136.06 75.37 3.45 136.03 75.72 2.47 136.05 2 0 -2.62 -999 ? ZN ZN H3004s >MET^H 154 75.66 -2.66 134.90 72.63 -4.50 135.08 74.15 -3.58 134.99 2 0 10.47 -999 ? ZN ZN H3004 >TYR^H 155 72.91 0.31 131.51 73.52 2.99 131.62 73.21 1.65 131.56 3 0 -5.42 -999 ? ZN ZN H3004s >GLY^H 156 70.27 -4.94 132.33 69.92 -4.23 132.05 70.10 -4.59 132.19 1 0 11.97 -999 ? ZN ZN H3004 >GLU.H 157 68.41 -7.12 128.09 67.73 -5.73 126.57 68.07 -6.42 127.33 2 0 15.88 -999 ? ZN ZN H3004 >PHE.H 158 62.53 -5.01 128.28 61.39 -3.93 126.03 61.96 -4.47 127.15 3 0 18.56 -999 ? ZN ZN H3004 >PHE.H 159 67.75 -0.93 126.64 68.88 1.43 125.68 68.31 0.25 126.16 3 0 12.32 -999 ? ZN ZN H3004 >ASP.H 160 61.85 0.35 127.72 59.91 0.82 126.85 60.88 0.59 127.28 2 0 18.26 -999 ? ZN ZN H3004 >ILE.H 161 65.30 0.36 122.82 66.62 0.01 122.95 65.96 0.18 122.89 3 0 16.07 -999 ? ZN ZN H3004 >PRO.H 162 62.37 1.80 119.34 62.48 -0.12 120.43 62.42 0.84 119.88 3 0 20.31 -999 ? ZN ZN H3004 >GLU.H 163 64.07 -5.94 117.27 62.91 -7.19 115.98 63.49 -6.56 116.63 2 0 25.81 -999 ? ZN ZN H3004 >PRO.H 164 68.28 -3.13 118.88 66.72 -2.69 117.29 67.50 -2.91 118.09 3 0 20.14 -999 ? ZN ZN H3004 >ASP.H 165 68.21 -1.41 112.20 66.60 0.05 111.85 67.40 -0.68 112.03 2 0 24.97 -999 ? ZN ZN H3004 >GLU^H 166 72.85 -5.57 112.88 73.35 -5.62 110.84 73.10 -5.59 111.86 2 0 26.14 -999 ? ZN ZN H3004 >THR^H 167 72.26 -5.67 117.46 71.26 -6.55 119.09 71.76 -6.11 118.28 2 0 19.98 -999 ? ZN ZN H3004 >ILE^H 168 76.63 -3.92 117.04 76.94 -3.95 115.63 76.78 -3.94 116.33 3 0 20.36 -999 ? ZN ZN H3004 >PHE^H 169 79.14 -4.70 120.94 81.54 -3.84 119.79 80.34 -4.27 120.36 3 0 17.63 -999 ? ZN ZN H3004 >ILE^H 170 74.69 -9.51 123.44 73.49 -10.29 123.37 74.09 -9.90 123.41 3 0 18.94 -999 ? ZN ZN H3004 >SER^H 171 77.03 -7.59 127.07 77.55 -5.25 127.16 77.29 -6.42 127.11 2 0 13.01 -999 ? ZN ZN H3004 >TRP^H 172 77.95 -13.57 130.70 80.52 -12.84 133.57 79.23 -13.21 132.14 3 0 19.07 -999 ? ZN ZN H3004 >PHE^H 173 76.68 -6.49 132.95 76.64 -4.27 131.39 76.66 -5.38 132.17 3 0 11.06 -999 ? ZN ZN H3004 >GLU.H 174 81.57 -10.53 137.45 83.06 -9.65 138.62 82.31 -10.09 138.03 2 0 17.23 -999 ? ZN ZN H3004 >GLY.H 175 76.25 -9.98 138.40 76.21 -10.28 137.70 76.23 -10.13 138.05 1 0 15.93 -999 ? ZN ZN H3004 >GLY.H 176 74.07 -12.12 136.18 74.10 -11.39 135.88 74.08 -11.76 136.03 1 0 17.73 -999 ? ZN ZN H3004 >GLU.H 177 71.42 -8.15 135.38 72.64 -8.10 137.12 72.03 -8.13 136.25 2 0 14.18 -999 ? ZN ZN H3004 >VAL^H 178 72.80 -9.19 129.89 71.94 -11.01 129.18 72.37 -10.10 129.54 3 0 16.65 -999 ? ZN ZN H3004 >PHE^H 179 72.15 -3.64 128.26 70.89 -1.22 127.88 71.52 -2.43 128.07 3 0 10.99 -999 ? ZN ZN H3004 >ARG^H 180 68.49 -6.40 122.65 65.83 -5.06 123.30 67.16 -5.73 122.98 2 0 18.28 -999 ? ZN ZN H3004 >SER^H 181 74.88 -2.82 124.39 75.68 -3.77 126.45 75.28 -3.29 125.42 2 0 12.15 -999 ? ZN ZN H3004 >GLY^H 182 75.39 -1.88 120.78 74.68 -2.40 120.91 75.04 -2.14 120.84 1 0 15.46 -999 ? ZN ZN H3004 >CYH^H 183 72.23 -1.17 118.76 70.92 -1.99 121.03 71.58 -1.58 119.90 2 0 16.07 -999 ? ZN ZN H3004 >THR^H 184 71.74 0.49 115.38 72.89 -0.52 113.88 72.32 -0.02 114.63 2 0 21.56 -999 ? ZN ZN H3004 >PHE^H 185 67.91 2.37 116.73 68.02 1.20 119.23 67.96 1.78 117.98 3 0 18.59 -999 ? ZN ZN H3004 >THR^H 186 67.66 4.47 111.19 68.38 4.04 109.24 68.02 4.26 110.22 2 0 26.28 -999 ? ZN ZN H3004 >ARG^H 187 63.62 6.53 114.19 63.76 3.54 115.16 63.69 5.04 114.68 2 0 22.81 -999 ? ZN ZN H3004 >GLY.H 188 64.44 9.25 108.37 65.00 8.61 108.61 64.72 8.93 108.49 1 0 22.04 -999 ? ZN ZN E3005 >LYS.H 189 67.82 9.40 106.61 67.55 13.29 101.81 67.68 11.34 104.21 2 0 24.91 -999 ? ZN ZN E3005 >GLY^H 190 69.82 9.40 109.88 69.41 8.75 109.68 69.62 9.08 109.78 1 0 25.56 -999 ? ZN ZN H3004 >LYS^H 191 71.79 6.52 111.25 73.71 6.32 106.09 72.75 6.42 108.67 2 0 28.39 -999 ? ZN ZN H3004 >ILE^H 192 70.58 6.32 115.72 69.58 6.91 116.28 70.08 6.62 116.00 3 0 19.32 -999 ? ZN ZN H3004 >PHE^H 193 76.32 2.52 117.44 77.72 0.43 118.61 77.02 1.48 118.02 3 0 16.87 -999 ? ZN ZN H3004 >TYR^H 194 72.44 2.98 122.94 73.05 3.02 125.66 72.74 3.00 124.30 3 0 10.84 -999 ? ZN ZN H3004 >PHE^H 195 79.19 1.78 122.27 81.40 0.14 122.64 80.30 0.96 122.46 3 0 13.48 -999 ? ZN ZN H3004 >ARG.H 196 75.60 -1.30 128.96 77.46 -0.16 131.07 76.53 -0.73 130.01 2 0 6.69 -999 ? ZN ZN H3004 >PRO.H 197 80.59 -0.06 126.54 79.33 1.58 127.42 79.96 0.76 126.98 3 0 9.66 -999 ? ZN ZN H3004 >GLY.H 198 80.84 4.97 129.64 80.45 4.60 130.18 80.65 4.79 129.91 1 0 6.88 -999 ? ZN ZN H3004 >HIS.H 199 79.16 4.91 135.54 78.07 5.75 137.12 78.61 5.33 136.33 3 0 -3.35 -999 ? ZN ZN H3004s >GLU.H 200 80.29 9.81 136.24 78.36 8.92 136.23 79.33 9.36 136.24 2 0 4.65 -999 ? ZN ZN H3004 >THR.H 201 83.56 7.00 137.51 82.00 6.43 138.91 82.78 6.72 138.21 2 0 7.67 -999 ? ZN ZN H3004 >TYR.H 202 83.94 2.63 136.17 82.38 1.61 138.19 83.16 2.12 137.18 3 0 8.46 -999 ? ZN ZN H3004 >PRO~H 203 89.64 3.89 133.82 87.80 4.97 133.22 88.72 4.43 133.52 3 0 12.90 -999 ? ZN ZN H3004 >THR~H 204 86.07 3.51 129.95 84.04 2.68 130.02 85.05 3.10 129.98 2 0 9.65 -999 ? ZN ZN H3004 >TYR~H 205 84.63 7.33 127.10 81.85 6.88 127.00 83.24 7.11 127.05 3 0 10.52 -999 ? ZN ZN H3004 >HIS~H 206 91.27 7.08 129.59 91.31 9.10 130.14 91.29 8.09 129.86 3 0 16.27 -999 ? ZN ZN H3004 >HIS~H 207 89.08 -0.45 126.77 89.44 -2.45 126.22 89.26 -1.45 126.50 3 0 16.99 -999 ? ZN ZN H3004 >PRO~H 208 92.76 -0.11 123.91 91.21 1.46 123.77 91.98 0.67 123.84 3 0 19.82 -999 ? ZN ZN H3004 >ASP~H 209 88.30 -2.24 122.44 89.71 -3.70 121.79 89.00 -2.97 122.11 2 0 20.81 -999 ? ZN ZN H3004 >VAL~H 210 85.78 1.37 123.18 84.92 1.84 125.11 85.35 1.61 124.15 3 0 14.46 -999 ? ZN ZN H3004 >LEU~H 211 88.69 4.91 121.68 89.07 6.45 123.14 88.88 5.68 122.41 3 0 17.68 -999 ? ZN ZN H3004 >LYS~H 212 87.87 2.28 118.18 89.90 -0.04 114.00 88.89 1.12 116.09 2 0 25.33 -999 ? ZN ZN H3004 >VAL~H 213 84.17 1.26 118.20 82.87 -0.15 119.19 83.52 0.56 118.70 3 0 18.12 -999 ? ZN ZN H3004 >ILE~H 214 83.47 5.86 119.65 83.11 6.68 120.78 83.29 6.27 120.21 3 0 16.01 -999 ? ZN ZN H3004 >ALA~H 215 85.35 5.91 115.55 86.78 5.80 115.51 86.06 5.86 115.53 2 0 21.80 -999 ? ZN ZN H3004 >ASN~H 216 84.09 1.53 113.79 86.00 0.64 113.78 85.04 1.09 113.79 2 0 23.45 -999 ? ZN ZN H3004 >ALA~H 217 80.50 4.12 114.34 79.91 4.11 115.72 80.20 4.11 115.03 2 0 19.14 -999 ? ZN ZN H3004 >VAL~H 218 81.19 7.72 113.37 82.24 9.42 114.24 81.72 8.57 113.81 3 0 21.62 -999 ? ZN ZN H3004 >ARG~H 219 85.11 4.43 108.11 86.90 3.99 110.62 86.01 4.21 109.37 2 0 26.23 -999 ? ZN ZN H3004 >TRP~H 220 77.21 1.40 109.39 74.63 2.85 111.93 75.92 2.12 110.66 3 0 23.96 -999 ? ZN ZN H3004 >ALA~H 221 76.86 6.92 110.61 76.72 7.37 112.08 76.79 7.14 111.35 2 0 22.40 -999 ? ZN ZN H3004 >ALA.H 222 78.09 9.60 108.19 79.42 9.59 107.47 78.76 9.59 107.83 2 0 27.46 -999 ? ZN ZN H3004 >PRO.H 223 75.68 12.99 107.47 75.83 11.01 106.55 75.76 12.00 107.01 3 0 28.16 -999 ? ZN ZN H3004 >VAL.H 224 74.28 9.95 102.74 73.96 7.81 102.27 74.12 8.88 102.51 3 0 30.21 -999 ? ZN ZN G3007 >ASN.H 225 70.82 11.01 100.19 71.36 9.80 98.57 71.09 10.40 99.38 2 0 27.81 -999 ? ZN ZN G3007 >ARG.H 226 73.41 15.80 106.57 74.71 17.54 108.64 74.06 16.67 107.60 2 0 28.48 -999 ? ZN ZN H3004 >GLY.H 227 68.92 17.03 103.21 68.61 16.33 103.53 68.76 16.68 103.37 1 0 26.85 -999 ? ZN ZN E3005 >GLU.H 228 64.23 19.47 101.62 62.23 20.18 101.27 63.23 19.82 101.44 2 0 21.80 -999 ? ZN ZN E3005 >ILE.H 229 62.53 13.64 102.97 62.58 12.28 103.41 62.56 12.96 103.19 3 0 19.84 -999 ? ZN ZN E3005 >VAL.H 230 60.10 15.77 99.68 60.01 16.52 97.63 60.05 16.14 98.66 3 0 18.83 -999 ? ZN ZN E3005 >PHE.H 231 57.56 14.23 103.16 59.43 12.87 104.73 58.49 13.55 103.95 3 0 15.90 -999 ? ZN ZN E3005 >GLY^H 232 53.06 16.21 100.36 53.31 15.63 99.85 53.18 15.92 100.10 1 0 12.21 -999 ? ZN ZN E3005 >ASN^H 233 49.56 17.53 97.35 48.03 17.06 95.92 48.80 17.30 96.63 2 0 11.58 -999 ? ZN ZN E3005 >VAL.H 234 52.00 15.10 94.15 53.35 13.51 95.00 52.67 14.31 94.57 3 0 14.06 -999 ? ZN ZN E3005 >LYS.H 235 50.67 14.78 90.61 51.19 20.17 89.44 50.93 17.48 90.03 2 0 19.31 -999 ? ZN ZN E3005 >PRO.H 236 48.32 12.05 88.21 50.26 11.98 89.34 49.29 12.02 88.77 3 0 16.51 -999 ? ZN ZN E3005 >LEU.H 237 54.29 8.95 87.70 55.81 9.91 88.95 55.05 9.43 88.32 3 0 19.80 -999 ? ZN ZN E3005 >GLU.H 238 51.70 5.54 86.10 53.21 5.27 84.68 52.46 5.41 85.39 2 0 21.27 -999 ? ZN ZN G3007 >PRO.H 239 47.99 7.71 81.70 47.79 8.30 83.91 47.89 8.00 82.80 3 0 21.83 -999 ? ZN ZN E3005 >ILE.H 240 44.15 8.55 87.61 44.29 8.68 88.99 44.22 8.61 88.30 3 0 15.78 -999 ? ZN ZN E3005 >LYS.H 241 41.06 6.52 84.68 39.68 3.20 82.00 40.37 4.86 83.34 2 0 23.31 -999 ? ZN ZN E3005 >ALA.H 242 37.92 8.61 85.33 37.40 9.68 84.35 37.66 9.14 84.84 2 0 20.33 -999 ? ZN ZN E3005 >LYS.H 243 34.81 7.25 87.12 34.90 1.59 84.28 34.86 4.42 85.70 2 0 22.98 -999 ? ZN ZN E3005