#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mop s LEU 20 N 0.00 4.09 0.90 3.17 1.02 -1.26 -4.82 118.68 121.78 3mop s LEU 20 Ca 0.00 2.19 -0.12 0.00 0.02 0.00 0.00 54.13 56.23 3mop s LEU 20 Cb 0.00 -4.18 0.19 0.00 0.02 0.00 0.00 46.19 42.21 3mop s LEU 20 CO 0.00 -0.69 1.24 -2.16 0.02 0.00 0.00 176.35 174.75 3mop s PRO 21 N -2.55 0.87 0.38 1.29 0.04 -1.26 -0.92 135.00 132.85 3mop s PRO 21 Ca 0.60 -0.67 0.13 0.00 0.04 0.00 0.00 61.00 61.10 3mop s PRO 21 Cb -0.26 -1.99 0.74 0.00 0.04 0.00 0.00 34.50 33.04 3mop s PRO 21 CO 0.32 -2.18 1.84 -0.07 0.04 0.00 0.00 177.00 176.95 3mop h LEU 22 N -1.35 0.01 -1.01 -3.56 4.07 -1.82 -2.67 115.31 108.97 3mop h LEU 22 Ca -0.42 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.54 3mop h LEU 22 Cb 1.24 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.98 3mop h LEU 22 CO 0.37 0.36 0.31 0.00 -1.08 0.00 0.00 178.44 178.40 3mop h ALA 23 N 1.64 1.22 -0.70 1.53 0.00 -1.96 -1.38 119.26 119.61 3mop h ALA 23 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3mop h ALA 23 Cb 0.62 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3mop h ALA 23 CO 0.05 -0.22 0.44 0.00 0.00 0.00 0.00 179.25 179.51 3mop h ALA 24 N 1.20 1.46 -3.86 0.00 0.00 -1.82 -3.42 119.26 112.82 3mop h ALA 24 Ca 0.00 -0.07 -0.69 0.00 0.00 0.00 0.00 54.91 54.16 3mop h ALA 24 Cb 0.62 -0.28 -0.31 0.00 0.00 0.00 0.00 17.79 17.82 3mop h ALA 24 CO 0.00 0.48 -0.87 -0.48 0.00 0.00 0.00 179.25 178.38 3mop s LEU 25 N -9.77 2.15 0.25 0.00 2.34 -0.52 -4.58 118.68 108.55 3mop s LEU 25 Ca -0.11 -0.49 -0.05 0.00 0.06 0.00 0.00 54.13 53.54 3mop s LEU 25 Cb 0.17 -1.40 -0.02 0.00 -0.56 0.00 0.00 46.19 44.38 3mop s LEU 25 CO 0.78 0.23 0.33 0.54 -1.06 0.00 0.00 176.35 177.17 3mop s ASN 26 N -0.08 0.31 0.00 1.48 4.22 -1.26 -4.74 114.94 114.87 3mop s ASN 26 Ca -0.06 -1.27 0.00 0.00 -2.14 0.00 0.00 52.86 49.39 3mop s ASN 26 Cb -0.14 0.52 0.00 0.00 1.28 0.00 0.00 41.25 42.90 3mop s ASN 26 CO 0.05 -1.05 0.00 0.23 -2.04 0.00 0.00 177.10 174.29 3mop n MET 27 N -0.39 0.00 0.00 3.55 2.81 -1.26 -1.88 117.12 119.95 3mop n MET 27 Ca 0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 3mop n MET 27 Cb 0.63 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.14 3mop n MET 27 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 3mop n ARG 28 N 0.00 0.00 0.13 0.03 0.63 -1.26 0.35 116.66 116.54 3mop n ARG 28 Ca 0.00 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.79 3mop n ARG 28 Cb 0.00 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 32.83 3mop n ARG 28 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3mop h VAL 29 N 0.00 0.84 -0.56 5.15 2.07 -1.74 -1.04 116.25 120.97 3mop h VAL 29 Ca 0.00 -0.31 0.16 0.00 0.82 0.00 0.00 66.70 67.37 3mop h VAL 29 Cb 0.00 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 3mop h VAL 29 CO 0.00 0.07 0.60 0.03 0.02 0.00 0.00 177.57 178.29 3mop h ARG 30 N -0.45 0.00 0.03 1.57 3.08 -0.21 0.35 114.38 118.76 3mop h ARG 30 Ca -0.03 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 3mop h ARG 30 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 3mop h ARG 30 CO 0.05 0.00 -0.02 0.00 -1.07 0.00 0.00 179.97 178.93 3mop h ARG 31 N 0.00 -0.04 -1.25 0.04 3.08 0.62 -3.16 114.38 113.67 3mop h ARG 31 Ca 0.27 0.00 0.36 0.00 0.07 0.00 0.00 59.98 60.68 3mop h ARG 31 Cb 1.46 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 31.43 3mop h ARG 31 CO -0.00 -0.03 0.85 0.00 -1.07 0.00 0.00 179.97 179.72 3mop h ARG 32 N -0.78 0.15 0.00 0.04 3.08 -0.89 0.80 114.38 116.78 3mop h ARG 32 Ca -0.00 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 3mop h ARG 32 Cb 0.03 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 3mop h ARG 32 CO 0.01 0.10 -0.14 1.25 -1.07 0.00 0.00 179.97 180.11 3mop h LEU 33 N 0.15 0.00 0.00 3.04 7.12 -0.39 -3.07 115.31 122.16 3mop h LEU 33 Ca 0.67 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.68 3mop h LEU 33 Cb 2.24 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 42.37 3mop h LEU 33 CO -0.21 0.14 -0.12 0.28 -0.13 0.00 0.00 178.44 178.41 3mop h SER 34 N 0.00 0.00 -0.32 1.25 0.02 0.64 -2.77 113.55 112.38 3mop h SER 34 Ca -0.00 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 61.07 3mop h SER 34 Cb 0.58 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.07 3mop h SER 34 CO 0.02 0.36 0.12 0.18 -1.14 0.00 0.00 176.83 176.37 3mop n LEU 35 N -3.67 0.06 0.03 5.07 4.77 -0.83 -0.63 117.00 121.80 3mop n LEU 35 Ca -0.02 0.53 -0.19 0.00 -0.03 0.00 0.00 56.01 56.30 3mop n LEU 35 Cb 0.06 -0.24 -0.14 0.00 -2.33 0.00 0.00 43.42 40.77 3mop n LEU 35 CO 0.02 -0.57 0.12 -0.26 -1.33 0.00 0.00 177.39 175.37 3mop h PHE 36 N 0.00 0.46 -0.09 -1.77 -1.00 -1.58 -3.40 116.94 109.57 3mop h PHE 36 Ca 0.24 -0.33 0.00 0.00 2.81 0.00 0.00 57.97 60.70 3mop h PHE 36 Cb 0.61 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 40.15 3mop h PHE 36 CO -0.05 1.24 0.00 1.28 -1.61 0.00 0.00 178.31 179.17 3mop n LEU 37 N -4.21 2.95 0.08 1.54 4.77 0.20 -4.24 117.00 118.08 3mop n LEU 37 Ca -0.13 -1.09 -0.02 0.00 -0.03 0.00 0.00 56.01 54.74 3mop n LEU 37 Cb 0.75 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.74 3mop n LEU 37 CO 0.46 0.52 0.11 0.78 -1.33 0.00 0.00 177.39 177.93 3mop h ASN 38 N 4.35 0.00 -3.36 -1.43 -0.26 -1.21 0.29 115.58 113.96 3mop h ASN 38 Ca 0.00 0.00 -0.59 0.00 -0.56 0.00 0.00 56.30 55.15 3mop h ASN 38 Cb 0.93 0.00 -0.08 0.00 -1.06 0.00 0.00 38.32 38.11 3mop h ASN 38 CO 0.00 0.72 0.67 0.68 -1.06 0.00 0.00 177.43 178.44 3mop s VAL 39 N -2.84 4.62 0.22 2.81 -7.23 -1.26 -4.92 120.40 111.81 3mop s VAL 39 Ca 0.01 1.52 -0.30 0.00 -1.81 0.00 0.00 61.98 61.39 3mop s VAL 39 Cb 0.09 -4.31 -0.09 0.00 0.56 0.00 0.00 36.38 32.62 3mop s VAL 39 CO 0.79 -0.39 1.32 -0.60 -0.31 0.00 0.00 175.10 175.91 3mop s ARG 40 N 3.38 4.37 0.33 4.82 6.06 -1.26 -4.84 118.95 131.81 3mop s ARG 40 Ca 0.40 2.10 0.05 0.00 -2.50 0.00 0.00 55.73 55.78 3mop s ARG 40 Cb -0.13 -3.17 -0.06 0.00 0.06 0.00 0.00 34.95 31.65 3mop s ARG 40 CO 0.14 -0.25 0.03 0.95 -2.50 0.00 0.00 175.30 173.66 3mop s THR 41 N -0.10 1.40 -0.11 4.11 -4.23 -1.26 -5.08 115.64 110.38 3mop s THR 41 Ca 0.56 -2.02 -0.27 0.00 -1.18 0.00 0.00 61.69 58.77 3mop s THR 41 Cb -0.38 -2.75 -0.26 0.00 1.34 0.00 0.00 72.50 70.46 3mop s THR 41 CO 0.41 -0.07 0.86 1.56 -0.54 0.00 0.00 174.62 176.84 3mop h GLN 42 N 2.10 0.05 0.00 3.99 1.08 -2.01 -3.43 115.11 116.89 3mop h GLN 42 Ca -0.41 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 3mop h GLN 42 Cb 1.24 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.70 3mop h GLN 42 CO 0.71 0.96 -0.69 1.33 -0.95 0.00 0.00 178.83 180.19 3mop n VAL 43 N -4.58 0.00 -1.68 -0.54 0.24 -1.26 -5.04 118.33 105.47 3mop n VAL 43 Ca -0.10 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.90 3mop n VAL 43 Cb 0.49 -0.59 0.09 0.00 -1.47 0.00 0.00 33.84 32.36 3mop n VAL 43 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3mop s ALA 44 N -1.66 2.39 -0.20 2.33 0.00 -1.26 -4.99 121.76 118.37 3mop s ALA 44 Ca 0.00 -0.36 -0.23 0.00 0.00 0.00 0.00 51.96 51.37 3mop s ALA 44 Cb 0.00 -3.05 -0.02 0.00 0.00 0.00 0.00 23.12 20.05 3mop s ALA 44 CO 0.00 -1.67 0.72 0.00 0.00 0.00 0.00 175.76 174.82 3mop s ALA 45 N -3.29 3.55 0.56 0.00 0.00 -1.26 -4.61 121.76 116.71 3mop s ALA 45 Ca 0.61 -0.16 0.09 0.00 0.00 0.00 0.00 51.96 52.50 3mop s ALA 45 Cb -0.13 -3.10 0.08 0.00 0.00 0.00 0.00 23.12 19.96 3mop s ALA 45 CO 0.53 -0.65 0.72 0.16 0.00 0.00 0.00 175.76 176.52 3mop s ASP 46 N 1.22 5.05 0.50 0.00 -4.77 -1.26 -4.92 116.67 112.48 3mop s ASP 46 Ca 0.33 -0.90 0.30 0.00 -3.30 0.00 0.00 52.55 48.98 3mop s ASP 46 Cb -0.16 0.28 1.41 0.00 -1.09 0.00 0.00 42.92 43.36 3mop s ASP 46 CO 0.11 -1.28 1.81 4.11 0.70 0.00 0.00 175.17 180.62 3mop h TRP 47 N 0.29 0.19 -0.76 2.11 5.08 -1.26 0.41 115.95 122.00 3mop h TRP 47 Ca -0.31 0.01 -0.04 0.00 1.08 0.00 0.00 58.89 59.62 3mop h TRP 47 Cb 1.29 -0.05 -0.03 0.00 -3.00 0.00 0.00 29.16 27.36 3mop h TRP 47 CO 0.52 0.02 0.30 1.79 -1.28 0.00 0.00 178.44 179.79 3mop h THR 48 N 0.11 1.26 -0.18 0.12 1.35 -1.94 1.10 112.91 114.74 3mop h THR 48 Ca 0.54 -0.81 -0.10 0.00 -0.55 0.00 0.00 66.41 65.49 3mop h THR 48 Cb 1.93 0.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.70 3mop h THR 48 CO -0.09 0.33 -0.33 0.00 -0.25 0.00 0.00 175.52 175.18 3mop h ALA 49 N 1.15 1.11 0.17 6.62 0.00 -1.29 -0.38 119.26 126.64 3mop h ALA 49 Ca 0.25 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3mop h ALA 49 Cb 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3mop h ALA 49 CO -0.02 0.56 -0.08 1.25 0.00 0.00 0.00 179.25 180.96 3mop h LEU 50 N 0.31 -0.19 -1.22 0.00 5.85 -0.92 -2.80 115.31 116.34 3mop h LEU 50 Ca 0.04 0.01 0.41 0.00 0.84 0.00 0.00 57.88 59.17 3mop h LEU 50 Cb 0.73 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.70 3mop h LEU 50 CO 0.06 -0.03 0.80 0.00 -0.34 0.00 0.00 178.44 178.92 3mop n ALA 51 N -2.27 1.20 -0.04 1.25 0.00 0.37 0.43 120.51 121.44 3mop n ALA 51 Ca -0.03 0.70 -0.16 0.00 0.00 0.00 0.00 53.44 53.95 3mop n ALA 51 Cb 0.09 -0.89 -0.07 0.00 0.00 0.00 0.00 19.45 18.58 3mop n ALA 51 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3mop h GLU 52 N 0.00 0.75 0.00 0.00 4.57 -1.15 -2.78 114.58 115.97 3mop h GLU 52 Ca 0.74 -0.57 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 3mop h GLU 52 Cb 2.47 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 31.16 3mop h GLU 52 CO -0.34 1.18 0.00 0.93 -1.18 0.00 0.00 179.01 179.60 3mop h GLU 53 N 0.47 0.00 -0.63 1.92 4.39 0.89 -0.13 114.58 121.50 3mop h GLU 53 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 3mop h GLU 53 Cb 1.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 3mop h GLU 53 CO 0.13 0.00 0.00 -1.33 -1.16 0.00 0.00 179.01 176.65 3mop n MET 54 N -2.81 3.07 -2.67 2.33 2.81 -0.34 -4.95 117.12 114.56 3mop n MET 54 Ca -0.00 -2.34 -0.09 0.00 -1.81 0.00 0.00 57.70 53.47 3mop n MET 54 Cb 0.20 -1.71 0.04 0.00 -0.71 0.00 0.00 33.22 31.04 3mop n MET 54 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3mop n ASP 55 N 1.00 -2.52 -4.73 7.83 8.00 -0.06 -5.05 116.55 121.03 3mop n ASP 55 Ca 0.21 -0.33 -0.29 0.00 0.71 0.00 0.00 54.79 55.09 3mop n ASP 55 Cb 0.70 -2.90 -0.07 0.00 -0.02 0.00 0.00 41.12 38.83 3mop n ASP 55 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3mop s PHE 56 N -3.19 3.05 0.36 1.24 0.40 -1.06 -5.04 117.98 113.75 3mop s PHE 56 Ca 0.05 -0.01 -0.11 0.00 -0.60 0.00 0.00 56.93 56.26 3mop s PHE 56 Cb -0.01 -1.54 -0.07 0.00 0.51 0.00 0.00 43.02 41.92 3mop s PHE 56 CO 0.38 0.50 0.72 -1.83 0.70 0.00 0.00 175.22 175.69 3mop s GLU 57 N -2.54 3.80 0.45 0.44 -1.05 -1.26 -4.70 118.70 113.84 3mop s GLU 57 Ca 0.28 0.43 0.30 0.00 -0.15 0.00 0.00 54.97 55.83 3mop s GLU 57 Cb -0.11 -2.45 1.39 0.00 -0.44 0.00 0.00 34.13 32.52 3mop s GLU 57 CO 0.20 0.05 1.67 -0.92 0.95 0.00 0.00 175.26 177.21 3mop h TYR 58 N 1.58 0.46 0.07 4.83 -0.00 -2.00 0.08 116.97 121.99 3mop h TYR 58 Ca -0.47 0.02 -0.25 0.00 -0.00 0.00 0.00 58.73 58.02 3mop h TYR 58 Cb 1.18 -0.12 -0.01 0.00 -0.00 0.00 0.00 36.73 37.78 3mop h TYR 58 CO 0.61 -0.11 -1.21 1.25 -0.00 0.00 0.00 178.16 178.69 3mop h LEU 59 N 0.14 0.22 -0.47 2.82 6.46 -2.01 -3.01 115.31 119.46 3mop h LEU 59 Ca 0.76 -0.25 -0.15 0.00 -0.12 0.00 0.00 57.88 58.12 3mop h LEU 59 Cb 2.41 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 42.26 3mop h LEU 59 CO -0.32 1.20 -0.33 -0.33 -0.62 0.00 0.00 178.44 178.05 3mop h GLU 60 N 0.04 0.91 -0.68 1.25 5.08 -1.49 -2.76 114.58 116.93 3mop h GLU 60 Ca -0.11 -0.44 -0.03 0.00 -1.00 0.00 0.00 59.36 57.78 3mop h GLU 60 Cb 1.90 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.11 3mop h GLU 60 CO 0.16 1.10 0.31 0.82 -1.00 0.00 0.00 179.01 180.40 3mop h ILE 61 N 0.76 1.23 0.38 3.13 1.08 -1.07 -2.64 117.51 120.39 3mop h ILE 61 Ca 0.08 -0.67 -0.02 0.00 -0.39 0.00 0.00 64.86 63.86 3mop h ILE 61 Cb 0.90 0.42 0.00 0.00 -3.07 0.00 0.00 36.82 35.07 3mop h ILE 61 CO 0.08 0.27 -0.18 -0.09 -0.69 0.00 0.00 178.15 177.54 3mop h ARG 62 N 0.95 -0.49 -0.10 2.37 9.65 -1.38 -0.66 114.38 124.72 3mop h ARG 62 Ca 0.23 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.14 3mop h ARG 62 Cb 0.14 0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.83 3mop h ARG 62 CO -0.03 -0.24 0.00 1.04 2.80 0.00 0.00 179.97 183.55 3mop n GLN 63 N -5.24 0.15 -0.05 0.20 1.13 -1.05 -1.45 117.38 111.07 3mop n GLN 63 Ca -0.10 0.00 -0.06 0.00 -1.94 0.00 0.00 57.00 54.89 3mop n GLN 63 Cb 0.26 -1.05 -0.02 0.00 0.11 0.00 0.00 30.24 29.54 3mop n GLN 63 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3mop n LEU 64 N 0.10 1.67 -2.21 1.08 4.77 -0.29 -4.71 117.00 117.42 3mop n LEU 64 Ca 0.00 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 3mop n LEU 64 Cb 0.02 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.49 3mop n LEU 64 CO 0.00 -0.40 0.00 1.21 -1.33 0.00 0.00 177.39 176.87 3mop n GLU 65 N -4.16 0.00 0.06 3.23 2.13 -0.53 -2.96 120.64 118.42 3mop n GLU 65 Ca -0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.72 3mop n GLU 65 Cb 0.37 -0.45 0.00 0.00 0.27 0.00 0.00 31.44 31.63 3mop n GLU 65 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3mop n THR 66 N 0.88 0.24 -3.24 6.31 -1.04 -1.26 -5.04 114.28 111.13 3mop n THR 66 Ca 0.00 0.08 -0.32 0.00 -2.04 0.00 0.00 64.05 61.77 3mop n THR 66 Cb 0.00 -0.88 -0.05 0.00 -1.82 0.00 0.00 70.33 67.58 3mop n THR 66 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3mop s GLN 67 N -2.00 3.87 1.02 -2.82 0.00 -1.16 -5.06 119.66 113.51 3mop s GLN 67 Ca 0.00 0.43 -0.13 0.00 -0.00 0.00 0.00 55.36 55.66 3mop s GLN 67 Cb 0.00 -2.53 0.13 0.00 0.00 0.00 0.00 33.01 30.61 3mop s GLN 67 CO 0.00 0.21 0.65 0.00 0.00 0.00 0.00 175.29 176.16 3mop n ALA 68 N -0.40 -2.46 -3.16 2.60 0.00 -1.26 -3.92 120.51 111.92 3mop n ALA 68 Ca 0.02 -0.83 -0.14 0.00 0.00 0.00 0.00 53.44 52.48 3mop n ALA 68 Cb 0.53 -1.90 0.07 0.00 0.00 0.00 0.00 19.45 18.15 3mop n ALA 68 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3mop n ASP 69 N -2.91 -3.42 0.12 0.00 4.64 -1.26 -4.85 116.55 108.87 3mop n ASP 69 Ca 0.06 -0.56 0.13 0.00 -1.38 0.00 0.00 54.79 53.04 3mop n ASP 69 Cb 0.55 -4.53 0.37 0.00 -1.04 0.00 0.00 41.12 36.47 3mop n ASP 69 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 3mop h PRO 70 N -1.40 0.00 -0.90 -0.67 0.11 -1.88 -1.31 132.00 125.94 3mop h PRO 70 Ca -0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3mop h PRO 70 Cb 1.28 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.35 3mop h PRO 70 CO 0.41 0.00 0.57 1.79 -0.21 0.00 0.00 178.00 180.57 3mop h THR 71 N 0.00 1.24 -0.76 -1.15 1.35 -1.91 0.29 112.91 111.97 3mop h THR 71 Ca 0.00 -0.48 -0.02 0.00 -0.55 0.00 0.00 66.41 65.36 3mop h THR 71 Cb 0.77 -0.06 -0.04 0.00 -1.73 0.00 0.00 68.15 67.10 3mop h THR 71 CO 0.00 0.24 0.40 1.23 -0.25 0.00 0.00 175.52 177.14 3mop h GLY 72 N 1.23 1.14 0.78 5.82 0.00 -1.66 -1.66 103.07 108.73 3mop h GLY 72 Ca 0.33 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 3mop h GLY 72 CO -0.07 0.51 0.01 3.21 0.00 0.00 0.00 176.54 180.20 3mop h ARG 73 N 1.05 0.05 -0.94 4.80 2.47 -0.95 -2.57 114.38 118.29 3mop h ARG 73 Ca 0.27 -0.01 0.28 0.00 -1.26 0.00 0.00 59.98 59.26 3mop h ARG 73 Cb 0.06 -0.01 -0.16 0.00 -1.65 0.00 0.00 29.97 28.21 3mop h ARG 73 CO -0.04 0.27 0.26 1.25 0.56 0.00 0.00 179.97 182.27 3mop h LEU 74 N -0.17 -0.03 0.39 3.04 5.85 -0.24 -0.14 115.31 124.02 3mop h LEU 74 Ca 0.01 0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 3mop h LEU 74 Cb 0.24 0.31 0.00 0.00 0.37 0.00 0.00 40.66 41.59 3mop h LEU 74 CO 0.00 -0.25 -0.19 -0.07 -0.34 0.00 0.00 178.44 177.59 3mop h LEU 75 N 0.13 -0.44 -1.98 2.25 3.38 -1.08 -1.24 115.31 116.33 3mop h LEU 75 Ca 0.63 -0.13 0.35 0.00 0.09 0.00 0.00 57.88 58.82 3mop h LEU 75 Cb 1.38 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 42.19 3mop h LEU 75 CO -0.74 -0.06 0.86 0.44 0.09 0.00 0.00 178.44 179.02 3mop h ASP 76 N -0.88 0.02 0.33 -0.43 3.45 -1.05 0.85 116.42 118.71 3mop h ASP 76 Ca -0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.41 3mop h ASP 76 Cb 0.55 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.32 3mop h ASP 76 CO 0.09 0.00 -0.81 0.00 -1.57 0.00 0.00 179.24 176.95 3mop n ALA 77 N -2.76 3.85 -0.20 3.45 0.00 -0.11 -3.89 120.51 120.86 3mop n ALA 77 Ca 0.26 -0.44 0.08 0.00 0.00 0.00 0.00 53.44 53.34 3mop n ALA 77 Cb 1.25 -0.97 0.21 0.00 0.00 0.00 0.00 19.45 19.94 3mop n ALA 77 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 3mop n TRP 78 N -1.65 0.63 -0.10 0.00 -0.00 0.24 -4.55 117.44 112.02 3mop n TRP 78 Ca 0.04 -0.47 -0.24 0.00 -0.00 0.00 0.00 57.50 56.84 3mop n TRP 78 Cb 0.37 -0.02 -0.12 0.00 -0.00 0.00 0.00 31.31 31.54 3mop n TRP 78 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3mop n GLN 79 N 0.97 0.63 -0.65 5.87 10.64 -0.87 -4.11 117.38 129.85 3mop n GLN 79 Ca 0.16 0.36 -0.06 0.00 -1.83 0.00 0.00 57.00 55.63 3mop n GLN 79 Cb 0.50 -1.63 -0.08 0.00 -0.86 0.00 0.00 30.24 28.16 3mop n GLN 79 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3mop n GLY 80 N 1.62 2.42 1.35 2.61 0.00 -1.26 -4.71 105.19 107.23 3mop n GLY 80 Ca -0.41 -0.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.94 3mop n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mop n ARG 81 N 2.21 0.21 0.00 1.61 1.74 -1.26 -5.11 116.66 116.06 3mop n ARG 81 Ca 0.21 -1.30 0.00 0.00 -0.77 0.00 0.00 57.85 55.99 3mop n ARG 81 Cb 0.61 1.13 0.00 0.00 -1.02 0.00 0.00 32.46 33.18 3mop n ARG 81 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3mop n PRO 82 N -0.25 0.00 0.00 5.56 -0.04 -1.26 -4.41 135.00 134.59 3mop n PRO 82 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 3mop n PRO 82 Cb 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.71 3mop n PRO 82 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3mop n GLY 83 N 1.85 0.00 0.97 0.55 0.00 -1.26 -4.60 105.19 102.70 3mop n GLY 83 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3mop n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mop n ALA 84 N -2.10 0.21 -2.32 4.61 0.00 -1.26 -4.72 120.51 114.92 3mop n ALA 84 Ca 0.00 -0.29 -0.21 0.00 0.00 0.00 0.00 53.44 52.93 3mop n ALA 84 Cb 0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 19.45 19.09 3mop n ALA 84 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3mop s SER 85 N 0.00 5.03 0.10 0.00 0.15 -1.26 -4.35 113.70 113.37 3mop s SER 85 Ca 0.12 -0.71 -0.13 0.00 0.70 0.00 0.00 55.95 55.93 3mop s SER 85 Cb -0.08 -0.67 -0.17 0.00 -1.71 0.00 0.00 66.02 63.39 3mop s SER 85 CO 0.05 -0.55 1.28 1.62 1.20 0.00 0.00 173.24 176.85 3mop h VAL 86 N 1.15 1.27 -0.10 4.45 3.04 -1.23 -3.13 116.25 121.71 3mop h VAL 86 Ca -0.42 -2.02 0.04 0.00 -1.01 0.00 0.00 66.70 63.28 3mop h VAL 86 Cb 1.26 2.06 -0.04 0.00 -2.01 0.00 0.00 31.29 32.56 3mop h VAL 86 CO 0.59 0.64 -0.14 1.23 -1.01 0.00 0.00 177.57 178.88 3mop h GLY 87 N 0.52 -0.08 0.33 3.17 0.00 -1.95 -0.28 103.07 104.78 3mop h GLY 87 Ca -0.07 0.17 0.08 0.00 0.00 0.00 0.00 47.33 47.51 3mop h GLY 87 CO 0.17 -0.14 0.04 -0.09 0.00 0.00 0.00 176.54 176.52 3mop h ARG 88 N -0.18 0.16 -0.79 4.80 9.65 -1.85 0.24 114.38 126.41 3mop h ARG 88 Ca 0.08 -0.01 0.17 0.00 -1.10 0.00 0.00 59.98 59.13 3mop h ARG 88 Cb 0.30 -0.04 -0.11 0.00 -1.39 0.00 0.00 29.97 28.73 3mop h ARG 88 CO -0.21 0.10 0.27 1.25 2.80 0.00 0.00 179.97 184.19 3mop h LEU 89 N 0.16 0.17 -0.14 3.80 5.85 -1.30 -0.11 115.31 123.75 3mop h LEU 89 Ca 0.23 0.14 -0.07 0.00 0.84 0.00 0.00 57.88 59.02 3mop h LEU 89 Cb 0.32 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 3mop h LEU 89 CO -0.34 0.01 -0.19 -0.07 -0.34 0.00 0.00 178.44 177.51 3mop h LEU 90 N 0.35 0.41 -1.41 2.25 4.07 0.74 -2.35 115.31 119.37 3mop h LEU 90 Ca 0.46 -0.51 -0.05 0.00 0.08 0.00 0.00 57.88 57.85 3mop h LEU 90 Cb 0.80 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 3mop h LEU 90 CO -0.49 0.84 -0.25 1.05 -1.08 0.00 0.00 178.44 178.51 3mop h GLU 91 N -0.01 0.00 0.04 1.13 4.11 -0.02 -2.06 114.58 117.76 3mop h GLU 91 Ca 0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.44 3mop h GLU 91 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3mop h GLU 91 CO 0.04 0.25 -0.02 -0.07 0.07 0.00 0.00 179.01 179.29 3mop h LEU 92 N 0.00 -0.05 -2.00 3.06 3.38 -1.10 -0.86 115.31 117.74 3mop h LEU 92 Ca -0.00 -0.35 0.07 0.00 0.09 0.00 0.00 57.88 57.69 3mop h LEU 92 Cb 0.60 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3mop h LEU 92 CO 0.03 0.33 0.38 -0.07 0.09 0.00 0.00 178.44 179.21 3mop h LEU 93 N -0.44 0.00 0.01 1.67 3.38 -0.81 0.19 115.31 119.31 3mop h LEU 93 Ca -0.01 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.58 3mop h LEU 93 Cb 0.40 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 3mop h LEU 93 CO 0.01 0.00 -2.39 0.41 0.09 0.00 0.00 178.44 176.56 3mop n THR 94 N -3.42 1.50 0.26 0.22 -1.04 -0.97 -1.72 114.28 109.11 3mop n THR 94 Ca 0.03 -0.65 0.09 0.00 -2.04 0.00 0.00 64.05 61.49 3mop n THR 94 Cb 0.51 -1.22 0.68 0.00 -1.82 0.00 0.00 70.33 68.48 3mop n THR 94 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 3mop h LYS 95 N 0.01 0.00 -0.06 -2.82 3.64 -0.75 -1.74 116.57 114.85 3mop h LYS 95 Ca -0.55 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 3mop h LYS 95 Cb 1.99 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.81 3mop h LYS 95 CO -0.04 0.03 0.00 1.28 -2.27 0.00 0.00 179.45 178.45 3mop n LEU 96 N -4.33 1.21 -1.67 5.20 4.77 0.02 -4.93 117.00 117.27 3mop n LEU 96 Ca -0.03 -0.45 -0.19 0.00 -0.03 0.00 0.00 56.01 55.31 3mop n LEU 96 Cb 0.12 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.10 3mop n LEU 96 CO 0.33 0.23 -0.19 0.61 -1.33 0.00 0.00 177.39 177.04 3mop n GLY 97 N 1.10 1.42 2.05 -0.72 0.00 -0.65 -4.54 105.19 103.84 3mop n GLY 97 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 3mop n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mop n ARG 98 N -2.34 2.26 0.01 1.61 5.12 -0.70 -4.58 116.66 118.04 3mop n ARG 98 Ca -0.19 -1.19 0.00 0.00 -1.93 0.00 0.00 57.85 54.54 3mop n ARG 98 Cb 0.62 -2.12 0.02 0.00 -1.16 0.00 0.00 32.46 29.82 3mop n ARG 98 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3mop n ASP 99 N 2.65 0.02 -0.02 0.55 9.92 -1.26 -0.47 116.55 127.94 3mop n ASP 99 Ca 0.48 0.39 -0.13 0.00 -0.53 0.00 0.00 54.79 55.01 3mop n ASP 99 Cb 0.81 -0.39 -0.10 0.00 -0.64 0.00 0.00 41.12 40.80 3mop n ASP 99 CO 0.00 0.00 0.00 -2.24 0.13 0.00 0.00 177.20 175.09 3mop h ASP 100 N 0.00 -0.03 -0.92 -2.24 -0.00 -1.95 -3.05 116.42 108.23 3mop h ASP 100 Ca 0.00 -0.59 0.00 0.00 -0.00 0.00 0.00 57.03 56.45 3mop h ASP 100 Cb 0.25 0.01 -0.05 0.00 -0.00 0.00 0.00 39.33 39.55 3mop h ASP 100 CO 0.00 0.59 0.59 1.62 -0.00 0.00 0.00 179.24 182.04 3mop h VAL 101 N -0.68 1.24 0.00 4.15 3.04 -1.17 -2.73 116.25 120.09 3mop h VAL 101 Ca -0.00 -0.47 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 3mop h VAL 101 Cb 0.62 -0.09 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 3mop h VAL 101 CO 0.01 0.24 0.00 0.18 -1.01 0.00 0.00 177.57 176.99 3mop n LEU 102 N -4.42 0.00 -0.33 3.16 7.99 -1.19 -0.84 117.00 121.36 3mop n LEU 102 Ca 0.10 0.74 0.23 0.00 -0.01 0.00 0.00 56.01 57.07 3mop n LEU 102 Cb 0.03 -0.24 0.43 0.00 -0.11 0.00 0.00 43.42 43.53 3mop n LEU 102 CO 0.37 -0.24 0.91 -0.11 -1.51 0.00 0.00 177.39 176.81 3mop n LEU 103 N -1.60 0.10 0.03 2.23 7.94 -1.15 0.79 117.00 125.35 3mop n LEU 103 Ca 0.00 1.66 -0.10 0.00 -1.11 0.00 0.00 56.01 56.46 3mop n LEU 103 Cb 0.00 -0.70 -0.13 0.00 0.53 0.00 0.00 43.42 43.12 3mop n LEU 103 CO 0.00 -1.77 -0.19 -0.33 -1.11 0.00 0.00 177.39 173.99 3mop h GLU 104 N 0.00 0.05 -0.00 1.96 4.39 -1.40 -3.30 114.58 116.29 3mop h GLU 104 Ca 0.71 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 60.32 3mop h GLU 104 Cb 1.70 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.39 3mop h GLU 104 CO -0.85 0.85 -0.74 1.28 -1.16 0.00 0.00 179.01 178.39 3mop n LEU 105 N -3.27 0.89 -0.10 1.33 4.77 -0.02 -4.66 117.00 115.95 3mop n LEU 105 Ca -0.09 -0.32 -0.03 0.00 -0.03 0.00 0.00 56.01 55.54 3mop n LEU 105 Cb 1.00 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.97 3mop n LEU 105 CO 0.47 0.21 0.45 0.61 -1.33 0.00 0.00 177.39 177.80 3mop n GLY 106 N 1.49 -2.74 0.11 -0.72 0.00 0.24 -0.65 105.19 102.91 3mop n GLY 106 Ca 0.05 0.67 -0.13 0.00 0.00 0.00 0.00 46.02 46.62 3mop n GLY 106 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mop h PRO 107 N 0.00 -0.17 -0.91 1.61 0.13 -1.83 -2.34 132.00 128.50 3mop h PRO 107 Ca 0.04 0.01 0.26 0.00 -0.87 0.00 0.00 66.00 65.44 3mop h PRO 107 Cb 0.09 0.04 -0.04 0.00 0.13 0.00 0.00 31.00 31.23 3mop h PRO 107 CO -0.22 -0.03 0.70 1.03 -0.23 0.00 0.00 178.00 179.25 3mop h SER 108 N -0.27 0.00 0.00 1.44 0.87 -1.67 0.22 113.55 114.13 3mop h SER 108 Ca -0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 3mop h SER 108 Cb 0.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 3mop h SER 108 CO 0.03 0.00 -0.13 0.40 -0.53 0.00 0.00 176.83 176.60 3mop h ILE 109 N 0.00 0.00 -0.90 2.23 2.04 -0.39 -2.74 117.51 117.75 3mop h ILE 109 Ca 0.43 -0.93 0.22 0.00 1.00 0.00 0.00 64.86 65.58 3mop h ILE 109 Cb 1.82 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 37.74 3mop h ILE 109 CO -0.00 0.00 -0.05 -0.08 0.00 0.00 0.00 178.15 178.01 3mop h GLU 110 N -0.93 0.04 0.09 2.37 4.81 -1.10 -0.89 114.58 118.96 3mop h GLU 110 Ca 0.00 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3mop h GLU 110 Cb 0.13 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 3mop h GLU 110 CO 0.00 0.02 -0.33 1.49 -0.73 0.00 0.00 179.01 179.47 3mop h GLU 111 N 0.04 -0.46 0.00 1.92 4.81 -0.70 -2.24 114.58 117.95 3mop h GLU 111 Ca 0.50 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.76 3mop h GLU 111 Cb 0.91 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.40 3mop h GLU 111 CO -0.85 -0.31 0.11 -0.25 -0.73 0.00 0.00 179.01 176.98 3mop n ASP 112 N -4.31 0.00 -0.09 1.04 9.92 -0.38 -1.51 116.55 121.21 3mop n ASP 112 Ca -0.05 0.23 -0.22 0.00 -0.53 0.00 0.00 54.79 54.22 3mop n ASP 112 Cb 0.26 -0.23 -0.12 0.00 -0.64 0.00 0.00 41.12 40.38 3mop n ASP 112 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3mop n GLN 114 N -3.68 0.32 0.00 0.00 -0.06 -0.57 -1.16 117.38 112.22 3mop n GLN 114 Ca -0.42 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.58 3mop n GLN 114 Cb 0.94 -1.31 0.00 0.00 -4.06 0.00 0.00 30.24 25.81 3mop n GLN 114 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 3mop n LYS 115 N 0.76 4.18 -0.04 3.69 5.02 -1.19 -4.30 118.16 126.27 3mop n LYS 115 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.25 3mop n LYS 115 Cb 0.14 -0.35 -0.01 0.00 -0.02 0.00 0.00 35.03 34.79 3mop n LYS 115 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3mop n TYR 116 N 0.00 0.22 -0.18 2.13 9.36 -0.54 -3.49 117.16 124.66 3mop n TYR 116 Ca 0.00 0.10 -0.02 0.00 3.32 0.00 0.00 57.90 61.30 3mop n TYR 116 Cb 0.00 -0.38 0.05 0.00 -0.63 0.00 0.00 39.34 38.39 3mop n TYR 116 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 3mop h ILE 117 N -0.53 0.46 0.00 2.97 5.03 -1.46 -2.58 117.51 121.40 3mop h ILE 117 Ca 0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 64.86 64.73 3mop h ILE 117 Cb 0.41 0.44 0.00 0.00 -3.03 0.00 0.00 36.82 34.64 3mop h ILE 117 CO 0.00 0.00 0.00 0.00 -0.68 0.00 0.00 178.15 177.47 3mop n ALA 118 N -2.90 0.00 -1.00 1.87 0.00 -1.25 -4.32 120.51 112.91 3mop n ALA 118 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3mop n ALA 118 Cb 0.30 0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.97 3mop n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mop n ALA 119 N -1.18 0.00 -2.77 0.00 0.00 -0.99 -4.09 120.51 111.48 3mop n ALA 119 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 3mop n ALA 119 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 3mop n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mop n ALA 120 N -3.00 -0.80 -3.42 0.00 0.00 -1.11 -4.78 120.51 107.40 3mop n ALA 120 Ca 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.27 3mop n ALA 120 Cb 0.00 -1.04 -0.09 0.00 0.00 0.00 0.00 19.45 18.32 3mop n ALA 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3mop s LEU 121 N -4.53 -0.55 0.00 0.00 1.43 -1.26 -4.93 118.68 108.83 3mop s LEU 121 Ca 0.28 0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 3mop s LEU 121 Cb -0.16 1.03 0.00 0.00 0.03 0.00 0.00 46.19 47.09 3mop s LEU 121 CO 0.34 -0.29 0.24 -0.62 0.23 0.00 0.00 176.35 176.26 3mop n GLU 122 N 5.36 0.00 0.00 1.70 4.71 -1.26 -5.08 120.64 126.07 3mop n GLU 122 Ca -0.04 -0.12 0.00 0.00 -0.01 0.00 0.00 57.16 56.99 3mop n GLU 122 Cb 0.50 -0.09 0.00 0.00 -1.01 0.00 0.00 31.44 30.84 3mop n GLU 122 CO 0.00 0.00 0.00 -2.39 0.09 0.00 0.00 177.13 174.83