#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wwd s THR 2 N 0.00 0.04 -0.15 0.00 2.01 -1.26 -5.15 115.64 111.14 1wwd s THR 2 Ca 0.00 -0.34 0.01 0.00 0.31 0.00 0.00 61.69 61.67 1wwd s THR 2 Cb 0.00 -0.98 0.02 0.00 0.01 0.00 0.00 72.50 71.54 1wwd s THR 2 CO 0.00 -0.19 -0.18 0.54 -0.69 0.00 0.00 174.62 174.10 1wwd s VAL 3 N -2.61 1.80 -0.20 3.82 0.11 -1.26 -5.10 120.40 116.97 1wwd s VAL 3 Ca -0.04 -0.80 -0.10 0.00 -2.93 0.00 0.00 61.98 58.11 1wwd s VAL 3 Cb -0.01 -1.63 0.07 0.00 -1.53 0.00 0.00 36.38 33.28 1wwd s VAL 3 CO -0.03 0.50 0.47 0.54 -3.33 0.00 0.00 175.10 173.25 1wwd s VAL 4 N 1.16 -0.21 -0.21 2.04 0.11 -1.26 -5.16 120.40 116.88 1wwd s VAL 4 Ca -0.01 0.09 -0.36 0.00 -2.93 0.00 0.00 61.98 58.77 1wwd s VAL 4 Cb -0.14 -0.71 0.15 0.00 -1.53 0.00 0.00 36.38 34.16 1wwd s VAL 4 CO -0.07 0.04 1.39 -0.55 -3.33 0.00 0.00 175.10 172.57 1wwd s SER 5 N 1.79 -0.02 0.00 3.54 0.15 -1.26 -5.17 113.70 112.74 1wwd s SER 5 Ca -0.08 -0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1wwd s SER 5 Cb -0.09 0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.25 1wwd s SER 5 CO -0.14 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 174.86 1wwd n GLY 6 N -0.20 2.94 3.38 9.45 0.00 -1.26 -5.18 105.19 114.32 1wwd n GLY 6 Ca -0.01 -0.12 0.02 0.00 0.00 0.00 0.00 46.02 45.92 1wwd n GLY 6 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wwd s GLN 7 N -1.33 0.17 -0.33 1.61 0.74 -1.26 -5.13 119.66 114.13 1wwd s GLN 7 Ca 0.00 0.39 -0.00 0.00 0.05 0.00 0.00 55.36 55.80 1wwd s GLN 7 Cb 0.00 0.19 0.11 0.00 1.10 0.00 0.00 33.01 34.41 1wwd s GLN 7 CO 0.00 -0.05 0.12 0.15 -0.55 0.00 0.00 175.29 174.96 1wwd s LYS 8 N 1.98 0.80 -0.36 1.67 1.02 -1.26 -5.05 119.74 118.55 1wwd s LYS 8 Ca -0.03 -1.23 0.00 0.00 0.02 0.00 0.00 55.97 54.73 1wwd s LYS 8 Cb -0.03 -2.01 0.14 0.00 -0.52 0.00 0.00 37.83 35.40 1wwd s LYS 8 CO -0.16 -1.02 0.22 -1.14 -0.92 0.00 0.00 175.35 172.32 1wwd s GLN 9 N 1.39 0.58 0.01 1.68 -0.44 -1.26 -5.11 119.66 116.52 1wwd s GLN 9 Ca 0.11 -1.37 -0.29 0.00 -2.50 0.00 0.00 55.36 51.31 1wwd s GLN 9 Cb -0.19 -1.34 0.07 0.00 -1.64 0.00 0.00 33.01 29.92 1wwd s GLN 9 CO -0.20 -1.21 0.67 -0.51 0.50 0.00 0.00 175.29 174.54 1wwd s ASP 10 N 1.02 -0.62 0.18 6.67 -0.00 -1.26 -5.18 116.67 117.48 1wwd s ASP 10 Ca 0.18 0.50 -0.14 0.00 -0.00 0.00 0.00 52.55 53.09 1wwd s ASP 10 Cb -0.22 0.55 0.02 0.00 -0.00 0.00 0.00 42.92 43.26 1wwd s ASP 10 CO 0.00 -0.70 0.44 0.00 -0.00 0.00 0.00 175.17 174.91 1wwd s ARG 11 N -1.93 1.29 0.21 8.23 3.03 -1.26 -5.18 118.95 123.34 1wwd s ARG 11 Ca -0.07 -0.97 0.08 0.00 2.03 0.00 0.00 55.73 56.80 1wwd s ARG 11 Cb -0.00 0.47 -0.04 0.00 -1.03 0.00 0.00 34.95 34.35 1wwd s ARG 11 CO 0.03 -0.52 0.03 -0.65 -1.13 0.00 0.00 175.30 173.05 1wwd s GLN 12 N -3.90 2.46 -0.33 3.89 -0.21 -1.26 -5.10 119.66 115.20 1wwd s GLN 12 Ca 0.12 -1.18 -0.09 0.00 0.02 0.00 0.00 55.36 54.23 1wwd s GLN 12 Cb 0.01 -2.34 0.02 0.00 1.00 0.00 0.00 33.01 31.69 1wwd s GLN 12 CO -0.02 0.42 0.14 0.20 -2.12 0.00 0.00 175.29 173.91 1wwd s GLY 13 N -3.26 1.86 0.00 3.09 0.00 -1.26 -4.94 107.32 102.80 1wwd s GLY 13 Ca 0.29 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.44 1wwd s GLY 13 CO 0.20 0.74 0.00 0.61 0.00 0.00 0.00 173.10 174.65 1wwd n GLY 14 N 4.92 3.52 0.21 0.20 0.00 -1.26 -5.05 105.19 107.73 1wwd n GLY 14 Ca -0.13 -0.79 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 1wwd n GLY 14 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1wwd h GLU 15 N 0.00 -0.42 -4.71 1.61 4.57 -2.05 -3.50 114.58 110.08 1wwd h GLU 15 Ca 0.00 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1wwd h GLU 15 Cb 0.00 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 1wwd h GLU 15 CO 0.00 -0.19 -0.95 0.54 -1.18 0.00 0.00 179.01 177.22 1wwd n ARG 16 N -5.07 -5.07 -3.51 1.92 1.74 -1.26 -4.90 116.66 100.51 1wwd n ARG 16 Ca -0.07 3.67 -0.41 0.00 -0.77 0.00 0.00 57.85 60.26 1wwd n ARG 16 Cb 0.22 -4.60 -0.05 0.00 -1.02 0.00 0.00 32.46 27.01 1wwd n ARG 16 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1wwd s ARG 17 N -0.58 3.27 0.00 5.56 3.52 -1.26 -4.51 118.95 124.95 1wwd s ARG 17 Ca 0.00 -2.72 0.00 0.00 -0.13 0.00 0.00 55.73 52.88 1wwd s ARG 17 Cb 0.00 -4.13 0.00 0.00 -1.56 0.00 0.00 34.95 29.26 1wwd s ARG 17 CO 0.00 -1.24 0.00 0.54 -0.81 0.00 0.00 175.30 173.79 1wwd n ARG 18 N 3.38 0.00 -4.34 5.12 1.74 -1.26 -4.97 116.66 116.32 1wwd n ARG 18 Ca 0.14 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.90 1wwd n ARG 18 Cb 0.41 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.76 1wwd n ARG 18 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wwd n SER 19 N 0.00 0.51 -4.15 0.55 2.88 -1.26 0.32 113.62 112.47 1wwd n SER 19 Ca 0.00 -1.27 -0.35 0.00 -1.33 0.00 0.00 58.87 55.92 1wwd n SER 19 Cb 0.00 -1.63 -0.05 0.00 -0.75 0.00 0.00 64.21 61.78 1wwd n SER 19 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1wwd n GLN 20 N -4.51 -0.67 -1.52 -1.46 7.27 -1.26 -4.53 117.38 110.70 1wwd n GLN 20 Ca -0.26 0.06 -0.29 0.00 0.07 0.00 0.00 57.00 56.57 1wwd n GLN 20 Cb 0.66 -2.90 -0.13 0.00 2.41 0.00 0.00 30.24 30.28 1wwd n GLN 20 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1wwd n LEU 21 N -4.55 0.47 -4.77 1.69 0.00 0.15 -4.82 117.00 105.17 1wwd n LEU 21 Ca -0.23 -0.48 -0.41 0.00 0.00 0.00 0.00 56.01 54.89 1wwd n LEU 21 Cb 0.60 -1.08 -0.01 0.00 0.00 0.00 0.00 43.42 42.93 1wwd n LEU 21 CO 0.76 -1.46 1.10 -1.81 0.00 0.00 0.00 177.39 175.98 1wwd s ASP 22 N 7.41 6.50 0.15 1.96 1.01 -1.26 -4.84 116.67 127.59 1wwd s ASP 22 Ca 1.19 2.90 0.13 0.00 0.71 0.00 0.00 52.55 57.48 1wwd s ASP 22 Cb -0.71 -2.65 0.64 0.00 1.01 0.00 0.00 42.92 41.20 1wwd s ASP 22 CO 0.39 -0.77 1.40 -1.14 0.21 0.00 0.00 175.17 175.27 1wwd n ARG 23 N 0.93 0.08 -0.52 8.23 3.00 -1.26 -0.52 116.66 126.60 1wwd n ARG 23 Ca 0.02 0.50 0.06 0.00 -0.00 0.00 0.00 57.85 58.44 1wwd n ARG 23 Cb 0.40 -1.72 0.20 0.00 0.00 0.00 0.00 32.46 31.34 1wwd n ARG 23 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1wwd n ASP 24 N -1.87 1.88 -4.14 6.15 9.92 -1.26 -4.97 116.55 122.26 1wwd n ASP 24 Ca 0.00 -3.76 -0.33 0.00 -0.53 0.00 0.00 54.79 50.17 1wwd n ASP 24 Cb 0.07 -0.52 -0.15 0.00 -0.64 0.00 0.00 41.12 39.88 1wwd n ASP 24 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1wwd s GLN 25 N -3.18 2.85 0.24 -1.24 -0.21 0.32 0.04 119.66 118.49 1wwd s GLN 25 Ca 0.37 -0.94 -0.31 0.00 0.02 0.00 0.00 55.36 54.50 1wwd s GLN 25 Cb 0.36 -2.74 -0.12 0.00 1.00 0.00 0.00 33.01 31.51 1wwd s GLN 25 CO -0.05 -0.31 1.64 0.00 -2.12 0.00 0.00 175.29 174.45 1wwd n ALA 27 N 3.07 4.61 0.03 0.00 0.00 -1.26 -1.94 120.51 125.02 1wwd n ALA 27 Ca 0.13 -2.16 0.00 0.00 0.00 0.00 0.00 53.44 51.41 1wwd n ALA 27 Cb 0.35 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1wwd n ALA 27 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1wwd n TYR 28 N -0.38 -0.37 0.28 0.00 9.36 -1.26 -4.86 117.16 119.93 1wwd n TYR 28 Ca 0.41 0.07 0.05 0.00 3.32 0.00 0.00 57.90 61.75 1wwd n TYR 28 Cb 1.34 0.19 -0.07 0.00 -0.63 0.00 0.00 39.34 40.18 1wwd n TYR 28 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1wwd n LYS 30 N -1.51 0.00 -1.59 0.00 4.76 -0.82 -5.00 118.16 114.00 1wwd n LYS 30 Ca 0.00 0.00 -0.59 0.00 -2.87 0.00 0.00 58.31 54.86 1wwd n LYS 30 Cb 0.21 -0.08 -0.08 0.00 -1.84 0.00 0.00 35.03 33.24 1wwd n LYS 30 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1wwd n GLU 31 N -0.56 0.42 -3.38 1.97 -0.58 -1.26 -3.30 120.64 113.95 1wwd n GLU 31 Ca 0.00 0.15 -0.38 0.00 -0.42 0.00 0.00 57.16 56.51 1wwd n GLU 31 Cb 0.00 -1.71 -0.06 0.00 -0.57 0.00 0.00 31.44 29.10 1wwd n GLU 31 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 1wwd s LYS 32 N 1.00 4.15 0.00 3.49 0.00 -1.26 0.20 119.74 127.32 1wwd s LYS 32 Ca 0.92 0.48 0.00 0.00 0.00 0.00 0.00 55.97 57.37 1wwd s LYS 32 Cb -1.20 -3.32 0.00 0.00 0.00 0.00 0.00 37.83 33.31 1wwd s LYS 32 CO 0.59 0.45 0.00 0.41 0.00 0.00 0.00 175.35 176.80 1wwd n GLY 33 N 2.45 3.81 3.67 0.59 0.00 0.11 -4.93 105.19 110.89 1wwd n GLY 33 Ca -0.10 -0.82 -0.26 0.00 0.00 0.00 0.00 46.02 44.84 1wwd n GLY 33 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1wwd s HIS 34 N 0.00 2.83 0.43 1.61 -3.43 -1.26 -4.98 115.29 110.49 1wwd s HIS 34 Ca 0.00 -0.15 -0.07 0.00 -0.80 0.00 0.00 55.06 54.04 1wwd s HIS 34 Cb 0.00 -1.35 -0.05 0.00 -1.43 0.00 0.00 32.58 29.75 1wwd s HIS 34 CO 0.00 0.53 0.75 -1.58 -2.00 0.00 0.00 174.74 172.44 1wwd s TRP 35 N -1.84 3.52 0.42 0.38 0.52 -1.26 -3.41 118.94 117.27 1wwd s TRP 35 Ca 0.28 0.86 0.10 0.00 0.02 0.00 0.00 56.10 57.37 1wwd s TRP 35 Cb -0.09 -2.32 0.93 0.00 -1.15 0.00 0.00 33.47 30.85 1wwd s TRP 35 CO 0.19 -0.16 2.02 0.00 0.02 0.00 0.00 176.95 179.02 1wwd h ALA 36 N 0.76 1.85 0.00 0.98 0.00 -1.91 0.56 119.26 121.50 1wwd h ALA 36 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1wwd h ALA 36 Cb 1.20 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1wwd h ALA 36 CO 0.63 0.08 0.00 0.87 0.00 0.00 0.00 179.25 180.83 1wwd h LYS 37 N 0.50 0.00 -0.02 0.00 1.57 -1.99 -1.16 116.57 115.47 1wwd h LYS 37 Ca 0.21 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1wwd h LYS 37 Cb 0.22 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 1wwd h LYS 37 CO -0.06 0.00 -0.14 -3.47 -0.57 0.00 0.00 179.45 175.21 1wwd n ASP 38 N -2.93 2.23 -4.69 0.86 -0.08 0.17 -5.03 116.55 107.08 1wwd n ASP 38 Ca -0.01 -3.34 -0.42 0.00 -1.51 0.00 0.00 54.79 49.52 1wwd n ASP 38 Cb 0.20 -0.47 -0.03 0.00 2.34 0.00 0.00 41.12 43.16 1wwd n ASP 38 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wwd n PRO 40 N 5.62 0.75 -0.00 0.00 -0.04 -1.26 -2.01 135.00 138.06 1wwd n PRO 40 Ca 0.16 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.73 1wwd n PRO 40 Cb 0.40 -1.49 -0.15 0.00 -0.04 0.00 0.00 33.50 32.22 1wwd n PRO 40 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1wwd n LYS 41 N -0.99 0.56 -4.15 0.54 4.81 -1.26 -4.94 118.16 112.73 1wwd n LYS 41 Ca 0.18 -0.15 -0.27 0.00 -0.87 0.00 0.00 58.31 57.19 1wwd n LYS 41 Cb 0.08 -1.53 -0.07 0.00 0.02 0.00 0.00 35.03 33.52 1wwd n LYS 41 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 1wwd s LYS 42 N -3.44 2.58 0.00 1.64 -2.85 -0.85 -5.13 119.74 111.69 1wwd s LYS 42 Ca -0.05 -0.98 0.00 0.00 -1.00 0.00 0.00 55.97 53.94 1wwd s LYS 42 Cb 0.14 -2.48 0.00 0.00 -2.06 0.00 0.00 37.83 33.43 1wwd s LYS 42 CO 0.90 0.48 0.00 -0.35 0.10 0.00 0.00 175.35 176.48 1wwd n PRO 43 N -0.03 0.63 -3.38 1.78 -0.04 -1.26 -4.76 135.00 127.94 1wwd n PRO 43 Ca -0.09 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.16 1wwd n PRO 43 Cb 0.54 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.91 1wwd n PRO 43 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1wwd s ARG 44 N -0.74 0.65 0.06 0.54 6.06 -1.26 -4.94 118.95 119.31 1wwd s ARG 44 Ca 0.00 -1.11 -0.21 0.00 -2.50 0.00 0.00 55.73 51.91 1wwd s ARG 44 Cb 0.00 -0.93 0.07 0.00 0.06 0.00 0.00 34.95 34.15 1wwd s ARG 44 CO 0.00 -1.22 0.98 0.41 -2.50 0.00 0.00 175.30 172.97 1wwd n GLY 45 N 4.03 0.47 0.09 8.12 0.00 -1.26 -4.86 105.19 111.78 1wwd n GLY 45 Ca 0.13 -1.06 -0.12 0.00 0.00 0.00 0.00 46.02 44.98 1wwd n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wwd h PRO 46 N 0.00 -0.08 -2.46 1.61 0.13 -2.08 -3.52 132.00 125.60 1wwd h PRO 46 Ca -0.20 0.01 0.11 0.00 -0.87 0.00 0.00 66.00 65.05 1wwd h PRO 46 Cb 1.00 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.08 1wwd h PRO 46 CO 0.28 0.52 -0.76 -2.13 -0.23 0.00 0.00 178.00 175.68 1wwd n ARG 47 N -4.80 -2.55 0.00 0.86 0.63 -1.26 -5.10 116.66 104.45 1wwd n ARG 47 Ca -0.08 2.02 0.00 0.00 -0.92 0.00 0.00 57.85 58.87 1wwd n ARG 47 Cb 0.31 -2.68 0.00 0.00 0.45 0.00 0.00 32.46 30.54 1wwd n ARG 47 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1wwd n GLY 48 N -2.88 3.63 3.80 5.14 0.00 -1.26 -5.06 105.19 108.56 1wwd n GLY 48 Ca -0.03 -1.77 -0.34 0.00 0.00 0.00 0.00 46.02 43.87 1wwd n GLY 48 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wwd s PRO 49 N -3.28 3.84 -0.02 1.61 0.04 -1.26 -4.43 135.00 131.50 1wwd s PRO 49 Ca 0.00 1.37 -0.00 0.00 0.04 0.00 0.00 61.00 62.41 1wwd s PRO 49 Cb 0.00 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1wwd s PRO 49 CO 0.00 -0.40 0.00 0.54 0.04 0.00 0.00 177.00 177.18 1wwd n ARG 50 N -0.89 -0.68 -2.15 4.56 1.74 -1.26 -4.89 116.66 113.09 1wwd n ARG 50 Ca 0.09 1.00 -0.33 0.00 -0.77 0.00 0.00 57.85 57.84 1wwd n ARG 50 Cb 0.52 -1.25 -0.00 0.00 -1.02 0.00 0.00 32.46 30.71 1wwd n ARG 50 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1wwd s PRO 51 N -0.86 3.46 0.21 5.56 0.04 -1.26 -4.77 135.00 137.38 1wwd s PRO 51 Ca -0.00 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.23 1wwd s PRO 51 Cb 0.00 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1wwd s PRO 51 CO 0.06 -0.70 0.00 0.94 0.04 0.00 0.00 177.00 177.34 1wwd n GLN 52 N -1.83 -4.52 -3.12 4.56 7.27 -1.26 -4.87 117.38 113.60 1wwd n GLN 52 Ca 0.09 3.28 -0.36 0.00 0.07 0.00 0.00 57.00 60.08 1wwd n GLN 52 Cb 0.53 -3.48 -0.03 0.00 2.41 0.00 0.00 30.24 29.67 1wwd n GLN 52 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1wwd n THR 53 N 1.22 4.18 -3.35 1.69 -2.24 -1.26 -4.92 114.28 109.60 1wwd n THR 53 Ca 0.00 -5.67 0.02 0.00 -2.27 0.00 0.00 64.05 56.14 1wwd n THR 53 Cb 0.00 -2.00 -0.03 0.00 -2.10 0.00 0.00 70.33 66.20 1wwd n THR 53 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1wwd s SER 54 N -2.13 -0.83 0.29 3.42 0.15 -1.26 -5.05 113.70 108.28 1wwd s SER 54 Ca 0.36 0.87 0.00 0.00 0.70 0.00 0.00 55.95 57.88 1wwd s SER 54 Cb 0.11 1.84 0.00 0.00 -1.71 0.00 0.00 66.02 66.26 1wwd s SER 54 CO 0.03 -0.16 0.00 -0.11 1.20 0.00 0.00 173.24 174.20 1wwd n LEU 55 N 5.26 -2.36 0.00 3.45 0.00 -1.26 -5.22 117.00 116.88 1wwd n LEU 55 Ca -0.08 0.55 0.00 0.00 0.00 0.00 0.00 56.01 56.48 1wwd n LEU 55 Cb 0.52 2.36 0.00 0.00 0.00 0.00 0.00 43.42 46.30 1wwd n LEU 55 CO -0.04 -0.08 0.00 0.18 0.00 0.00 0.00 177.39 177.44