#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 0.03 -0.05 0.00 -1.32 -1.26 -5.16 115.64 107.88 1wwd s THR 2 Ca 0.00 -0.25 -0.30 0.00 -1.21 0.00 0.00 61.69 59.94 1wwd s THR 2 Cb 0.00 -0.40 0.09 0.00 -1.51 0.00 0.00 72.50 70.67 1wwd s THR 2 CO 0.00 -0.14 0.78 0.54 -2.21 0.00 0.00 174.62 173.59 1wwd s VAL 3 N -0.48 0.00 -0.02 5.08 0.11 -1.26 -5.17 120.40 118.66 1wwd s VAL 3 Ca -0.06 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.03 1wwd s VAL 3 Cb -0.04 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.81 1wwd s VAL 3 CO 0.01 0.00 -0.13 0.54 -3.33 0.00 0.00 175.10 172.19 1wwd s VAL 4 N -1.65 1.06 0.28 2.04 0.11 -1.26 -5.15 120.40 115.84 1wwd s VAL 4 Ca -0.06 -0.55 0.02 0.00 -2.93 0.00 0.00 61.98 58.46 1wwd s VAL 4 Cb -0.00 -0.90 -0.05 0.00 -1.53 0.00 0.00 36.38 33.90 1wwd s VAL 4 CO 0.03 0.30 0.10 -0.44 -3.33 0.00 0.00 175.10 171.77 1wwd s SER 5 N -0.17 1.54 0.00 3.54 0.01 -1.26 -5.16 113.70 112.19 1wwd s SER 5 Ca 0.02 -1.42 0.00 0.00 1.31 0.00 0.00 55.95 55.86 1wwd s SER 5 Cb -0.07 0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.33 1wwd s SER 5 CO 0.00 -0.74 0.00 0.61 0.41 0.00 0.00 173.24 173.52 1wwd n GLY 6 N -0.54 0.41 3.29 3.44 0.00 -1.26 -5.02 105.19 105.51 1wwd n GLY 6 Ca -0.01 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 1wwd n GLY 6 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wwd s GLN 7 N -2.00 0.80 -0.19 1.61 0.00 -1.26 -5.04 119.66 113.58 1wwd s GLN 7 Ca 0.00 -0.26 0.11 0.00 -0.00 0.00 0.00 55.36 55.21 1wwd s GLN 7 Cb 0.00 0.36 -0.22 0.00 0.00 0.00 0.00 33.01 33.14 1wwd s GLN 7 CO 0.00 -0.25 0.07 0.36 0.00 0.00 0.00 175.29 175.48 1wwd n LYS 8 N 0.89 0.68 -1.25 9.60 0.00 -1.26 -3.47 118.16 123.34 1wwd n LYS 8 Ca -0.20 0.10 0.14 0.00 -0.00 0.00 0.00 58.31 58.35 1wwd n LYS 8 Cb 0.58 -1.57 -0.06 0.00 -0.00 0.00 0.00 35.03 33.98 1wwd n LYS 8 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1wwd n GLN 9 N -2.99 -2.51 -4.22 -1.58 6.02 -1.26 -4.84 117.38 106.00 1wwd n GLN 9 Ca -0.35 1.92 -0.20 0.00 -0.01 0.00 0.00 57.00 58.36 1wwd n GLN 9 Cb 1.09 -3.09 -0.12 0.00 1.02 0.00 0.00 30.24 29.14 1wwd n GLN 9 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wwd s ASP 10 N -6.42 2.00 0.24 1.08 -0.00 -1.26 -5.00 116.67 107.31 1wwd s ASP 10 Ca 0.00 -0.64 0.00 0.00 -0.00 0.00 0.00 52.55 51.91 1wwd s ASP 10 Cb 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 42.92 42.84 1wwd s ASP 10 CO 0.00 -0.02 0.00 0.54 -0.00 0.00 0.00 175.17 175.69 1wwd n ARG 11 N 1.22 0.00 -1.14 8.23 1.74 -1.26 -5.14 116.66 120.31 1wwd n ARG 11 Ca -0.21 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.52 1wwd n ARG 11 Cb 0.54 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 32.07 1wwd n ARG 11 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1wwd n GLN 12 N -3.07 0.16 0.00 5.56 -0.06 -1.26 -4.88 117.38 113.83 1wwd n GLN 12 Ca 0.00 0.10 0.00 0.00 -2.00 0.00 0.00 57.00 55.10 1wwd n GLN 12 Cb 0.00 -1.92 0.00 0.00 -4.06 0.00 0.00 30.24 24.26 1wwd n GLN 12 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1wwd n GLY 13 N 1.48 -0.17 0.00 1.69 0.00 -1.26 -5.17 105.19 101.76 1wwd n GLY 13 Ca 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1wwd n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wwd n GLY 14 N 0.00 -3.22 1.43 -0.02 0.00 -1.26 -4.96 105.19 97.16 1wwd n GLY 14 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1wwd n GLY 14 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wwd n GLU 15 N 0.00 -3.94 0.02 1.61 4.07 -1.26 -5.02 120.64 116.11 1wwd n GLU 15 Ca 0.00 2.99 0.00 0.00 -0.06 0.00 0.00 57.16 60.09 1wwd n GLU 15 Cb 0.00 -3.55 0.00 0.00 -0.06 0.00 0.00 31.44 27.83 1wwd n GLU 15 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 1wwd n ARG 16 N -1.68 0.00 -3.47 5.31 0.00 -1.26 -5.08 116.66 110.48 1wwd n ARG 16 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.52 1wwd n ARG 16 Cb 0.21 -0.29 -0.05 0.00 0.00 0.00 0.00 32.46 32.33 1wwd n ARG 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1wwd s ARG 17 N -2.00 3.80 -1.10 -0.14 6.06 -1.26 -5.02 118.95 119.29 1wwd s ARG 17 Ca 0.00 0.24 -0.07 0.00 -2.50 0.00 0.00 55.73 53.40 1wwd s ARG 17 Cb 0.00 -2.80 0.29 0.00 0.06 0.00 0.00 34.95 32.50 1wwd s ARG 17 CO 0.00 0.42 1.22 0.54 -2.50 0.00 0.00 175.30 174.97 1wwd n ARG 18 N 0.27 3.80 -1.51 5.12 1.74 -1.26 -4.98 116.66 119.84 1wwd n ARG 18 Ca -0.03 -4.49 -0.33 0.00 -0.77 0.00 0.00 57.85 52.23 1wwd n ARG 18 Cb 0.52 -2.53 -0.16 0.00 -1.02 0.00 0.00 32.46 29.27 1wwd n ARG 18 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1wwd n SER 19 N 2.25 -0.03 -4.17 0.55 7.64 -1.26 -0.93 113.62 117.67 1wwd n SER 19 Ca 0.25 -0.20 -0.30 0.00 1.01 0.00 0.00 58.87 59.62 1wwd n SER 19 Cb 0.37 -0.89 -0.08 0.00 -1.01 0.00 0.00 64.21 62.60 1wwd n SER 19 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wwd n GLN 20 N 7.59 -0.88 -2.93 1.43 6.02 -1.26 -4.80 117.38 122.55 1wwd n GLN 20 Ca 0.63 0.08 -0.44 0.00 -0.01 0.00 0.00 57.00 57.26 1wwd n GLN 20 Cb 0.13 -3.20 -0.02 0.00 1.02 0.00 0.00 30.24 28.17 1wwd n GLN 20 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1wwd s LEU 21 N -7.09 5.07 0.49 1.08 0.20 -0.11 -5.00 118.68 113.32 1wwd s LEU 21 Ca 0.04 -2.19 -0.23 0.00 0.69 0.00 0.00 54.13 52.45 1wwd s LEU 21 Cb -0.02 -2.40 -0.08 0.00 -0.43 0.00 0.00 46.19 43.26 1wwd s LEU 21 CO 0.92 -1.01 1.14 0.47 -0.29 0.00 0.00 176.35 177.58 1wwd n ASP 22 N 6.39 1.77 0.13 3.68 8.00 -1.26 -4.81 116.55 130.45 1wwd n ASP 22 Ca 0.26 0.99 0.09 0.00 0.71 0.00 0.00 54.79 56.84 1wwd n ASP 22 Cb 0.48 -1.45 0.48 0.00 -0.02 0.00 0.00 41.12 40.61 1wwd n ASP 22 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1wwd n ARG 23 N -0.38 0.12 -1.61 -1.24 3.00 -1.26 -0.74 116.66 114.55 1wwd n ARG 23 Ca 0.10 0.59 -0.08 0.00 -0.00 0.00 0.00 57.85 58.46 1wwd n ARG 23 Cb 0.42 -1.87 0.09 0.00 0.00 0.00 0.00 32.46 31.10 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 -2.12 3.02 -4.87 6.15 8.00 -1.26 -5.05 116.55 120.43 1wwd n ASP 24 Ca -0.01 -3.39 -0.29 0.00 0.71 0.00 0.00 54.79 51.81 1wwd n ASP 24 Cb 0.05 -0.42 -0.03 0.00 -0.02 0.00 0.00 41.12 40.70 1wwd n ASP 24 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1wwd s GLN 25 N -3.15 2.23 -0.15 -1.24 0.74 0.08 -1.28 119.66 116.91 1wwd s GLN 25 Ca 0.42 -2.18 0.01 0.00 0.05 0.00 0.00 55.36 53.66 1wwd s GLN 25 Cb 0.38 -1.90 -0.00 0.00 1.10 0.00 0.00 33.01 32.59 1wwd s GLN 25 CO -0.03 -0.57 -0.17 0.00 -0.55 0.00 0.00 175.29 173.98 1wwd n ALA 27 N 4.00 5.32 0.07 0.00 0.00 -1.26 -2.27 120.51 126.37 1wwd n ALA 27 Ca -0.19 -2.49 0.00 0.00 0.00 0.00 0.00 53.44 50.76 1wwd n ALA 27 Cb 0.52 -1.46 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 -0.67 -0.82 0.05 0.00 9.36 -1.26 -4.88 117.16 118.95 1wwd n TYR 28 Ca 0.49 0.15 0.08 0.00 3.32 0.00 0.00 57.90 61.93 1wwd n TYR 28 Cb 1.13 0.23 -0.12 0.00 -0.63 0.00 0.00 39.34 39.95 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 -1.99 0.00 -2.80 0.00 5.02 -0.96 -5.06 118.16 112.37 1wwd n LYS 30 Ca -0.02 0.23 -0.33 0.00 -2.02 0.00 0.00 58.31 56.17 1wwd n LYS 30 Cb 0.39 -2.05 -0.06 0.00 -0.02 0.00 0.00 35.03 33.29 1wwd n LYS 30 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1wwd s GLU 31 N -1.23 4.15 -0.24 1.97 2.56 -1.25 -4.72 118.70 119.94 1wwd s GLU 31 Ca 0.00 1.02 -0.05 0.00 0.00 0.00 0.00 54.97 55.94 1wwd s GLU 31 Cb 0.00 -2.21 -0.01 0.00 2.00 0.00 0.00 34.13 33.91 1wwd s GLU 31 CO 0.00 -0.04 0.01 -1.59 -0.56 0.00 0.00 175.26 173.08 1wwd s LYS 32 N -3.29 3.38 0.00 4.30 -2.85 -1.26 0.80 119.74 120.82 1wwd s LYS 32 Ca 0.60 -0.64 0.00 0.00 -1.00 0.00 0.00 55.97 54.94 1wwd s LYS 32 Cb -0.09 -3.17 0.00 0.00 -2.06 0.00 0.00 37.83 32.51 1wwd s LYS 32 CO 0.17 -0.25 0.00 0.41 0.10 0.00 0.00 175.35 175.78 1wwd n GLY 33 N 4.84 3.63 3.89 0.59 0.00 -0.40 -5.01 105.19 112.72 1wwd n GLY 33 Ca -0.17 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 44.95 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 3.33 0.38 1.61 -3.43 -1.26 -4.87 115.29 111.04 1wwd s HIS 34 Ca 0.00 0.02 -0.02 0.00 -0.80 0.00 0.00 55.06 54.27 1wwd s HIS 34 Cb 0.00 -1.57 -0.04 0.00 -1.43 0.00 0.00 32.58 29.55 1wwd s HIS 34 CO 0.00 0.50 0.62 -1.58 -2.00 0.00 0.00 174.74 172.28 1wwd s TRP 35 N -1.84 3.52 0.38 0.38 0.52 -1.26 -3.31 118.94 117.33 1wwd s TRP 35 Ca 0.33 0.51 0.05 0.00 0.02 0.00 0.00 56.10 57.01 1wwd s TRP 35 Cb -0.10 -2.03 0.76 0.00 -1.15 0.00 0.00 33.47 30.95 1wwd s TRP 35 CO 0.27 0.01 2.03 0.00 0.02 0.00 0.00 176.95 179.28 1wwd h ALA 36 N 0.69 1.65 0.00 0.98 0.00 -1.91 0.50 119.26 121.17 1wwd h ALA 36 Ca -0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1wwd h ALA 36 Cb 1.21 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1wwd h ALA 36 CO 0.62 0.31 0.00 1.63 0.00 0.00 0.00 179.25 181.81 1wwd n LYS 37 N -4.46 0.00 -0.57 0.00 5.02 -1.26 -1.37 118.16 115.53 1wwd n LYS 37 Ca 0.06 0.31 0.05 0.00 -2.02 0.00 0.00 58.31 56.71 1wwd n LYS 37 Cb 0.08 -1.50 0.10 0.00 -0.02 0.00 0.00 35.03 33.68 1wwd n LYS 37 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1wwd n ASP 38 N -1.50 1.33 -4.73 4.39 2.03 0.15 -5.06 116.55 113.17 1wwd n ASP 38 Ca 0.03 -2.79 -0.42 0.00 0.52 0.00 0.00 54.79 52.13 1wwd n ASP 38 Cb 0.13 -0.37 -0.03 0.00 -0.72 0.00 0.00 41.12 40.13 1wwd n ASP 38 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wwd n PRO 40 N 3.29 0.75 0.07 0.00 -0.04 -1.26 -2.08 135.00 135.73 1wwd n PRO 40 Ca 0.08 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.65 1wwd n PRO 40 Cb 0.44 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.38 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 -0.96 0.62 -1.68 0.54 4.81 -1.26 -4.93 118.16 115.29 1wwd n LYS 41 Ca 0.17 0.02 -0.35 0.00 -0.87 0.00 0.00 58.31 57.27 1wwd n LYS 41 Cb 0.08 -1.72 0.07 0.00 0.02 0.00 0.00 35.03 33.47 1wwd n LYS 41 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1wwd s LYS 42 N -3.41 2.50 0.91 1.64 1.02 -0.88 -5.00 119.74 116.51 1wwd s LYS 42 Ca -0.03 1.79 -0.12 0.00 0.02 0.00 0.00 55.97 57.63 1wwd s LYS 42 Cb 0.11 -1.87 0.14 0.00 -0.52 0.00 0.00 37.83 35.69 1wwd s LYS 42 CO 0.83 -1.57 1.14 -1.25 -0.92 0.00 0.00 175.35 173.58 1wwd s PRO 43 N -3.68 1.13 0.11 -1.68 0.04 -1.26 -4.98 135.00 124.69 1wwd s PRO 43 Ca 0.76 0.27 -0.31 0.00 0.04 0.00 0.00 61.00 61.76 1wwd s PRO 43 Cb -0.30 -1.84 -0.08 0.00 0.04 0.00 0.00 34.50 32.32 1wwd s PRO 43 CO 0.40 -2.20 1.42 -0.98 0.04 0.00 0.00 177.00 175.69 1wwd s ARG 44 N -5.29 4.30 0.65 4.56 3.03 -1.26 -5.02 118.95 119.91 1wwd s ARG 44 Ca 0.64 2.11 0.01 0.00 2.03 0.00 0.00 55.73 60.53 1wwd s ARG 44 Cb -0.14 -3.28 0.09 0.00 -1.03 0.00 0.00 34.95 30.59 1wwd s ARG 44 CO 0.53 -0.48 0.90 0.20 -1.13 0.00 0.00 175.30 175.32 1wwd s GLY 45 N 1.23 1.78 0.68 3.88 0.00 -1.26 -4.71 107.32 108.92 1wwd s GLY 45 Ca 0.66 -1.66 -0.11 0.00 0.00 0.00 0.00 44.72 43.60 1wwd s GLY 45 CO 0.30 -1.19 0.74 -1.55 0.00 0.00 0.00 173.10 171.40 1wwd n PRO 46 N -2.60 -1.55 -3.49 2.90 -0.04 -1.26 -5.11 135.00 123.85 1wwd n PRO 46 Ca 0.13 -1.17 -0.37 0.00 -0.04 0.00 0.00 63.50 62.05 1wwd n PRO 46 Cb 0.60 -0.92 -0.08 0.00 -0.04 0.00 0.00 33.50 33.06 1wwd n PRO 46 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1wwd s ARG 47 N -4.65 4.16 -0.76 0.54 3.00 -1.26 -4.98 118.95 115.00 1wwd s ARG 47 Ca 0.45 0.05 -0.33 0.00 -1.00 0.00 0.00 55.73 54.90 1wwd s ARG 47 Cb -0.03 -3.52 -0.18 0.00 0.00 0.00 0.00 34.95 31.22 1wwd s ARG 47 CO 0.33 0.03 2.50 0.41 0.00 0.00 0.00 175.30 178.57 1wwd n GLY 48 N 3.95 -0.21 3.73 8.12 0.00 -1.26 -4.89 105.19 114.63 1wwd n GLY 48 Ca -0.11 1.05 -0.30 0.00 0.00 0.00 0.00 46.02 46.66 1wwd n GLY 48 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wwd n PRO 49 N 8.37 -2.24 -3.63 1.61 -0.04 -1.26 -5.10 135.00 132.70 1wwd n PRO 49 Ca 0.57 -1.93 -0.03 0.00 -0.04 0.00 0.00 63.50 62.07 1wwd n PRO 49 Cb 0.12 -1.52 -0.04 0.00 -0.04 0.00 0.00 33.50 32.02 1wwd n PRO 49 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1wwd s ARG 50 N -5.73 0.13 0.37 0.54 1.70 -1.26 -5.12 118.95 109.58 1wwd s ARG 50 Ca 0.74 0.03 -0.25 0.00 -0.47 0.00 0.00 55.73 55.78 1wwd s ARG 50 Cb -0.05 0.06 -0.09 0.00 -0.57 0.00 0.00 34.95 34.31 1wwd s ARG 50 CO 0.54 -0.04 1.06 -1.25 -1.08 0.00 0.00 175.30 174.53 1wwd s PRO 51 N -1.02 4.26 -0.20 3.89 0.04 -1.25 -4.14 135.00 136.58 1wwd s PRO 51 Ca 0.07 1.57 -0.17 0.00 0.04 0.00 0.00 61.00 62.52 1wwd s PRO 51 Cb -0.01 -2.68 -0.07 0.00 0.04 0.00 0.00 34.50 31.78 1wwd s PRO 51 CO -0.07 -0.07 -0.35 0.94 0.04 0.00 0.00 177.00 177.49 1wwd n GLN 52 N 0.19 0.54 -2.64 4.56 7.27 -1.23 -4.99 117.38 121.08 1wwd n GLN 52 Ca 0.04 0.22 -0.04 0.00 0.07 0.00 0.00 57.00 57.28 1wwd n GLN 52 Cb 0.49 -1.44 -0.04 0.00 2.41 0.00 0.00 30.24 31.66 1wwd n GLN 52 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 1wwd n THR 53 N -4.41-12.65 -4.12 1.69 -1.04 -1.26 -5.07 114.28 87.43 1wwd n THR 53 Ca -0.23 2.54 -0.11 0.00 -2.04 0.00 0.00 64.05 64.21 1wwd n THR 53 Cb 0.60 -6.64 -0.09 0.00 -1.82 0.00 0.00 70.33 62.38 1wwd n THR 53 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1wwd s SER 54 N -0.93 0.11 0.27 8.00 0.15 -1.26 -5.10 113.70 114.95 1wwd s SER 54 Ca -0.21 -1.19 0.00 0.00 0.70 0.00 0.00 55.95 55.25 1wwd s SER 54 Cb 0.01 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 1wwd s SER 54 CO 0.79 -0.89 0.00 -0.11 1.20 0.00 0.00 173.24 174.23 1wwd n LEU 55 N -0.25 -5.21 -0.64 3.45 7.94 -1.26 -5.31 117.00 115.72 1wwd n LEU 55 Ca -0.01 2.36 0.13 0.00 -1.11 0.00 0.00 56.01 57.38 1wwd n LEU 55 Cb 0.64 -2.02 0.38 0.00 0.53 0.00 0.00 43.42 42.95 1wwd n LEU 55 CO 0.29 -0.50 0.79 -0.11 -1.11 0.00 0.00 177.39 176.75