#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdj s PRO 2 N 0.00 1.89 0.52 0.03 0.04 -1.26 -4.82 135.00 131.40 2wdj s PRO 2 Ca 0.00 0.29 -0.21 0.00 0.04 0.00 0.00 61.00 61.12 2wdj s PRO 2 Cb 0.00 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.55 2wdj s PRO 2 CO 0.00 -1.68 1.17 0.50 0.04 0.00 0.00 177.00 177.03 2wdj s ARG 3 N -5.40 3.42 -0.07 4.56 3.52 -0.88 -2.90 118.95 121.20 2wdj s ARG 3 Ca 0.62 1.74 0.02 0.00 -0.13 0.00 0.00 55.73 57.97 2wdj s ARG 3 Cb -0.13 -2.14 0.01 0.00 -1.56 0.00 0.00 34.95 31.14 2wdj s ARG 3 CO 0.51 -0.83 -0.11 -1.17 -0.81 0.00 0.00 175.30 172.90 2wdj s LEU 4 N -3.56 1.58 -0.24 -0.88 0.20 0.48 -1.56 118.68 114.68 2wdj s LEU 4 Ca 0.70 -0.28 0.02 0.00 0.69 0.00 0.00 54.13 55.27 2wdj s LEU 4 Cb -0.27 -0.78 0.05 0.00 -0.43 0.00 0.00 46.19 44.76 2wdj s LEU 4 CO 0.32 0.01 -0.11 -0.75 -0.29 0.00 0.00 176.35 175.53 2wdj s LYS 5 N 0.76 2.21 -0.12 1.98 2.20 0.13 0.71 119.74 127.61 2wdj s LYS 5 Ca -0.13 -1.21 -0.04 0.00 -0.36 0.00 0.00 55.97 54.23 2wdj s LYS 5 Cb -0.15 -2.78 -0.03 0.00 -1.51 0.00 0.00 37.83 33.35 2wdj s LYS 5 CO 0.03 -0.53 0.03 0.14 -0.36 0.00 0.00 175.35 174.65 2wdj s VAL 6 N 1.18 4.52 -0.18 4.02 -7.23 -1.01 -2.12 120.40 119.58 2wdj s VAL 6 Ca -0.07 -0.15 0.00 0.00 -1.81 0.00 0.00 61.98 59.95 2wdj s VAL 6 Cb -0.19 -2.95 0.04 0.00 0.56 0.00 0.00 36.38 33.84 2wdj s VAL 6 CO -0.06 0.56 -0.09 -0.75 -0.31 0.00 0.00 175.10 174.45 2wdj s LYS 7 N -0.49 1.85 0.05 4.82 2.20 -0.83 -1.03 119.74 126.31 2wdj s LYS 7 Ca 0.09 -0.69 -0.31 0.00 -0.36 0.00 0.00 55.97 54.70 2wdj s LYS 7 Cb -0.12 -2.23 -0.07 0.00 -1.51 0.00 0.00 37.83 33.90 2wdj s LYS 7 CO 0.02 -0.41 1.52 -1.17 -0.36 0.00 0.00 175.35 174.95 2wdj s LEU 8 N 1.49 4.34 0.00 5.43 1.98 -0.93 -2.17 118.68 128.82 2wdj s LEU 8 Ca 0.00 2.31 0.00 0.00 -2.89 0.00 0.00 54.13 53.56 2wdj s LEU 8 Cb -0.15 -3.57 0.00 0.00 0.66 0.00 0.00 46.19 43.13 2wdj s LEU 8 CO -0.08 -0.79 0.00 1.33 -1.89 0.00 0.00 176.35 174.92 2wdj n VAL 9 N 4.60 0.00 -3.25 1.68 0.24 -0.45 -1.86 118.33 119.28 2wdj n VAL 9 Ca 0.14 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 62.05 2wdj n VAL 9 Cb 0.42 -0.86 -0.06 0.00 -1.47 0.00 0.00 33.84 31.86 2wdj n VAL 9 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2wdj s LYS 10 N -1.90 4.27 0.43 7.34 2.20 -0.08 -4.83 119.74 127.17 2wdj s LYS 10 Ca 0.00 0.48 -0.26 0.00 -0.36 0.00 0.00 55.97 55.83 2wdj s LYS 10 Cb 0.00 -3.50 -0.09 0.00 -1.51 0.00 0.00 37.83 32.73 2wdj s LYS 10 CO 0.00 -0.01 1.45 0.45 -0.36 0.00 0.00 175.35 176.88 2wdj s SER 11 N 0.91 6.02 0.22 1.43 0.15 -1.26 -4.74 113.70 116.42 2wdj s SER 11 Ca 0.26 2.98 0.26 0.00 0.70 0.00 0.00 55.95 60.14 2wdj s SER 11 Cb -0.15 -2.66 0.85 0.00 -1.71 0.00 0.00 66.02 62.35 2wdj s SER 11 CO 0.11 -1.09 1.77 -0.81 1.20 0.00 0.00 173.24 174.41 2wdj n PRO 12 N 0.01 0.25 -1.52 5.44 -0.04 -1.26 -4.84 135.00 133.03 2wdj n PRO 12 Ca 0.04 0.26 -0.34 0.00 -0.04 0.00 0.00 63.50 63.41 2wdj n PRO 12 Cb 0.41 -1.82 -0.11 0.00 -0.04 0.00 0.00 33.50 31.94 2wdj n PRO 12 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2wdj n ILE 13 N -2.25 -0.03 0.00 0.52 -0.00 -1.26 0.42 119.36 116.76 2wdj n ILE 13 Ca 0.05 -0.39 0.00 0.00 -0.00 0.00 0.00 62.75 62.41 2wdj n ILE 13 Cb 0.39 -1.36 0.00 0.00 -0.00 0.00 0.00 39.64 38.66 2wdj n ILE 13 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2wdj n GLY 14 N 6.24 1.14 3.94 7.39 0.00 -1.26 -5.10 105.19 117.53 2wdj n GLY 14 Ca 0.55 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.29 2wdj n GLY 14 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wdj s TYR 15 N -2.00 3.49 0.29 1.61 1.51 0.17 -5.06 117.35 117.36 2wdj s TYR 15 Ca 0.00 0.16 -0.26 0.00 -1.01 0.00 0.00 57.07 55.96 2wdj s TYR 15 Cb 0.00 -1.69 -0.15 0.00 -0.11 0.00 0.00 41.96 40.00 2wdj s TYR 15 CO 0.00 0.54 0.55 -2.30 -1.11 0.00 0.00 175.55 173.23 2wdj n PRO 16 N -0.29 0.35 -0.33 -1.71 -0.02 -1.26 -4.70 135.00 127.04 2wdj n PRO 16 Ca -0.06 0.12 0.11 0.00 -2.02 0.00 0.00 63.50 61.65 2wdj n PRO 16 Cb 0.53 -1.24 0.29 0.00 -0.02 0.00 0.00 33.50 33.06 2wdj n PRO 16 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2wdj h LYS 17 N 1.04 0.65 -0.09 -0.52 6.56 -1.97 -0.64 116.57 121.60 2wdj h LYS 17 Ca -0.34 -0.04 0.01 0.00 -1.06 0.00 0.00 60.65 59.22 2wdj h LYS 17 Cb 1.42 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 32.92 2wdj h LYS 17 CO 0.55 0.43 0.02 0.38 -2.06 0.00 0.00 179.45 178.77 2wdj h ASP 18 N 0.67 0.02 -0.95 0.86 2.03 -1.95 0.62 116.42 117.71 2wdj h ASP 18 Ca 0.54 0.01 0.03 0.00 -0.73 0.00 0.00 57.03 56.88 2wdj h ASP 18 Cb 0.86 0.01 -0.05 0.00 -0.83 0.00 0.00 39.33 39.32 2wdj h ASP 18 CO -0.40 0.02 0.63 1.56 -1.03 0.00 0.00 179.24 180.02 2wdj h GLN 19 N 0.06 1.20 -0.98 4.15 4.20 -1.51 0.00 115.11 122.23 2wdj h GLN 19 Ca 0.04 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.70 2wdj h GLN 19 Cb 0.03 -0.27 -0.05 0.00 0.30 0.00 0.00 27.48 27.49 2wdj h GLN 19 CO -0.05 0.79 0.65 0.87 -0.67 0.00 0.00 178.83 180.42 2wdj h LYS 20 N 1.23 1.26 -0.46 1.46 1.57 -0.53 0.25 116.57 121.36 2wdj h LYS 20 Ca 0.37 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2wdj h LYS 20 Cb -0.04 -0.29 0.00 0.00 0.08 0.00 0.00 32.23 31.98 2wdj h LYS 20 CO -0.11 0.84 0.00 0.00 -0.57 0.00 0.00 179.45 179.61 2wdj n ALA 21 N -2.38 2.58 -0.04 3.86 0.00 0.15 -3.03 120.51 121.65 2wdj n ALA 21 Ca 0.12 -0.25 0.02 0.00 0.00 0.00 0.00 53.44 53.32 2wdj n ALA 21 Cb 0.04 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.35 2wdj n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wdj n ALA 22 N -0.04 2.21 0.15 0.00 0.00 0.07 -4.17 120.51 118.73 2wdj n ALA 22 Ca 0.04 -0.76 0.10 0.00 0.00 0.00 0.00 53.44 52.82 2wdj n ALA 22 Cb 0.23 -0.42 0.07 0.00 0.00 0.00 0.00 19.45 19.33 2wdj n ALA 22 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2wdj h LEU 23 N 0.00 0.00 -1.40 0.00 4.07 -1.50 -3.08 115.31 113.40 2wdj h LEU 23 Ca -0.21 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.69 2wdj h LEU 23 Cb 1.40 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.13 2wdj h LEU 23 CO 0.01 0.09 -0.30 0.50 -1.08 0.00 0.00 178.44 177.66 2wdj h LYS 24 N 0.00 0.00 0.06 1.13 1.63 -1.72 0.52 116.57 118.19 2wdj h LYS 24 Ca -0.01 0.00 -0.26 0.00 -0.85 0.00 0.00 60.65 59.52 2wdj h LYS 24 Cb 1.08 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.72 2wdj h LYS 24 CO 0.01 0.30 -1.11 0.00 -3.45 0.00 0.00 179.45 175.20 2wdj h ALA 25 N 1.70 0.17 -0.71 5.00 0.00 -1.72 -3.23 119.26 120.47 2wdj h ALA 25 Ca -0.00 -0.76 -0.42 0.00 0.00 0.00 0.00 54.91 53.73 2wdj h ALA 25 Cb 0.54 0.04 -0.22 0.00 0.00 0.00 0.00 17.79 18.15 2wdj h ALA 25 CO 0.04 0.79 0.53 1.28 0.00 0.00 0.00 179.25 181.89 2wdj n LEU 26 N -3.73 6.21 -3.18 0.00 4.77 -0.81 -4.90 117.00 115.35 2wdj n LEU 26 Ca -0.10 -3.30 -0.22 0.00 -0.03 0.00 0.00 56.01 52.37 2wdj n LEU 26 Cb 0.92 -0.85 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 2wdj n LEU 26 CO 0.54 1.07 -0.11 0.61 -1.33 0.00 0.00 177.39 178.17 2wdj n GLY 27 N -0.50 -0.19 3.34 -0.72 0.00 -0.72 -4.82 105.19 101.58 2wdj n GLY 27 Ca 0.44 0.05 -0.46 0.00 0.00 0.00 0.00 46.02 46.04 2wdj n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wdj s LEU 28 N -4.49 6.15 0.00 0.99 1.43 0.09 -4.95 118.68 117.90 2wdj s LEU 28 Ca 0.37 -2.01 0.00 0.00 -1.03 0.00 0.00 54.13 51.46 2wdj s LEU 28 Cb -0.22 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.76 2wdj s LEU 28 CO 0.54 -0.83 0.00 0.54 0.23 0.00 0.00 176.35 176.83 2wdj n ARG 29 N 5.14 0.00 0.00 1.70 5.12 -1.26 -4.71 116.66 122.66 2wdj n ARG 29 Ca -0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.89 2wdj n ARG 29 Cb 0.43 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.73 2wdj n ARG 29 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2wdj n ARG 30 N 0.00 0.02 -2.49 5.56 1.74 -1.26 -5.02 116.66 115.21 2wdj n ARG 30 Ca 0.00 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.85 2wdj n ARG 30 Cb 0.00 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.49 2wdj n ARG 30 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2wdj s LEU 31 N 0.00 3.12 0.00 0.55 1.43 -1.26 -4.09 118.68 118.43 2wdj s LEU 31 Ca 0.00 0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 2wdj s LEU 31 Cb 0.00 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.26 2wdj s LEU 31 CO 0.00 -1.29 0.00 0.00 0.23 0.00 0.00 176.35 175.29 2wdj n GLN 32 N -2.54 0.00 -2.48 1.70 1.13 -0.78 -4.88 117.38 109.53 2wdj n GLN 32 Ca 0.08 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.72 2wdj n GLN 32 Cb 0.60 -3.89 -0.03 0.00 0.11 0.00 0.00 30.24 27.03 2wdj n GLN 32 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 2wdj s GLN 33 N -0.56 4.39 -0.02 -1.09 0.74 -1.26 -4.86 119.66 117.00 2wdj s GLN 33 Ca 0.00 1.66 -0.00 0.00 0.05 0.00 0.00 55.36 57.07 2wdj s GLN 33 Cb 0.00 -3.51 -0.04 0.00 1.10 0.00 0.00 33.01 30.57 2wdj s GLN 33 CO 0.00 -0.37 0.04 -1.21 -0.55 0.00 0.00 175.29 173.19 2wdj s GLU 34 N 1.89 2.95 -0.12 1.67 2.02 -1.26 -2.19 118.70 123.65 2wdj s GLU 34 Ca 0.56 -0.51 -0.05 0.00 0.02 0.00 0.00 54.97 54.98 2wdj s GLU 34 Cb -0.25 -2.78 0.05 0.00 0.10 0.00 0.00 34.13 31.25 2wdj s GLU 34 CO 0.24 0.65 0.26 0.50 0.02 0.00 0.00 175.26 176.93 2wdj s ARG 35 N -1.48 0.19 -0.25 1.61 3.52 -0.19 -4.99 118.95 117.35 2wdj s ARG 35 Ca 0.19 0.63 -0.18 0.00 -0.13 0.00 0.00 55.73 56.24 2wdj s ARG 35 Cb -0.12 -0.08 -0.03 0.00 -1.56 0.00 0.00 34.95 33.16 2wdj s ARG 35 CO 0.10 -0.21 0.51 0.14 -0.81 0.00 0.00 175.30 175.03 2wdj s VAL 36 N 1.70 5.08 0.17 7.11 -7.23 -1.26 -2.40 120.40 123.57 2wdj s VAL 36 Ca -0.05 0.89 0.10 0.00 -1.81 0.00 0.00 61.98 61.10 2wdj s VAL 36 Cb -0.11 -3.83 -0.04 0.00 0.56 0.00 0.00 36.38 32.96 2wdj s VAL 36 CO -0.09 0.11 -0.21 -0.76 -0.31 0.00 0.00 175.10 173.84 2wdj s LEU 37 N 2.15 2.42 -0.56 1.32 1.43 0.22 -4.95 118.68 120.71 2wdj s LEU 37 Ca 0.22 -0.84 -0.28 0.00 -1.03 0.00 0.00 54.13 52.19 2wdj s LEU 37 Cb -0.16 -0.98 0.03 0.00 0.03 0.00 0.00 46.19 45.11 2wdj s LEU 37 CO 0.09 0.05 1.20 -0.70 0.23 0.00 0.00 176.35 177.22 2wdj s GLU 38 N -2.62 3.54 -0.65 1.70 2.56 -1.26 -0.39 118.70 121.58 2wdj s GLU 38 Ca 0.17 0.32 -0.33 0.00 0.00 0.00 0.00 54.97 55.13 2wdj s GLU 38 Cb -0.07 -4.00 -0.15 0.00 2.00 0.00 0.00 34.13 31.90 2wdj s GLU 38 CO 0.08 -1.65 2.43 -3.47 -0.56 0.00 0.00 175.26 172.09 2wdj n ASP 39 N 8.42 1.29 -3.91 -1.70 2.03 -1.14 -4.87 116.55 116.67 2wdj n ASP 39 Ca 0.09 0.15 -0.09 0.00 0.52 0.00 0.00 54.79 55.46 2wdj n ASP 39 Cb 0.49 -1.16 -0.08 0.00 -0.72 0.00 0.00 41.12 39.65 2wdj n ASP 39 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2wdj s THR 40 N 8.90 0.15 0.45 5.18 -4.23 -1.26 -4.64 115.64 120.19 2wdj s THR 40 Ca 1.18 -1.20 0.33 0.00 -1.18 0.00 0.00 61.69 60.83 2wdj s THR 40 Cb -0.94 -1.17 0.52 0.00 1.34 0.00 0.00 72.50 72.24 2wdj s THR 40 CO 0.46 -0.66 1.59 -0.65 -0.54 0.00 0.00 174.62 174.82 2wdj h PRO 41 N 3.18 0.02 -0.60 3.99 0.11 -2.00 0.53 132.00 137.23 2wdj h PRO 41 Ca -0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2wdj h PRO 41 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wdj h PRO 41 CO 0.55 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 178.35 2wdj n ALA 42 N -2.55 2.89 0.00 -0.75 0.00 -1.26 -2.56 120.51 116.28 2wdj n ALA 42 Ca 0.40 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2wdj n ALA 42 Cb 1.57 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2wdj n ALA 42 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2wdj n ILE 43 N 0.61 0.00 -0.09 0.00 2.08 0.18 -4.63 119.36 117.51 2wdj n ILE 43 Ca 0.16 -0.04 -0.18 0.00 0.56 0.00 0.00 62.75 63.26 2wdj n ILE 43 Cb 0.61 0.42 -0.11 0.00 -0.75 0.00 0.00 39.64 39.81 2wdj n ILE 43 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2wdj h ARG 44 N 0.00 0.00 -0.83 0.38 3.08 -1.49 -3.01 114.38 112.50 2wdj h ARG 44 Ca 0.00 0.00 0.34 0.00 0.07 0.00 0.00 59.98 60.39 2wdj h ARG 44 Cb 0.00 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 29.90 2wdj h ARG 44 CO 0.00 0.92 0.42 0.41 -1.07 0.00 0.00 179.97 180.65 2wdj n GLY 45 N 1.51 -0.66 0.07 0.04 0.00 -1.06 0.21 105.19 105.30 2wdj n GLY 45 Ca -0.22 0.69 -0.11 0.00 0.00 0.00 0.00 46.02 46.38 2wdj n GLY 45 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2wdj h ASN 46 N 0.00 -0.00 -0.89 1.61 4.21 -1.82 -3.03 115.58 115.65 2wdj h ASN 46 Ca 0.69 -0.75 0.10 0.00 1.21 0.00 0.00 56.30 57.55 2wdj h ASN 46 Cb 1.82 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 38.95 2wdj h ASN 46 CO -0.65 0.87 0.58 0.58 -1.29 0.00 0.00 177.43 177.52 2wdj h VAL 47 N -1.00 0.96 0.25 2.81 2.07 -0.21 -1.93 116.25 119.21 2wdj h VAL 47 Ca -0.00 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.22 2wdj h VAL 47 Cb 0.75 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.49 2wdj h VAL 47 CO 0.00 0.16 -0.45 -0.33 0.02 0.00 0.00 177.57 176.97 2wdj h GLU 48 N 0.88 -0.74 0.07 1.57 4.39 0.25 -1.17 114.58 119.82 2wdj h GLU 48 Ca 0.42 0.05 -0.00 0.00 0.34 0.00 0.00 59.36 60.17 2wdj h GLU 48 Cb 0.42 0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 29.24 2wdj h GLU 48 CO -0.18 -0.50 -0.07 -0.22 -1.16 0.00 0.00 179.01 176.89 2wdj h LYS 49 N -0.77 -0.13 -0.22 2.33 3.64 -1.27 -2.23 116.57 117.92 2wdj h LYS 49 Ca -0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wdj h LYS 49 Cb 0.74 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2wdj h LYS 49 CO -0.18 -0.08 0.00 1.33 -2.27 0.00 0.00 179.45 178.25 2wdj n VAL 50 N -2.68 0.00 0.00 2.00 0.24 -0.78 -4.42 118.33 112.69 2wdj n VAL 50 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2wdj n VAL 50 Cb 0.06 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.27 2wdj n VAL 50 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wdj n ALA 51 N 0.24 0.00 0.20 2.33 0.00 -0.44 -1.27 120.51 121.57 2wdj n ALA 51 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 2wdj n ALA 51 Cb 0.06 0.30 0.19 0.00 0.00 0.00 0.00 19.45 20.00 2wdj n ALA 51 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2wdj h HIS 52 N 0.00 0.00 0.00 0.00 2.07 -1.85 0.76 115.15 116.13 2wdj h HIS 52 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2wdj h HIS 52 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2wdj h HIS 52 CO -0.31 0.00 -1.33 1.28 -3.07 0.00 0.00 177.93 174.50 2wdj n LEU 53 N -2.04 0.51 -4.02 6.12 4.77 -0.40 -4.67 117.00 117.28 2wdj n LEU 53 Ca -0.00 -0.08 -0.14 0.00 -0.03 0.00 0.00 56.01 55.76 2wdj n LEU 53 Cb 0.60 -0.04 -0.13 0.00 -2.33 0.00 0.00 43.42 41.52 2wdj n LEU 53 CO 0.03 0.05 -0.40 -0.69 -1.33 0.00 0.00 177.39 175.05 2wdj s VAL 54 N -3.28 0.46 -0.25 4.08 1.01 0.26 -0.91 120.40 121.78 2wdj s VAL 54 Ca 0.00 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 2wdj s VAL 54 Cb 0.14 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 2wdj s VAL 54 CO 0.85 -0.19 0.13 -0.13 0.00 0.00 0.00 175.10 175.75 2wdj s ARG 55 N -0.99 3.85 0.20 2.72 0.52 -0.92 -4.77 118.95 119.56 2wdj s ARG 55 Ca -0.06 -0.38 -0.01 0.00 -0.52 0.00 0.00 55.73 54.76 2wdj s ARG 55 Cb -0.07 -3.46 0.04 0.00 0.52 0.00 0.00 34.95 31.98 2wdj s ARG 55 CO 0.00 -0.10 0.27 0.28 0.02 0.00 0.00 175.30 175.77 2wdj n VAL 56 N 4.74 0.00 0.00 3.52 0.31 -1.26 -1.97 118.33 123.68 2wdj n VAL 56 Ca -0.15 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 2wdj n VAL 56 Cb 0.52 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 2wdj n VAL 56 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2wdj n GLU 57 N -1.53 0.00 -3.56 5.55 2.13 -0.90 -4.90 120.64 117.42 2wdj n GLU 57 Ca 0.04 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.50 2wdj n GLU 57 Cb 0.15 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.79 2wdj n GLU 57 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2wdj s VAL 58 N -0.70 5.32 0.12 6.31 1.01 -1.26 0.21 120.40 131.41 2wdj s VAL 58 Ca 0.00 0.51 -0.01 0.00 0.00 0.00 0.00 61.98 62.48 2wdj s VAL 58 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2wdj s VAL 58 CO 0.00 0.40 0.18 0.52 0.00 0.00 0.00 175.10 176.19 2wdj n VAL 59 N 3.54 0.00 0.00 2.92 0.31 -0.60 -4.91 118.33 119.58 2wdj n VAL 59 Ca -0.12 -0.59 0.00 0.00 -0.01 0.00 0.00 64.34 63.62 2wdj n VAL 59 Cb 0.52 0.37 0.00 0.00 -0.91 0.00 0.00 33.84 33.82 2wdj n VAL 59 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89