#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ww9 s ALA 2 N 0.00 3.63 0.08 -5.12 0.00 -1.26 -4.89 121.76 114.19 2ww9 s ALA 2 Ca 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 51.96 49.14 2ww9 s ALA 2 Cb 0.00 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2ww9 s ALA 2 CO 0.00 -2.58 0.00 0.41 0.00 0.00 0.00 175.76 173.59 2ww9 n GLY 3 N 4.91 -1.78 0.00 0.00 0.00 -1.26 -5.01 105.19 102.05 2ww9 n GLY 3 Ca 0.12 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2ww9 n GLY 3 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ww9 n VAL 4 N -2.31 0.00 -1.66 1.61 0.31 -1.26 -4.94 118.33 110.09 2ww9 n VAL 4 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2ww9 n VAL 4 Cb 0.13 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.06 2ww9 n VAL 4 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2ww9 n LYS 5 N 0.00 -4.69 0.00 5.55 4.81 -1.26 -5.03 118.16 117.55 2ww9 n LYS 5 Ca 0.00 3.52 0.00 0.00 -0.87 0.00 0.00 58.31 60.96 2ww9 n LYS 5 Cb 0.00 -4.04 0.00 0.00 0.02 0.00 0.00 35.03 31.01 2ww9 n LYS 5 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ww9 n ALA 6 N -1.22 1.26 0.09 3.14 0.00 -1.26 -4.70 120.51 117.82 2ww9 n ALA 6 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 2ww9 n ALA 6 Cb 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.53 2ww9 n ALA 6 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2ww9 h TYR 7 N 0.00 0.00 -0.23 0.00 -1.99 -1.99 -2.50 116.97 110.26 2ww9 h TYR 7 Ca 0.00 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.62 2ww9 h TYR 7 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 2ww9 h TYR 7 CO 0.00 0.18 -0.27 1.49 -0.00 0.00 0.00 178.16 179.56 2ww9 h GLU 8 N 0.00 0.60 -0.06 4.88 4.57 -1.92 -3.38 114.58 119.27 2ww9 h GLU 8 Ca -0.05 -0.33 -0.10 0.00 -1.18 0.00 0.00 59.36 57.71 2ww9 h GLU 8 Cb 1.18 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2ww9 h GLU 8 CO 0.02 0.93 -0.34 1.25 -1.18 0.00 0.00 179.01 179.69 2ww9 h LEU 9 N 0.29 0.39 -0.10 1.64 7.12 -1.89 -3.32 115.31 119.45 2ww9 h LEU 9 Ca 0.03 -0.67 -0.02 0.00 0.13 0.00 0.00 57.88 57.35 2ww9 h LEU 9 Cb 0.84 -0.12 -0.00 0.00 -0.53 0.00 0.00 40.66 40.85 2ww9 h LEU 9 CO 0.07 1.00 -0.11 -0.09 -0.13 0.00 0.00 178.44 179.18 2ww9 h ARG 10 N -0.18 0.00 -0.13 1.25 9.65 -1.62 -3.02 114.38 120.32 2ww9 h ARG 10 Ca -0.03 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2ww9 h ARG 10 Cb 1.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.58 2ww9 h ARG 10 CO 0.07 0.11 0.00 -2.37 2.80 0.00 0.00 179.97 180.58 2ww9 n THR 11 N -3.13 0.70 -2.54 0.20 5.66 -1.26 -5.02 114.28 108.89 2ww9 n THR 11 Ca 0.03 -0.85 -0.38 0.00 -3.05 0.00 0.00 64.05 59.80 2ww9 n THR 11 Cb 0.56 0.69 -0.04 0.00 -1.55 0.00 0.00 70.33 69.98 2ww9 n THR 11 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 2ww9 s LYS 12 N -0.84 4.42 -0.36 1.09 2.20 -1.14 -5.04 119.74 120.07 2ww9 s LYS 12 Ca 0.10 1.63 -0.07 0.00 -0.36 0.00 0.00 55.97 57.27 2ww9 s LYS 12 Cb 0.06 -2.87 0.05 0.00 -1.51 0.00 0.00 37.83 33.56 2ww9 s LYS 12 CO 0.08 0.06 0.14 0.45 -0.36 0.00 0.00 175.35 175.72 2ww9 s SER 13 N -1.26 5.36 0.00 1.43 0.15 -1.26 -4.95 113.70 113.18 2ww9 s SER 13 Ca 0.51 -1.26 0.00 0.00 0.70 0.00 0.00 55.95 55.90 2ww9 s SER 13 Cb -0.26 -1.88 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 2ww9 s SER 13 CO 0.33 -0.38 0.00 2.29 1.20 0.00 0.00 173.24 176.69 2ww9 n LYS 14 N 4.81 0.00 -0.06 5.44 2.85 -1.26 -4.33 118.16 125.62 2ww9 n LYS 14 Ca -0.11 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.04 2ww9 n LYS 14 Cb 0.44 0.00 0.04 0.00 -0.65 0.00 0.00 35.03 34.86 2ww9 n LYS 14 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2ww9 h GLU 15 N 0.00 0.74 -0.53 -1.58 3.07 -1.99 -2.12 114.58 112.17 2ww9 h GLU 15 Ca 0.00 -0.40 -0.04 0.00 -0.50 0.00 0.00 59.36 58.43 2ww9 h GLU 15 Cb 0.00 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 2ww9 h GLU 15 CO 0.00 1.02 0.18 1.96 -1.40 0.00 0.00 179.01 180.77 2ww9 h GLN 16 N 0.60 0.82 -0.49 2.33 4.20 -1.99 -2.29 115.11 118.29 2ww9 h GLN 16 Ca 0.05 -0.17 -0.12 0.00 0.06 0.00 0.00 58.65 58.47 2ww9 h GLN 16 Cb 0.97 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 2ww9 h GLN 16 CO 0.09 0.74 -0.16 1.25 -0.67 0.00 0.00 178.83 180.08 2ww9 h LEU 17 N 0.73 0.99 -0.70 1.46 7.12 -1.83 -1.65 115.31 121.43 2ww9 h LEU 17 Ca 0.17 -0.38 -0.08 0.00 0.13 0.00 0.00 57.88 57.73 2ww9 h LEU 17 Cb 0.25 -0.27 -0.03 0.00 -0.53 0.00 0.00 40.66 40.08 2ww9 h LEU 17 CO -0.01 1.14 0.11 0.00 -0.13 0.00 0.00 178.44 179.55 2ww9 h ALA 18 N 0.88 0.92 -0.54 1.25 0.00 -1.32 -0.28 119.26 120.17 2ww9 h ALA 18 Ca 0.12 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 2ww9 h ALA 18 Cb 0.73 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2ww9 h ALA 18 CO 0.06 0.67 -0.12 1.03 0.00 0.00 0.00 179.25 180.89 2ww9 h SER 19 N 1.04 1.04 -0.43 0.00 0.87 -1.30 -2.65 113.55 112.13 2ww9 h SER 19 Ca 0.21 -0.35 -0.12 0.00 -1.23 0.00 0.00 61.79 60.29 2ww9 h SER 19 Cb 0.44 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2ww9 h SER 19 CO 0.01 1.15 -0.20 1.56 -0.53 0.00 0.00 176.83 178.82 2ww9 h GLN 20 N 0.91 0.93 -0.55 2.24 1.08 -1.14 -3.19 115.11 115.40 2ww9 h GLN 20 Ca 0.14 -0.38 -0.08 0.00 -1.45 0.00 0.00 58.65 56.87 2ww9 h GLN 20 Cb 0.69 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.06 2ww9 h GLN 20 CO 0.05 1.04 0.00 1.25 -0.95 0.00 0.00 178.83 180.22 2ww9 h LEU 21 N 0.81 0.91 -0.22 1.46 5.85 -0.86 -0.98 115.31 122.27 2ww9 h LEU 21 Ca 0.11 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2ww9 h LEU 21 Cb 0.76 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.54 2ww9 h LEU 21 CO 0.06 0.97 0.00 1.62 -0.34 0.00 0.00 178.44 180.75 2ww9 h VAL 22 N 0.87 0.00 -0.00 1.05 3.04 -1.53 -2.24 116.25 117.43 2ww9 h VAL 22 Ca 0.16 -0.56 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 2ww9 h VAL 22 Cb 0.51 1.52 0.00 0.00 -2.01 0.00 0.00 31.29 31.31 2ww9 h VAL 22 CO 0.02 0.00 -0.86 0.47 -1.01 0.00 0.00 177.57 176.19 2ww9 n ASP 23 N -2.51 1.17 0.07 3.17 9.92 -0.90 -2.35 116.55 125.11 2ww9 n ASP 23 Ca 0.04 -1.08 0.12 0.00 -0.53 0.00 0.00 54.79 53.34 2ww9 n ASP 23 Cb 0.41 0.90 0.08 0.00 -0.64 0.00 0.00 41.12 41.87 2ww9 n ASP 23 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2ww9 n LEU 24 N -1.19 0.72 0.08 0.64 4.77 -0.42 -3.20 117.00 118.39 2ww9 n LEU 24 Ca 0.05 0.20 0.12 0.00 -0.03 0.00 0.00 56.01 56.34 2ww9 n LEU 24 Cb 0.34 -0.12 0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2ww9 n LEU 24 CO 0.39 -0.07 0.05 1.17 -1.33 0.00 0.00 177.39 177.60 2ww9 n LYS 25 N -2.25 0.49 0.12 3.23 4.81 -0.86 -3.28 118.16 120.42 2ww9 n LYS 25 Ca 0.02 0.08 0.04 0.00 -0.87 0.00 0.00 58.31 57.58 2ww9 n LYS 25 Cb 0.47 -1.74 0.02 0.00 0.02 0.00 0.00 35.03 33.80 2ww9 n LYS 25 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2ww9 h LYS 26 N 0.00 0.00 -0.45 1.64 1.57 -1.51 -1.98 116.57 115.84 2ww9 h LYS 26 Ca 0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 2ww9 h LYS 26 Cb 0.90 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 2ww9 h LYS 26 CO 0.00 0.32 -0.13 0.93 -0.57 0.00 0.00 179.45 180.00 2ww9 h GLU 27 N 0.00 0.89 0.00 3.15 5.08 -1.55 -1.83 114.58 120.32 2ww9 h GLU 27 Ca -0.04 -0.35 -0.03 0.00 -1.00 0.00 0.00 59.36 57.94 2ww9 h GLU 27 Cb 1.34 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 2ww9 h GLU 27 CO 0.04 1.00 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.83 2ww9 h LEU 28 N 0.72 0.00 0.00 1.33 4.07 -1.59 -2.32 115.31 117.52 2ww9 h LEU 28 Ca 0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.07 2ww9 h LEU 28 Cb 0.68 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.42 2ww9 h LEU 28 CO 0.05 0.13 -1.05 0.00 -1.08 0.00 0.00 178.44 176.49 2ww9 n ALA 29 N -2.13 2.68 0.05 1.53 0.00 -0.75 -2.72 120.51 119.16 2ww9 n ALA 29 Ca 0.03 -0.27 -0.14 0.00 0.00 0.00 0.00 53.44 53.05 2ww9 n ALA 29 Cb 0.58 -1.07 -0.04 0.00 0.00 0.00 0.00 19.45 18.92 2ww9 n ALA 29 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2ww9 h GLU 30 N 0.00 0.52 -1.16 0.00 4.22 -1.33 -3.23 114.58 113.59 2ww9 h GLU 30 Ca 0.00 -0.51 -0.57 0.00 0.08 0.00 0.00 59.36 58.37 2ww9 h GLU 30 Cb 0.94 0.13 -0.24 0.00 0.50 0.00 0.00 28.75 30.08 2ww9 h GLU 30 CO 0.00 1.14 0.73 -0.11 -2.18 0.00 0.00 179.01 178.59 2ww9 n LEU 31 N -3.81 7.31 -3.71 1.64 7.94 -0.88 -4.81 117.00 120.68 2ww9 n LEU 31 Ca -0.07 -3.97 -0.14 0.00 -1.11 0.00 0.00 56.01 50.72 2ww9 n LEU 31 Cb 0.81 -1.00 -0.09 0.00 0.53 0.00 0.00 43.42 43.66 2ww9 n LEU 31 CO 0.52 1.39 0.12 -0.54 -1.11 0.00 0.00 177.39 177.77 2ww9 s LYS 32 N -3.19 0.63 0.08 1.96 1.02 -1.10 -4.30 119.74 114.83 2ww9 s LYS 32 Ca 0.54 0.30 0.07 0.00 0.02 0.00 0.00 55.97 56.90 2ww9 s LYS 32 Cb 0.42 0.30 -0.03 0.00 -0.52 0.00 0.00 37.83 38.00 2ww9 s LYS 32 CO -0.01 -0.13 -0.19 0.14 -0.92 0.00 0.00 175.35 174.24 2ww9 s VAL 33 N -0.45 1.52 -0.12 3.17 -7.23 -1.26 -4.86 120.40 111.15 2ww9 s VAL 33 Ca -0.06 -1.35 -0.01 0.00 -1.81 0.00 0.00 61.98 58.75 2ww9 s VAL 33 Cb -0.03 -1.37 0.03 0.00 0.56 0.00 0.00 36.38 35.56 2ww9 s VAL 33 CO 0.03 -0.02 -0.06 0.00 -0.31 0.00 0.00 175.10 174.74 2ww9 s GLN 34 N -1.61 1.35 0.00 4.82 0.00 -1.26 -4.91 119.66 118.05 2ww9 s GLN 34 Ca 0.04 -0.27 0.00 0.00 -0.00 0.00 0.00 55.36 55.14 2ww9 s GLN 34 Cb -0.09 -1.61 0.00 0.00 0.00 0.00 0.00 33.01 31.30 2ww9 s GLN 34 CO 0.03 -0.32 0.00 1.63 0.00 0.00 0.00 175.29 176.63 2ww9 n LYS 35 N 4.96 0.00 -2.62 9.60 4.76 -1.26 -4.53 118.16 129.07 2ww9 n LYS 35 Ca -0.11 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.18 2ww9 n LYS 35 Cb 0.49 -2.75 0.02 0.00 -1.84 0.00 0.00 35.03 30.95 2ww9 n LYS 35 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2ww9 n LEU 36 N 0.00 2.47 0.00 -0.35 4.77 -1.26 -3.81 117.00 118.81 2ww9 n LEU 36 Ca 0.00 -4.23 0.00 0.00 -0.03 0.00 0.00 56.01 51.75 2ww9 n LEU 36 Cb 0.00 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2ww9 n LEU 36 CO 0.00 1.80 0.00 -0.24 -1.33 0.00 0.00 177.39 177.62 2ww9 n SER 37 N -0.18 0.00 -4.86 -1.43 2.88 -1.26 -4.47 113.62 104.29 2ww9 n SER 37 Ca 0.19 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.38 2ww9 n SER 37 Cb 0.76 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.17 2ww9 n SER 37 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ww9 s ARG 38 N 0.00 3.78 0.00 -1.46 1.70 -1.26 -5.14 118.95 116.56 2ww9 s ARG 38 Ca 0.00 0.21 0.00 0.00 -0.47 0.00 0.00 55.73 55.47 2ww9 s ARG 38 Cb 0.00 -3.03 0.00 0.00 -0.57 0.00 0.00 34.95 31.35 2ww9 s ARG 38 CO 0.00 0.58 0.00 -0.35 -1.08 0.00 0.00 175.30 174.45 2ww9 n PRO 39 N 1.04 0.00 -0.25 3.89 -0.04 -1.26 -5.02 135.00 133.36 2ww9 n PRO 39 Ca -0.09 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.30 2ww9 n PRO 39 Cb 0.52 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 34.03 2ww9 n PRO 39 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2ww9 h SER 40 N 0.00 1.00 -4.58 3.54 0.87 -2.03 -3.48 113.55 108.87 2ww9 h SER 40 Ca 0.00 -0.21 -0.47 0.00 -1.23 0.00 0.00 61.79 59.88 2ww9 h SER 40 Cb 0.00 -0.26 0.10 0.00 -0.44 0.00 0.00 62.40 61.80 2ww9 h SER 40 CO 0.00 0.95 0.41 -0.76 -0.53 0.00 0.00 176.83 176.90 2ww9 s LEU 41 N -9.61 2.51 0.58 2.23 2.01 -1.26 -4.69 118.68 110.45 2ww9 s LEU 41 Ca -0.12 0.75 0.28 0.00 0.01 0.00 0.00 54.13 55.05 2ww9 s LEU 41 Cb 0.14 -3.22 1.71 0.00 0.01 0.00 0.00 46.19 44.83 2ww9 s LEU 41 CO 0.83 -1.95 2.18 -0.65 1.01 0.00 0.00 176.35 177.78 2ww9 h PRO 42 N -1.08 0.00 -0.47 1.29 0.11 -1.99 -2.25 132.00 127.62 2ww9 h PRO 42 Ca -0.46 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 2ww9 h PRO 42 Cb 1.33 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 2ww9 h PRO 42 CO 0.65 0.00 -0.16 -0.22 -0.21 0.00 0.00 178.00 178.05 2ww9 h LYS 43 N 0.00 0.93 -0.63 1.05 3.64 -1.98 -0.97 116.57 118.62 2ww9 h LYS 43 Ca 0.04 -0.38 -0.05 0.00 -1.27 0.00 0.00 60.65 58.99 2ww9 h LYS 43 Cb 0.21 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2ww9 h LYS 43 CO -0.00 1.04 0.19 0.82 -2.27 0.00 0.00 179.45 179.23 2ww9 h ILE 44 N 0.78 1.25 -0.30 2.00 2.04 -1.73 -0.52 117.51 121.03 2ww9 h ILE 44 Ca 0.11 -0.86 -0.05 0.00 1.00 0.00 0.00 64.86 65.07 2ww9 h ILE 44 Cb 0.73 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2ww9 h ILE 44 CO 0.06 0.33 -0.01 0.50 0.00 0.00 0.00 178.15 179.03 2ww9 h LYS 45 N 0.91 0.53 -0.34 2.37 3.64 -1.42 -2.54 116.57 119.72 2ww9 h LYS 45 Ca 0.20 -0.17 -0.11 0.00 -1.27 0.00 0.00 60.65 59.30 2ww9 h LYS 45 Cb 0.30 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2ww9 h LYS 45 CO -0.00 0.68 -0.23 1.15 -2.27 0.00 0.00 179.45 178.78 2ww9 h THR 46 N 0.33 1.29 0.00 1.00 2.02 -1.00 -2.43 112.91 114.12 2ww9 h THR 46 Ca 0.08 -1.37 -0.14 0.00 0.77 0.00 0.00 66.41 65.75 2ww9 h THR 46 Cb 0.44 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.26 2ww9 h THR 46 CO 0.02 0.45 -0.68 0.58 0.37 0.00 0.00 175.52 176.26 2ww9 h VAL 47 N 0.53 1.19 -0.76 3.16 2.07 -1.18 0.14 116.25 121.40 2ww9 h VAL 47 Ca 0.07 -2.62 -0.04 0.00 0.82 0.00 0.00 66.70 64.93 2ww9 h VAL 47 Cb 0.78 2.55 -0.03 0.00 -1.52 0.00 0.00 31.29 33.06 2ww9 h VAL 47 CO 0.06 0.66 0.32 -0.09 0.02 0.00 0.00 177.57 178.55 2ww9 h ARG 48 N 0.00 1.13 -0.64 1.57 2.43 -1.41 -2.11 114.38 115.35 2ww9 h ARG 48 Ca -0.01 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 2ww9 h ARG 48 Cb 1.49 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 2ww9 h ARG 48 CO 0.09 0.91 0.00 1.63 -1.51 0.00 0.00 179.97 181.09 2ww9 n LYS 49 N -4.33 2.85 -0.06 0.20 5.02 -0.92 -2.93 118.16 118.00 2ww9 n LYS 49 Ca 0.07 -2.56 -0.02 0.00 -2.02 0.00 0.00 58.31 53.77 2ww9 n LYS 49 Cb 0.17 -1.54 -0.16 0.00 -0.02 0.00 0.00 35.03 33.48 2ww9 n LYS 49 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ww9 n SER 50 N 1.35 0.09 -0.18 4.39 2.88 0.46 -2.29 113.62 120.32 2ww9 n SER 50 Ca 0.22 0.04 -0.10 0.00 -1.33 0.00 0.00 58.87 57.70 2ww9 n SER 50 Cb 0.61 1.26 0.01 0.00 -0.75 0.00 0.00 64.21 65.34 2ww9 n SER 50 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2ww9 h ILE 51 N 0.00 1.26 -0.25 2.46 2.04 -1.40 -1.99 117.51 119.63 2ww9 h ILE 51 Ca -0.32 -1.03 -0.04 0.00 1.00 0.00 0.00 64.86 64.47 2ww9 h ILE 51 Cb 1.75 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 2ww9 h ILE 51 CO 0.02 0.37 0.01 0.00 0.00 0.00 0.00 178.15 178.55 2ww9 h ALA 52 N 0.95 0.33 -0.02 1.87 0.00 -1.63 -2.04 119.26 118.72 2ww9 h ALA 52 Ca 0.15 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 2ww9 h ALA 52 Cb 0.48 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2ww9 h ALA 52 CO 0.02 0.05 -0.53 0.00 0.00 0.00 0.00 179.25 178.79 2ww9 n VAL 54 N -3.91 0.03 0.35 0.00 0.24 -0.76 -3.38 118.33 110.91 2ww9 n VAL 54 Ca -0.02 -0.52 0.12 0.00 -2.04 0.00 0.00 64.34 61.89 2ww9 n VAL 54 Cb 0.55 1.26 0.18 0.00 -1.47 0.00 0.00 33.84 34.35 2ww9 n VAL 54 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2ww9 h LEU 55 N 2.68 0.00 -0.39 1.34 3.38 -1.27 -2.68 115.31 118.37 2ww9 h LEU 55 Ca 0.00 -0.05 -0.17 0.00 0.09 0.00 0.00 57.88 57.75 2ww9 h LEU 55 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 2ww9 h LEU 55 CO 0.00 0.02 -0.49 0.71 0.09 0.00 0.00 178.44 178.77 2ww9 h THR 56 N 0.00 1.28 -0.37 0.22 1.35 -1.50 -2.85 112.91 111.04 2ww9 h THR 56 Ca 0.00 -1.68 -0.06 0.00 -0.55 0.00 0.00 66.41 64.12 2ww9 h THR 56 Cb 0.89 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 68.86 2ww9 h THR 56 CO 0.00 0.55 -0.01 0.58 -0.25 0.00 0.00 175.52 176.39 2ww9 h VAL 57 N 0.65 1.26 -0.36 6.82 2.07 -1.57 0.11 116.25 125.23 2ww9 h VAL 57 Ca 0.03 -1.00 -0.13 0.00 0.82 0.00 0.00 66.70 66.42 2ww9 h VAL 57 Cb 1.08 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 2ww9 h VAL 57 CO 0.11 0.33 -0.28 0.40 0.02 0.00 0.00 177.57 178.15 2ww9 h ILE 58 N 0.47 1.28 0.00 4.57 2.04 -1.58 -1.72 117.51 122.58 2ww9 h ILE 58 Ca 0.10 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 2ww9 h ILE 58 Cb 0.47 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 37.97 2ww9 h ILE 58 CO 0.02 0.48 -0.09 0.78 0.00 0.00 0.00 178.15 179.33 2ww9 h ASN 59 N 0.61 0.00 -0.08 1.72 2.35 -1.47 -2.81 115.58 115.90 2ww9 h ASN 59 Ca 0.07 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.65 2ww9 h ASN 59 Cb 0.86 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.23 2ww9 h ASN 59 CO 0.07 0.04 -0.58 -0.08 -1.65 0.00 0.00 177.43 175.24 2ww9 h GLU 60 N 0.00 0.54 -0.49 0.81 4.81 -0.71 -2.43 114.58 117.12 2ww9 h GLU 60 Ca -0.00 -0.47 -0.10 0.00 -0.13 0.00 0.00 59.36 58.66 2ww9 h GLU 60 Cb 1.03 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 2ww9 h GLU 60 CO 0.01 1.10 -0.09 -0.56 -0.73 0.00 0.00 179.01 178.73 2ww9 h GLN 61 N 0.14 0.89 -0.72 1.92 3.07 -1.25 0.05 115.11 119.21 2ww9 h GLN 61 Ca -0.05 -0.30 -0.06 0.00 0.09 0.00 0.00 58.65 58.33 2ww9 h GLN 61 Cb 1.24 -0.07 -0.03 0.00 0.08 0.00 0.00 27.48 28.69 2ww9 h GLN 61 CO 0.12 0.95 0.21 1.96 0.09 0.00 0.00 178.83 182.16 2ww9 h GLN 62 N 0.81 1.13 -0.29 0.06 4.20 -1.57 -1.03 115.11 118.41 2ww9 h GLN 62 Ca 0.13 -0.24 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 2ww9 h GLN 62 Cb 0.61 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 2ww9 h GLN 62 CO 0.04 0.96 -0.07 -0.09 -0.67 0.00 0.00 178.83 179.01 2ww9 h ARG 63 N 1.08 0.56 -0.01 1.46 9.65 -0.91 -2.76 114.38 123.45 2ww9 h ARG 63 Ca 0.23 -0.21 -0.19 0.00 -1.10 0.00 0.00 59.98 58.71 2ww9 h ARG 63 Cb 0.32 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.85 2ww9 h ARG 63 CO -0.01 0.76 -0.82 0.93 2.80 0.00 0.00 179.97 183.63 2ww9 h GLU 64 N 0.33 0.18 -0.26 0.20 4.39 -0.94 -3.02 114.58 115.46 2ww9 h GLU 64 Ca 0.07 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.53 2ww9 h GLU 64 Cb 0.55 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 2ww9 h GLU 64 CO 0.03 0.90 -0.08 0.00 -1.16 0.00 0.00 179.01 178.70 2ww9 h ALA 65 N 1.03 1.39 0.00 3.43 0.00 -1.22 -2.58 119.26 121.31 2ww9 h ALA 65 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2ww9 h ALA 65 Cb 1.42 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2ww9 h ALA 65 CO 0.12 0.42 0.00 0.28 0.00 0.00 0.00 179.25 180.08 2ww9 h VAL 66 N 0.39 0.00 -0.40 0.00 2.07 -1.36 -2.63 116.25 114.32 2ww9 h VAL 66 Ca 0.08 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2ww9 h VAL 66 Cb 0.39 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 2ww9 h VAL 66 CO 0.02 0.00 0.00 -1.14 0.02 0.00 0.00 177.57 176.47 2ww9 n ARG 67 N -2.31 2.41 -0.02 1.57 0.63 -0.98 -3.78 116.66 114.17 2ww9 n ARG 67 Ca 0.04 -2.14 0.07 0.00 -0.92 0.00 0.00 57.85 54.90 2ww9 n ARG 67 Cb 0.33 -1.40 0.08 0.00 0.45 0.00 0.00 32.46 31.91 2ww9 n ARG 67 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2ww9 n GLN 68 N 1.09 1.21 0.00 -0.14 6.02 -0.99 -5.08 117.38 119.49 2ww9 n GLN 68 Ca 0.16 -1.46 0.00 0.00 -0.01 0.00 0.00 57.00 55.69 2ww9 n GLN 68 Cb 0.51 -1.29 0.00 0.00 1.02 0.00 0.00 30.24 30.48 2ww9 n GLN 68 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33