#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uk5 s SER 2 N 0.00 3.38 0.49 1.61 0.01 -1.26 -5.10 113.70 112.83 1uk5 s SER 2 Ca 0.00 -1.46 0.00 0.00 1.31 0.00 0.00 55.95 55.80 1uk5 s SER 2 Cb 0.00 -0.34 0.00 0.00 0.21 0.00 0.00 66.02 65.89 1uk5 s SER 2 CO 0.00 -0.41 0.00 -0.24 0.41 0.00 0.00 173.24 173.00 1uk5 n SER 3 N 5.01 -8.16 0.00 2.44 2.88 -1.26 -5.03 113.62 109.50 1uk5 n SER 3 Ca -0.02 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.58 1uk5 n SER 3 Cb 0.41 -4.62 0.00 0.00 -0.75 0.00 0.00 64.21 59.25 1uk5 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uk5 n GLY 4 N -4.22 -0.54 3.25 0.46 0.00 -1.26 -5.16 105.19 97.72 1uk5 n GLY 4 Ca -0.05 0.80 0.03 0.00 0.00 0.00 0.00 46.02 46.81 1uk5 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uk5 s SER 5 N 0.00 -0.38 -0.05 1.61 0.15 -1.26 -5.18 113.70 108.59 1uk5 s SER 5 Ca 0.00 0.41 -0.30 0.00 0.70 0.00 0.00 55.95 56.76 1uk5 s SER 5 Cb 0.00 1.39 0.11 0.00 -1.71 0.00 0.00 66.02 65.81 1uk5 s SER 5 CO 0.00 -0.07 0.98 -0.94 1.20 0.00 0.00 173.24 174.41 1uk5 s SER 6 N 2.52 -0.29 0.00 5.45 1.04 -1.26 -5.19 113.70 115.97 1uk5 s SER 6 Ca -0.01 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.40 1uk5 s SER 6 Cb -0.06 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1uk5 s SER 6 CO -0.15 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.16 1uk5 n GLY 7 N -0.22 -1.24 2.68 7.32 0.00 -1.26 -5.11 105.19 107.36 1uk5 n GLY 7 Ca -0.06 -0.88 -0.03 0.00 0.00 0.00 0.00 46.02 45.05 1uk5 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uk5 s ALA 8 N -1.00 -4.56 -0.86 4.61 0.00 -1.26 -5.10 121.76 113.59 1uk5 s ALA 8 Ca 0.00 0.71 -0.25 0.00 0.00 0.00 0.00 51.96 52.42 1uk5 s ALA 8 Cb 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.13 1uk5 s ALA 8 CO 0.00 -2.53 1.65 -1.25 0.00 0.00 0.00 175.76 173.63 1uk5 s PRO 9 N 1.11 3.03 -0.46 0.00 0.04 -1.26 -4.79 135.00 132.66 1uk5 s PRO 9 Ca 0.22 -0.41 0.07 0.00 0.04 0.00 0.00 61.00 60.93 1uk5 s PRO 9 Cb 0.12 -4.90 0.18 0.00 0.04 0.00 0.00 34.50 29.95 1uk5 s PRO 9 CO -0.11 -2.66 0.67 0.00 0.04 0.00 0.00 177.00 174.93 1uk5 s ALA 10 N 7.44 -2.16 -0.09 8.56 0.00 -1.26 -5.13 121.76 129.13 1uk5 s ALA 10 Ca 0.55 -0.15 -0.03 0.00 0.00 0.00 0.00 51.96 52.33 1uk5 s ALA 10 Cb -0.06 -2.70 0.05 0.00 0.00 0.00 0.00 23.12 20.41 1uk5 s ALA 10 CO 0.02 -2.23 0.16 -1.83 0.00 0.00 0.00 175.76 171.89 1uk5 s GLU 11 N 1.34 0.04 0.83 0.00 -1.05 -1.26 -5.15 118.70 113.45 1uk5 s GLU 11 Ca 0.23 0.53 -0.12 0.00 -0.15 0.00 0.00 54.97 55.46 1uk5 s GLU 11 Cb -0.02 -0.37 0.09 0.00 -0.44 0.00 0.00 34.13 33.39 1uk5 s GLU 11 CO -0.06 -0.34 1.11 -1.25 0.95 0.00 0.00 175.26 175.67 1uk5 s PRO 12 N 2.29 1.78 -0.30 -4.83 0.04 -1.26 -5.08 135.00 127.64 1uk5 s PRO 12 Ca 0.03 0.52 -0.04 0.00 0.04 0.00 0.00 61.00 61.56 1uk5 s PRO 12 Cb -0.12 -1.89 0.17 0.00 0.04 0.00 0.00 34.50 32.70 1uk5 s PRO 12 CO -0.06 -1.81 0.64 0.00 0.04 0.00 0.00 177.00 175.81 1uk5 s ALA 13 N -3.20 -2.27 -0.47 8.56 0.00 -1.26 -5.07 121.76 118.06 1uk5 s ALA 13 Ca 0.62 1.96 0.06 0.00 0.00 0.00 0.00 51.96 54.60 1uk5 s ALA 13 Cb -0.14 -2.09 0.25 0.00 0.00 0.00 0.00 23.12 21.14 1uk5 s ALA 13 CO 0.54 -1.23 0.84 0.00 0.00 0.00 0.00 175.76 175.91 1uk5 n ALA 14 N 5.43 -0.60 -2.40 0.00 0.00 -1.26 -5.13 120.51 116.54 1uk5 n ALA 14 Ca -0.04 -1.81 -0.42 0.00 0.00 0.00 0.00 53.44 51.17 1uk5 n ALA 14 Cb 0.51 -1.22 -0.03 0.00 0.00 0.00 0.00 19.45 18.70 1uk5 n ALA 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1uk5 s PRO 15 N 0.26 4.47 -0.10 0.00 0.04 -1.26 -4.83 135.00 133.58 1uk5 s PRO 15 Ca 0.32 1.72 -0.33 0.00 0.04 0.00 0.00 61.00 62.75 1uk5 s PRO 15 Cb 0.23 -3.35 0.13 0.00 0.04 0.00 0.00 34.50 31.54 1uk5 s PRO 15 CO -0.20 -0.18 1.20 0.15 0.04 0.00 0.00 177.00 178.01 1uk5 s LYS 16 N 0.84 0.42 -1.04 4.56 1.02 -1.26 -5.08 119.74 119.19 1uk5 s LYS 16 Ca 0.56 -0.19 -0.06 0.00 0.02 0.00 0.00 55.97 56.30 1uk5 s LYS 16 Cb -0.28 0.17 0.26 0.00 -0.52 0.00 0.00 37.83 37.46 1uk5 s LYS 16 CO 0.30 -0.19 1.04 0.43 -0.92 0.00 0.00 175.35 176.02 1uk5 n SER 17 N -0.26 5.17 -3.93 2.83 7.64 -1.26 -4.75 113.62 119.06 1uk5 n SER 17 Ca -0.04 -3.11 -0.30 0.00 1.01 0.00 0.00 58.87 56.43 1uk5 n SER 17 Cb 0.60 -1.26 -0.14 0.00 -1.01 0.00 0.00 64.21 62.40 1uk5 n SER 17 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1uk5 s GLY 18 N 0.50 2.18 0.71 0.23 0.00 -1.26 -5.10 107.32 104.57 1uk5 s GLY 18 Ca 0.30 -2.95 -0.17 0.00 0.00 0.00 0.00 44.72 41.90 1uk5 s GLY 18 CO -0.08 1.08 -0.43 1.18 0.00 0.00 0.00 173.10 174.85 1uk5 n GLU 19 N 3.51 0.00 -1.21 2.90 4.71 -1.26 -4.61 120.64 124.67 1uk5 n GLU 19 Ca 0.05 0.00 0.16 0.00 -0.01 0.00 0.00 57.16 57.36 1uk5 n GLU 19 Cb 0.35 -0.95 -0.05 0.00 -1.01 0.00 0.00 31.44 29.78 1uk5 n GLU 19 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1uk5 n ALA 20 N -1.89 -3.16 -0.86 0.62 0.00 -1.26 -5.01 120.51 108.95 1uk5 n ALA 20 Ca 0.03 0.54 0.11 0.00 0.00 0.00 0.00 53.44 54.13 1uk5 n ALA 20 Cb 0.49 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 1uk5 n ALA 20 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uk5 n GLU 21 N -3.96 -1.78 -1.48 0.00 4.71 -1.26 -4.81 120.64 112.05 1uk5 n GLU 21 Ca -0.02 1.23 -0.43 0.00 -0.01 0.00 0.00 57.16 57.93 1uk5 n GLU 21 Cb 0.56 -2.15 -0.00 0.00 -1.01 0.00 0.00 31.44 28.83 1uk5 n GLU 21 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1uk5 n THR 22 N -3.16 1.87 -1.55 2.62 -1.04 -1.26 -4.94 114.28 106.82 1uk5 n THR 22 Ca -0.00 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.05 61.21 1uk5 n THR 22 Cb 0.40 -0.59 0.10 0.00 -1.82 0.00 0.00 70.33 68.42 1uk5 n THR 22 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1uk5 s PRO 23 N -1.49 1.82 0.95 -2.82 0.04 -1.26 -5.02 135.00 127.22 1uk5 s PRO 23 Ca 0.62 0.54 -0.14 0.00 0.04 0.00 0.00 61.00 62.06 1uk5 s PRO 23 Cb -0.68 -1.90 0.16 0.00 0.04 0.00 0.00 34.50 32.13 1uk5 s PRO 23 CO 0.58 -1.78 1.16 -1.25 0.04 0.00 0.00 177.00 175.75 1uk5 s PRO 24 N -5.19 0.78 0.59 0.56 0.04 -1.26 -5.04 135.00 125.47 1uk5 s PRO 24 Ca 0.62 0.15 -0.13 0.00 0.04 0.00 0.00 61.00 61.68 1uk5 s PRO 24 Cb -0.14 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 1uk5 s PRO 24 CO 0.54 -2.42 1.02 0.15 0.04 0.00 0.00 177.00 176.33 1uk5 s LYS 25 N -5.37 3.67 0.19 4.56 -0.14 -1.26 -5.03 119.74 116.34 1uk5 s LYS 25 Ca 0.66 0.84 -0.27 0.00 -1.36 0.00 0.00 55.97 55.84 1uk5 s LYS 25 Cb -0.13 -2.09 -0.08 0.00 -1.68 0.00 0.00 37.83 33.85 1uk5 s LYS 25 CO 0.54 -0.51 0.84 -1.58 -0.76 0.00 0.00 175.35 173.87 1uk5 s HIS 26 N -2.98 3.93 0.13 3.18 5.65 -1.26 -4.97 115.29 118.98 1uk5 s HIS 26 Ca 0.57 1.73 -0.06 0.00 0.25 0.00 0.00 55.06 57.55 1uk5 s HIS 26 Cb -0.11 -2.85 -0.08 0.00 -1.18 0.00 0.00 32.58 28.36 1uk5 s HIS 26 CO 0.46 0.49 1.32 -1.00 -0.65 0.00 0.00 174.74 175.36 1uk5 h PRO 27 N 4.32 0.49 0.00 2.88 0.13 -1.98 -1.91 132.00 135.92 1uk5 h PRO 27 Ca -0.46 -0.48 -0.00 0.00 -0.87 0.00 0.00 66.00 64.19 1uk5 h PRO 27 Cb 1.20 0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 1uk5 h PRO 27 CO 0.67 1.12 -0.00 0.78 -0.23 0.00 0.00 178.00 180.34 1uk5 h GLY 28 N 1.06 0.00 0.00 1.56 0.00 -1.96 -0.76 103.07 102.97 1uk5 h GLY 28 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 1uk5 h GLY 28 CO 0.16 0.00 -0.42 -2.08 0.00 0.00 0.00 176.54 174.20 1uk5 h VAL 29 N 0.00 0.18 -1.32 4.60 2.07 -1.85 -3.35 116.25 116.57 1uk5 h VAL 29 Ca -0.00 -1.19 0.42 0.00 0.82 0.00 0.00 66.70 66.75 1uk5 h VAL 29 Cb 0.01 0.40 -0.11 0.00 -1.52 0.00 0.00 31.29 30.06 1uk5 h VAL 29 CO 0.00 0.06 0.87 -0.07 0.02 0.00 0.00 177.57 178.45 1uk5 h LEU 30 N -1.00 0.24 -0.85 2.57 3.38 -1.21 1.86 115.31 120.30 1uk5 h LEU 30 Ca -0.04 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.16 1uk5 h LEU 30 Cb 0.47 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.23 1uk5 h LEU 30 CO -0.02 -0.12 0.47 0.11 0.09 0.00 0.00 178.44 178.97 1uk5 h LYS 31 N 0.12 0.71 0.08 1.13 1.57 -1.27 0.94 116.57 119.86 1uk5 h LYS 31 Ca 0.78 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 59.40 1uk5 h LYS 31 Cb 2.49 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 34.66 1uk5 h LYS 31 CO -0.34 0.47 -0.52 -0.39 -0.57 0.00 0.00 179.45 178.10 1uk5 h VAL 32 N 0.74 1.59 -0.65 0.50 -1.51 0.26 -3.18 116.25 114.00 1uk5 h VAL 32 Ca 0.43 -2.40 0.15 0.00 -1.23 0.00 0.00 66.70 63.65 1uk5 h VAL 32 Cb 0.50 3.18 -0.04 0.00 -2.13 0.00 0.00 31.29 32.80 1uk5 h VAL 32 CO -0.30 0.66 0.45 -0.33 -1.23 0.00 0.00 177.57 176.82 1uk5 h GLU 33 N -0.54 0.22 -0.40 5.19 5.08 -0.24 0.44 114.58 124.33 1uk5 h GLU 33 Ca -0.09 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 1uk5 h GLU 33 Cb 1.38 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.57 1uk5 h GLU 33 CO 0.10 0.15 0.02 0.00 -1.00 0.00 0.00 179.01 178.28 1uk5 h ALA 34 N 1.69 0.54 0.32 3.43 0.00 0.86 -1.06 119.26 125.04 1uk5 h ALA 34 Ca 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1uk5 h ALA 34 Cb 0.91 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1uk5 h ALA 34 CO -0.06 0.29 -0.15 0.82 0.00 0.00 0.00 179.25 180.15 1uk5 h ILE 35 N 0.53 0.53 -0.84 0.00 2.04 -0.77 -3.22 117.51 115.78 1uk5 h ILE 35 Ca 0.12 -0.75 0.16 0.00 1.00 0.00 0.00 64.86 65.39 1uk5 h ILE 35 Cb 0.44 0.83 -0.16 0.00 -0.74 0.00 0.00 36.82 37.19 1uk5 h ILE 35 CO 0.02 0.11 -0.23 -0.07 0.00 0.00 0.00 178.15 177.98 1uk5 h LEU 36 N -0.92 -0.86 -1.06 1.44 3.38 -0.29 1.20 115.31 118.20 1uk5 h LEU 36 Ca -0.04 0.26 0.35 0.00 0.09 0.00 0.00 57.88 58.53 1uk5 h LEU 36 Cb 0.52 0.54 -0.15 0.00 0.09 0.00 0.00 40.66 41.66 1uk5 h LEU 36 CO 0.07 -0.28 0.60 -0.33 0.09 0.00 0.00 178.44 178.59 1uk5 h GLU 37 N -0.01 0.23 -0.02 1.13 4.39 -1.20 0.55 114.58 119.65 1uk5 h GLU 37 Ca 0.39 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 60.03 1uk5 h GLU 37 Cb 0.61 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 1uk5 h GLU 37 CO -0.86 0.15 -0.17 0.87 -1.16 0.00 0.00 179.01 177.84 1uk5 h LYS 38 N 0.24 0.15 -0.87 2.33 1.57 0.14 -3.28 116.57 116.86 1uk5 h LYS 38 Ca 0.76 -0.14 0.15 0.00 -1.87 0.00 0.00 60.65 59.55 1uk5 h LYS 38 Cb 1.88 0.03 -0.15 0.00 0.08 0.00 0.00 32.23 34.07 1uk5 h LYS 38 CO -0.60 0.83 -0.33 0.28 -0.57 0.00 0.00 179.45 179.05 1uk5 h VAL 39 N -0.48 0.07 -0.96 0.50 2.07 0.15 1.03 116.25 118.63 1uk5 h VAL 39 Ca -0.02 0.00 0.37 0.00 0.82 0.00 0.00 66.70 67.88 1uk5 h VAL 39 Cb 0.87 0.07 -0.17 0.00 -1.52 0.00 0.00 31.29 30.54 1uk5 h VAL 39 CO 0.03 0.00 0.40 0.00 0.02 0.00 0.00 177.57 178.03 1uk5 n GLN 40 N -5.49 -0.06 -0.11 1.57 1.13 -0.34 0.19 117.38 114.26 1uk5 n GLN 40 Ca 0.10 1.35 -0.10 0.00 -1.94 0.00 0.00 57.00 56.41 1uk5 n GLN 40 Cb 0.40 -2.36 -0.02 0.00 0.11 0.00 0.00 30.24 28.37 1uk5 n GLN 40 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1uk5 h GLY 41 N 0.00 0.58 2.00 1.08 0.00 0.97 -0.41 103.07 107.30 1uk5 h GLY 41 Ca 0.76 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.68 1uk5 h GLY 41 CO -0.78 0.35 -0.17 1.41 0.00 0.00 0.00 176.54 177.35 1uk5 h LEU 42 N 0.38 0.00 0.06 3.11 3.38 0.23 -2.79 115.31 119.68 1uk5 h LEU 42 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1uk5 h LEU 42 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1uk5 h LEU 42 CO 0.00 0.17 -0.03 -0.08 0.09 0.00 0.00 178.44 178.60 1uk5 h GLU 43 N 0.00 -0.07 -1.14 1.13 4.22 0.14 -2.98 114.58 115.87 1uk5 h GLU 43 Ca -0.00 0.01 0.32 0.00 0.08 0.00 0.00 59.36 59.76 1uk5 h GLU 43 Cb 0.39 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.56 1uk5 h GLU 43 CO 0.02 0.49 0.75 1.96 -2.18 0.00 0.00 179.01 180.05 1uk5 h GLN 44 N -0.71 0.25 -0.21 1.92 1.08 -0.83 0.68 115.11 117.29 1uk5 h GLN 44 Ca -0.01 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.14 1uk5 h GLN 44 Cb 0.60 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 1uk5 h GLN 44 CO 0.01 0.17 -0.02 0.00 -0.95 0.00 0.00 178.83 178.04 1uk5 h ALA 45 N 1.58 0.28 0.73 3.87 0.00 -1.48 -1.91 119.26 122.33 1uk5 h ALA 45 Ca 0.65 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 1uk5 h ALA 45 Cb 1.89 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1uk5 h ALA 45 CO -0.28 0.02 -0.40 0.28 0.00 0.00 0.00 179.25 178.87 1uk5 h VAL 46 N 0.13 0.00 -0.96 0.00 2.07 0.41 1.52 116.25 119.42 1uk5 h VAL 46 Ca 0.06 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.85 1uk5 h VAL 46 Cb 0.43 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 1uk5 h VAL 46 CO 0.01 0.00 0.88 -0.78 0.02 0.00 0.00 177.57 177.70 1uk5 h ASP 47 N -1.04 0.00 -0.73 0.57 1.82 -0.97 1.02 116.42 117.10 1uk5 h ASP 47 Ca -0.10 0.00 -0.50 0.00 -0.39 0.00 0.00 57.03 56.04 1uk5 h ASP 47 Cb 0.82 0.00 -0.42 0.00 0.68 0.00 0.00 39.33 40.40 1uk5 h ASP 47 CO 0.13 0.00 -0.87 -1.20 -1.61 0.00 0.00 179.24 175.69 1uk5 n SER 48 N -3.72 4.30 -4.94 2.28 7.64 -0.49 -5.06 113.62 113.63 1uk5 n SER 48 Ca 0.20 -3.44 -0.20 0.00 1.01 0.00 0.00 58.87 56.45 1uk5 n SER 48 Cb 1.19 -0.37 -0.01 0.00 -1.01 0.00 0.00 64.21 64.01 1uk5 n SER 48 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1uk5 s PHE 49 N -3.63 2.51 -0.29 1.43 5.36 0.51 -4.84 117.98 119.03 1uk5 s PHE 49 Ca 0.46 -0.52 -0.18 0.00 -0.96 0.00 0.00 56.93 55.74 1uk5 s PHE 49 Cb 0.39 -2.22 0.15 0.00 -0.34 0.00 0.00 43.02 41.00 1uk5 s PHE 49 CO 0.02 -0.35 1.02 -2.00 -1.46 0.00 0.00 175.22 172.45 1uk5 s GLU 50 N -4.27 0.36 0.00 10.12 2.12 -1.26 -4.94 118.70 120.84 1uk5 s GLU 50 Ca 0.51 0.58 0.00 0.00 0.36 0.00 0.00 54.97 56.42 1uk5 s GLU 50 Cb -0.05 0.10 0.00 0.00 0.26 0.00 0.00 34.13 34.43 1uk5 s GLU 50 CO 0.30 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.36 1uk5 n GLY 51 N 3.32 -0.19 0.63 -1.50 0.00 -1.26 -4.93 105.19 101.27 1uk5 n GLY 51 Ca -0.17 -0.34 -0.03 0.00 0.00 0.00 0.00 46.02 45.48 1uk5 n GLY 51 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1uk5 n LYS 52 N 0.00 0.14 0.02 1.61 0.00 -1.25 -4.36 118.16 114.32 1uk5 n LYS 52 Ca 0.00 -0.52 0.13 0.00 -0.00 0.00 0.00 58.31 57.91 1uk5 n LYS 52 Cb 0.00 0.51 0.32 0.00 -0.00 0.00 0.00 35.03 35.86 1uk5 n LYS 52 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1uk5 n LYS 53 N -0.11 0.09 -0.10 -1.58 5.02 -1.26 -3.88 118.16 116.34 1uk5 n LYS 53 Ca 0.00 0.04 -0.19 0.00 -2.02 0.00 0.00 58.31 56.14 1uk5 n LYS 53 Cb 0.11 -1.57 -0.12 0.00 -0.02 0.00 0.00 35.03 33.43 1uk5 n LYS 53 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1uk5 n THR 54 N -1.71 1.56 -1.29 -0.18 -2.24 -1.26 -4.79 114.28 104.37 1uk5 n THR 54 Ca 0.05 -0.58 -0.41 0.00 -2.27 0.00 0.00 64.05 60.84 1uk5 n THR 54 Cb 0.37 -1.51 0.00 0.00 -2.10 0.00 0.00 70.33 67.09 1uk5 n THR 54 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1uk5 n ASP 55 N -3.36 -3.04 -0.01 3.42 8.00 -1.25 -4.75 116.55 115.55 1uk5 n ASP 55 Ca -0.43 0.77 -0.12 0.00 0.71 0.00 0.00 54.79 55.72 1uk5 n ASP 55 Cb 1.00 -0.88 -0.08 0.00 -0.02 0.00 0.00 41.12 41.14 1uk5 n ASP 55 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1uk5 h LYS 56 N 0.24 0.09 -0.97 -1.24 3.11 -1.93 -2.79 116.57 113.09 1uk5 h LYS 56 Ca -0.38 -0.03 0.29 0.00 -2.81 0.00 0.00 60.65 57.72 1uk5 h LYS 56 Cb 1.45 -0.01 -0.18 0.00 -1.00 0.00 0.00 32.23 32.49 1uk5 h LYS 56 CO 0.46 0.40 0.14 -0.22 -2.81 0.00 0.00 179.45 177.42 1uk5 h LYS 57 N -0.22 0.04 -0.58 1.90 1.63 -1.94 1.42 116.57 118.81 1uk5 h LYS 57 Ca 0.01 -0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.77 1uk5 h LYS 57 Cb 0.36 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.95 1uk5 h LYS 57 CO 0.00 0.02 0.19 -0.92 -3.45 0.00 0.00 179.45 175.30 1uk5 h TYR 58 N 0.04 0.93 -0.89 1.91 3.20 -1.75 -2.49 116.97 117.92 1uk5 h TYR 58 Ca 0.63 -0.09 0.08 0.00 3.14 0.00 0.00 58.73 62.49 1uk5 h TYR 58 Cb 1.38 -0.27 -0.07 0.00 1.54 0.00 0.00 36.73 39.31 1uk5 h TYR 58 CO -0.38 0.77 0.54 -0.07 -1.64 0.00 0.00 178.16 177.38 1uk5 h LEU 59 N 0.82 0.82 0.15 2.82 3.38 0.21 1.27 115.31 124.79 1uk5 h LEU 59 Ca 0.19 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1uk5 h LEU 59 Cb 0.27 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1uk5 h LEU 59 CO -0.01 0.49 -0.14 0.24 0.09 0.00 0.00 178.44 179.12 1uk5 h MET 60 N 0.94 -0.30 -0.37 1.13 2.86 -0.59 0.36 114.93 118.95 1uk5 h MET 60 Ca 0.41 0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.98 1uk5 h MET 60 Cb 0.29 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1uk5 h MET 60 CO -0.21 -0.20 -0.12 0.82 1.06 0.00 0.00 176.91 178.25 1uk5 h ILE 61 N -0.32 1.28 0.10 -1.22 2.04 -1.03 0.14 117.51 118.50 1uk5 h ILE 61 Ca 0.00 -1.22 0.02 0.00 1.00 0.00 0.00 64.86 64.66 1uk5 h ILE 61 Cb 0.30 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 1uk5 h ILE 61 CO -0.03 0.40 -0.33 -0.08 0.00 0.00 0.00 178.15 178.12 1uk5 h GLU 62 N 0.53 -0.52 -0.48 2.37 4.22 0.19 0.63 114.58 121.51 1uk5 h GLU 62 Ca 0.09 0.04 -0.03 0.00 0.08 0.00 0.00 59.36 59.53 1uk5 h GLU 62 Cb 0.65 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1uk5 h GLU 62 CO 0.04 -0.35 0.17 1.05 -2.18 0.00 0.00 179.01 177.74 1uk5 h GLU 63 N -0.54 0.72 -0.83 1.92 4.11 -0.27 -2.26 114.58 117.44 1uk5 h GLU 63 Ca 0.03 -0.14 0.06 0.00 0.07 0.00 0.00 59.36 59.39 1uk5 h GLU 63 Cb 0.58 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.66 1uk5 h GLU 63 CO -0.20 0.67 0.50 1.88 0.07 0.00 0.00 179.01 181.93 1uk5 h TYR 64 N 0.63 0.93 0.73 2.06 0.05 -0.22 0.40 116.97 121.54 1uk5 h TYR 64 Ca 0.16 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.93 1uk5 h TYR 64 Cb 0.23 -0.30 0.01 0.00 1.01 0.00 0.00 36.73 37.68 1uk5 h TYR 64 CO 0.01 0.46 -0.36 -0.07 -1.05 0.00 0.00 178.16 177.14 1uk5 h LEU 65 N 0.91 -0.87 -0.60 3.88 3.38 0.56 -2.82 115.31 119.76 1uk5 h LEU 65 Ca 0.37 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.44 1uk5 h LEU 65 Cb 0.19 0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.11 1uk5 h LEU 65 CO -0.18 -0.61 0.28 0.74 0.09 0.00 0.00 178.44 178.76 1uk5 h THR 66 N -1.00 0.88 -0.99 0.22 2.02 -1.03 -0.95 112.91 112.06 1uk5 h THR 66 Ca -0.10 -0.18 0.34 0.00 0.77 0.00 0.00 66.41 67.25 1uk5 h THR 66 Cb 0.77 0.32 -0.18 0.00 -1.74 0.00 0.00 68.15 67.33 1uk5 h THR 66 CO 0.16 0.09 0.34 0.11 0.37 0.00 0.00 175.52 176.59 1uk5 h LYS 67 N 0.51 0.05 -0.26 6.66 1.57 0.03 1.52 116.57 126.65 1uk5 h LYS 67 Ca 0.28 -0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.92 1uk5 h LYS 67 Cb 0.26 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 1uk5 h LYS 67 CO -0.23 0.03 -0.39 0.93 -0.57 0.00 0.00 179.45 179.23 1uk5 h GLU 68 N 0.05 0.72 -0.03 3.15 4.39 -0.99 -2.91 114.58 118.96 1uk5 h GLU 68 Ca 0.73 -0.43 0.02 0.00 0.34 0.00 0.00 59.36 60.02 1uk5 h GLU 68 Cb 1.75 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 30.39 1uk5 h GLU 68 CO -0.80 1.05 -0.54 -0.07 -1.16 0.00 0.00 179.01 177.49 1uk5 h LEU 69 N 0.46 -1.67 -1.30 1.33 3.38 0.25 0.88 115.31 118.63 1uk5 h LEU 69 Ca 0.03 0.19 0.23 0.00 0.09 0.00 0.00 57.88 58.42 1uk5 h LEU 69 Cb 0.98 0.64 -0.09 0.00 0.09 0.00 0.00 40.66 42.28 1uk5 h LEU 69 CO 0.09 -0.52 0.64 -0.07 0.09 0.00 0.00 178.44 178.67 1uk5 h LEU 70 N -0.66 0.52 -0.95 1.67 3.38 -1.16 1.63 115.31 119.75 1uk5 h LEU 70 Ca 0.02 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1uk5 h LEU 70 Cb 0.72 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1uk5 h LEU 70 CO -0.38 0.15 -0.46 0.00 0.09 0.00 0.00 178.44 177.84 1uk5 h ALA 71 N 1.63 1.06 0.04 1.53 0.00 -0.35 0.54 119.26 123.71 1uk5 h ALA 71 Ca 0.57 -0.42 -0.23 0.00 0.00 0.00 0.00 54.91 54.82 1uk5 h ALA 71 Cb 1.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1uk5 h ALA 71 CO -0.30 0.58 -1.02 -0.07 0.00 0.00 0.00 179.25 178.44 1uk5 h LEU 72 N 0.00 0.45 0.15 0.00 3.38 0.90 -3.26 115.31 116.93 1uk5 h LEU 72 Ca -0.00 -0.39 -0.31 0.00 0.09 0.00 0.00 57.88 57.27 1uk5 h LEU 72 Cb 0.92 -0.14 0.03 0.00 0.09 0.00 0.00 40.66 41.56 1uk5 h LEU 72 CO 0.06 1.22 -1.32 -0.78 0.09 0.00 0.00 178.44 177.72 1uk5 h ASP 73 N 0.16 0.81 -0.55 -0.43 3.58 0.19 -3.16 116.42 117.01 1uk5 h ASP 73 Ca -0.09 -0.79 0.16 0.00 0.42 0.00 0.00 57.03 56.73 1uk5 h ASP 73 Cb 1.68 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 42.45 1uk5 h ASP 73 CO 0.17 1.60 0.75 -1.28 -2.88 0.00 0.00 179.24 177.60 1uk5 h SER 74 N 0.21 0.00 -3.09 2.28 0.87 0.04 -3.39 113.55 110.47 1uk5 h SER 74 Ca -0.20 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 59.83 1uk5 h SER 74 Cb 2.00 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 63.98 1uk5 h SER 74 CO 0.25 0.00 0.67 -0.69 -0.53 0.00 0.00 176.83 176.53 1uk5 s VAL 75 N -4.44 3.51 -0.41 2.23 1.01 -1.20 -4.99 120.40 116.10 1uk5 s VAL 75 Ca -0.03 1.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.96 1uk5 s VAL 75 Cb 0.13 -3.70 0.09 0.00 0.00 0.00 0.00 36.38 32.90 1uk5 s VAL 75 CO 0.44 0.09 0.24 1.51 0.00 0.00 0.00 175.10 177.39 1uk5 s ASP 76 N 1.02 5.53 0.27 3.32 -4.77 -1.26 -4.93 116.67 115.85 1uk5 s ASP 76 Ca 0.62 -1.63 0.13 0.00 -3.30 0.00 0.00 52.55 48.37 1uk5 s ASP 76 Cb -0.35 -1.94 0.28 0.00 -1.09 0.00 0.00 42.92 39.82 1uk5 s ASP 76 CO 0.31 -0.54 1.55 1.55 0.70 0.00 0.00 175.17 178.73 1uk5 h PRO 77 N 8.32 0.00 0.00 2.11 0.13 -1.93 -3.47 132.00 137.17 1uk5 h PRO 77 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1uk5 h PRO 77 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1uk5 h PRO 77 CO 0.74 0.62 0.00 0.39 -0.23 0.00 0.00 178.00 179.53 1uk5 n GLU 78 N -3.55 0.00 -1.65 0.86 -0.58 -1.26 -2.06 120.64 112.40 1uk5 n GLU 78 Ca -0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1uk5 n GLU 78 Cb 0.68 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.56 1uk5 n GLU 78 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uk5 n GLY 79 N 0.00 -0.65 3.16 0.62 0.00 -1.26 -5.13 105.19 101.93 1uk5 n GLY 79 Ca 0.00 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1uk5 n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1uk5 s ARG 80 N 0.01 2.77 0.08 1.61 3.00 -0.88 -5.00 118.95 120.55 1uk5 s ARG 80 Ca 0.01 -1.00 -0.30 0.00 0.00 0.00 0.00 55.73 54.44 1uk5 s ARG 80 Cb 0.05 -2.88 -0.16 0.00 0.00 0.00 0.00 34.95 31.96 1uk5 s ARG 80 CO -0.01 -0.38 1.66 0.00 0.00 0.00 0.00 175.30 176.56 1uk5 h ALA 81 N 7.95 -0.62 -1.30 2.13 0.00 -1.97 0.90 119.26 126.36 1uk5 h ALA 81 Ca -0.33 -0.13 0.45 0.00 0.00 0.00 0.00 54.91 54.90 1uk5 h ALA 81 Cb 1.10 0.28 -0.14 0.00 0.00 0.00 0.00 17.79 19.03 1uk5 h ALA 81 CO 0.57 -0.86 0.82 0.38 0.00 0.00 0.00 179.25 180.16 1uk5 h ASP 82 N -0.62 0.24 0.00 0.00 2.03 -1.99 1.28 116.42 117.36 1uk5 h ASP 82 Ca -0.05 0.16 -0.03 0.00 -0.73 0.00 0.00 57.03 56.38 1uk5 h ASP 82 Cb 0.50 0.16 -0.00 0.00 -0.83 0.00 0.00 39.33 39.16 1uk5 h ASP 82 CO 0.07 -0.26 -0.31 0.58 -1.03 0.00 0.00 179.24 178.29 1uk5 h VAL 83 N 0.04 0.45 -0.48 4.15 2.07 -1.62 -3.18 116.25 117.68 1uk5 h VAL 83 Ca 0.85 -1.40 0.08 0.00 0.82 0.00 0.00 66.70 67.05 1uk5 h VAL 83 Cb 2.64 0.91 -0.10 0.00 -1.52 0.00 0.00 31.29 33.23 1uk5 h VAL 83 CO -0.50 0.15 -0.42 0.03 0.02 0.00 0.00 177.57 176.86 1uk5 h ARG 84 N -1.00 -0.27 -0.56 1.57 3.08 0.37 0.68 114.38 118.25 1uk5 h ARG 84 Ca -0.05 0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.14 1uk5 h ARG 84 Cb 0.50 0.06 -0.10 0.00 0.08 0.00 0.00 29.97 30.51 1uk5 h ARG 84 CO -0.03 -0.18 -0.08 -0.56 -1.07 0.00 0.00 179.97 178.06 1uk5 h GLN 85 N -0.28 0.05 -0.34 0.04 3.07 0.13 0.71 115.11 118.49 1uk5 h GLN 85 Ca 0.16 -0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.90 1uk5 h GLN 85 Cb 0.57 -0.01 -0.02 0.00 0.08 0.00 0.00 27.48 28.10 1uk5 h GLN 85 CO -0.62 0.03 0.23 0.00 0.09 0.00 0.00 178.83 178.56 1uk5 h ALA 86 N 1.54 0.44 0.71 0.06 0.00 -0.89 0.20 119.26 121.31 1uk5 h ALA 86 Ca 0.28 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1uk5 h ALA 86 Cb 0.44 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1uk5 h ALA 86 CO -0.53 -0.11 -0.42 -0.09 0.00 0.00 0.00 179.25 178.10 1uk5 h ARG 87 N 0.46 -1.02 -0.47 0.00 2.43 0.24 0.96 114.38 116.99 1uk5 h ARG 87 Ca 0.13 0.07 0.14 0.00 -0.81 0.00 0.00 59.98 59.50 1uk5 h ARG 87 Cb -0.05 0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1uk5 h ARG 87 CO -0.03 -0.68 0.42 0.07 -1.51 0.00 0.00 179.97 178.24 1uk5 h ARG 88 N -1.06 0.00 0.18 0.20 0.11 0.42 0.35 114.38 114.58 1uk5 h ARG 88 Ca -0.10 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.98 1uk5 h ARG 88 Cb 0.84 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.92 1uk5 h ARG 88 CO 0.10 0.00 -0.09 0.22 0.10 0.00 0.00 179.97 180.31 1uk5 h ASP 89 N 0.00 -0.21 -0.68 0.08 3.58 0.24 -1.06 116.42 118.37 1uk5 h ASP 89 Ca 0.22 0.01 0.13 0.00 0.42 0.00 0.00 57.03 57.80 1uk5 h ASP 89 Cb 1.05 0.05 -0.09 0.00 1.72 0.00 0.00 39.33 42.07 1uk5 h ASP 89 CO -0.00 0.26 0.23 1.23 -2.88 0.00 0.00 179.24 178.08 1uk5 h GLY 90 N -1.07 0.98 0.82 -0.78 0.00 0.17 0.82 103.07 104.01 1uk5 h GLY 90 Ca -0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1uk5 h GLY 90 CO 0.04 -0.09 0.02 -2.08 0.00 0.00 0.00 176.54 174.43 1uk5 h VAL 91 N 0.38 1.18 -0.41 4.60 2.07 -0.45 -1.30 116.25 122.31 1uk5 h VAL 91 Ca 0.37 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 67.36 1uk5 h VAL 91 Cb 0.54 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1uk5 h VAL 91 CO -0.39 0.15 0.27 -0.09 0.02 0.00 0.00 177.57 177.54 1uk5 h ARG 92 N -0.07 0.52 0.14 1.57 2.43 0.06 -0.85 114.38 118.17 1uk5 h ARG 92 Ca 0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1uk5 h ARG 92 Cb 0.22 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1uk5 h ARG 92 CO -0.00 0.34 -0.07 -0.22 -1.51 0.00 0.00 179.97 178.52 1uk5 h LYS 93 N 0.53 -0.18 -0.83 0.20 3.64 0.10 -2.05 116.57 117.99 1uk5 h LYS 93 Ca 0.16 0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.70 1uk5 h LYS 93 Cb -0.02 0.04 -0.15 0.00 -0.41 0.00 0.00 32.23 31.69 1uk5 h LYS 93 CO -0.04 -0.12 -0.30 0.28 -2.27 0.00 0.00 179.45 177.01 1uk5 h VAL 94 N -0.22 0.11 -0.66 2.00 2.07 -1.14 0.29 116.25 118.70 1uk5 h VAL 94 Ca -0.02 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.61 1uk5 h VAL 94 Cb 0.14 0.11 -0.12 0.00 -1.52 0.00 0.00 31.29 29.90 1uk5 h VAL 94 CO 0.03 0.00 -0.38 1.56 0.02 0.00 0.00 177.57 178.80 1uk5 h GLN 95 N -0.05 -0.15 -0.83 1.57 1.08 -1.16 0.99 115.11 116.56 1uk5 h GLN 95 Ca 0.34 0.01 0.18 0.00 -1.45 0.00 0.00 58.65 57.73 1uk5 h GLN 95 Cb 0.60 0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 28.00 1uk5 h GLN 95 CO -0.86 -0.10 0.56 1.15 -0.95 0.00 0.00 178.83 178.63 1uk5 h THR 96 N -0.16 0.73 -0.35 -0.54 2.02 0.30 0.26 112.91 115.18 1uk5 h THR 96 Ca 0.23 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.16 1uk5 h THR 96 Cb 0.56 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1uk5 h THR 96 CO -0.74 0.07 -0.23 0.40 0.37 0.00 0.00 175.52 175.40 1uk5 h ILE 97 N 0.41 1.29 -0.16 3.11 2.04 0.17 -1.00 117.51 123.37 1uk5 h ILE 97 Ca 0.42 -1.37 -0.01 0.00 1.00 0.00 0.00 64.86 64.90 1uk5 h ILE 97 Cb 1.03 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 1uk5 h ILE 97 CO -0.15 0.45 0.07 -0.07 0.00 0.00 0.00 178.15 178.45 1uk5 h LEU 98 N 0.55 0.21 -2.02 1.44 3.38 0.23 0.61 115.31 119.72 1uk5 h LEU 98 Ca 0.07 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1uk5 h LEU 98 Cb 0.79 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1uk5 h LEU 98 CO 0.06 0.31 -0.04 -0.33 0.09 0.00 0.00 178.44 178.53 1uk5 h GLU 99 N 0.11 0.00 0.08 1.13 5.08 -0.61 -1.97 114.58 118.41 1uk5 h GLU 99 Ca 0.05 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.28 1uk5 h GLU 99 Cb 0.15 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.42 1uk5 h GLU 99 CO -0.01 0.04 -0.56 -0.22 -1.00 0.00 0.00 179.01 177.27 1uk5 h LYS 100 N 0.00 0.23 -0.01 2.33 3.64 -0.42 -3.22 116.57 119.12 1uk5 h LYS 100 Ca -0.00 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1uk5 h LYS 100 Cb 0.08 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1uk5 h LYS 100 CO 0.01 1.14 -0.07 1.25 -2.27 0.00 0.00 179.45 179.51 1uk5 h LEU 101 N -0.49 -0.23 -0.97 5.20 6.46 0.84 1.02 115.31 127.14 1uk5 h LEU 101 Ca -0.09 0.03 0.40 0.00 -0.12 0.00 0.00 57.88 58.10 1uk5 h LEU 101 Cb 1.40 0.09 -0.17 0.00 -0.73 0.00 0.00 40.66 41.25 1uk5 h LEU 101 CO 0.11 -0.07 0.51 -1.84 -0.62 0.00 0.00 178.44 176.53 1uk5 n GLU 102 N -2.93 -0.06 -0.04 1.25 0.28 -0.80 0.16 120.64 118.50 1uk5 n GLU 102 Ca -0.01 1.34 -0.13 0.00 -0.16 0.00 0.00 57.16 58.19 1uk5 n GLU 102 Cb 0.05 -2.39 -0.09 0.00 1.43 0.00 0.00 31.44 30.44 1uk5 n GLU 102 CO 0.00 0.00 0.00 1.96 -0.16 0.00 0.00 177.13 178.93 1uk5 h GLN 103 N 0.00 0.21 -0.79 3.44 1.08 -0.99 -0.51 115.11 117.56 1uk5 h GLN 103 Ca 0.82 -0.12 0.15 0.00 -1.45 0.00 0.00 58.65 58.04 1uk5 h GLN 103 Cb 2.15 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 29.53 1uk5 h GLN 103 CO -0.75 0.67 0.52 0.87 -0.95 0.00 0.00 178.83 179.19 1uk5 h LYS 104 N -0.23 0.46 -0.06 1.46 1.79 0.95 0.65 116.57 121.59 1uk5 h LYS 104 Ca 0.01 -0.03 -0.23 0.00 -2.18 0.00 0.00 60.65 58.22 1uk5 h LYS 104 Cb 0.64 -0.10 0.02 0.00 -1.58 0.00 0.00 32.23 31.20 1uk5 h LYS 104 CO 0.02 0.31 -0.85 0.00 -1.08 0.00 0.00 179.45 177.85 1uk5 h ALA 105 N 1.63 0.19 0.00 3.86 0.00 -0.47 -2.87 119.26 121.60 1uk5 h ALA 105 Ca 0.39 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1uk5 h ALA 105 Cb 0.82 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1uk5 h ALA 105 CO -0.14 0.61 0.00 0.45 0.00 0.00 0.00 179.25 180.18 1uk5 n SER 106 N -3.97 0.00 0.00 0.00 2.88 0.32 -3.82 113.62 109.04 1uk5 n SER 106 Ca -0.09 -0.87 0.00 0.00 -1.33 0.00 0.00 58.87 56.57 1uk5 n SER 106 Cb 0.79 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.25 1uk5 n SER 106 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uk5 n GLY 107 N 0.73 3.35 3.76 0.46 0.00 0.20 -5.03 105.19 108.66 1uk5 n GLY 107 Ca 0.21 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.53 1uk5 n GLY 107 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uk5 s PRO 108 N -5.51 -0.43 -0.30 1.61 0.04 -1.25 -4.22 135.00 124.93 1uk5 s PRO 108 Ca 0.00 -0.30 -0.09 0.00 0.04 0.00 0.00 61.00 60.65 1uk5 s PRO 108 Cb 0.00 -1.71 0.19 0.00 0.04 0.00 0.00 34.50 33.02 1uk5 s PRO 108 CO 0.00 -3.14 0.99 0.45 0.04 0.00 0.00 177.00 175.33 1uk5 s SER 109 N -4.45 -0.56 -0.30 6.66 0.15 -1.26 -5.04 113.70 108.91 1uk5 s SER 109 Ca 0.73 0.00 -0.08 0.00 0.70 0.00 0.00 55.95 57.31 1uk5 s SER 109 Cb -0.06 1.23 0.18 0.00 -1.71 0.00 0.00 66.02 65.67 1uk5 s SER 109 CO 0.55 -0.10 0.91 -0.94 1.20 0.00 0.00 173.24 174.86 1uk5 s SER 110 N 2.76 -0.77 0.00 5.45 1.04 -1.26 -4.90 113.70 116.02 1uk5 s SER 110 Ca 0.24 0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.99 1uk5 s SER 110 Cb -0.02 1.58 0.00 0.00 0.10 0.00 0.00 66.02 67.68 1uk5 s SER 110 CO -0.22 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.47