#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 -0.63 -0.20 1.61 1.04 -1.26 -5.18 113.70 109.08 1uk5 s SER 2 Ca 0.00 0.51 -0.35 0.00 0.48 0.00 0.00 55.95 56.59 1uk5 s SER 2 Cb 0.00 0.55 0.14 0.00 0.10 0.00 0.00 66.02 66.82 1uk5 s SER 2 CO 0.00 -0.71 1.23 -0.94 0.98 0.00 0.00 173.24 173.80 1uk5 s SER 3 N -1.63 -0.12 0.00 7.02 1.04 -1.26 -5.13 113.70 113.62 1uk5 s SER 3 Ca -0.07 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.37 1uk5 s SER 3 Cb -0.00 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.25 1uk5 s SER 3 CO 0.03 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.66 1uk5 n GLY 4 N -0.04 -0.08 3.61 7.32 0.00 -1.26 -5.18 105.19 109.56 1uk5 n GLY 4 Ca 0.01 -1.06 -0.08 0.00 0.00 0.00 0.00 46.02 44.88 1uk5 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uk5 s SER 5 N 0.00 -0.31 -0.29 1.61 1.04 -1.26 -4.92 113.70 109.57 1uk5 s SER 5 Ca 0.00 0.42 -0.24 0.00 0.48 0.00 0.00 55.95 56.61 1uk5 s SER 5 Cb 0.00 0.37 0.15 0.00 0.10 0.00 0.00 66.02 66.64 1uk5 s SER 5 CO 0.00 -0.23 1.16 -0.55 0.98 0.00 0.00 173.24 174.60 1uk5 s SER 6 N -0.72 -0.32 -0.06 7.02 0.15 -1.26 -5.18 113.70 113.33 1uk5 s SER 6 Ca 0.02 0.60 -0.17 0.00 0.70 0.00 0.00 55.95 57.09 1uk5 s SER 6 Cb -0.02 0.68 0.04 0.00 -1.71 0.00 0.00 66.02 65.01 1uk5 s SER 6 CO -0.03 -0.10 0.40 -0.83 1.20 0.00 0.00 173.24 173.88 1uk5 s GLY 7 N 0.31 -0.27 0.07 9.45 0.00 -1.26 -5.10 107.32 110.52 1uk5 s GLY 7 Ca 0.03 0.75 0.03 0.00 0.00 0.00 0.00 44.72 45.53 1uk5 s GLY 7 CO -0.10 0.53 -0.10 0.00 0.00 0.00 0.00 173.10 173.43 1uk5 s ALA 8 N -0.82 0.88 1.02 3.20 0.00 -1.26 -5.16 121.76 119.62 1uk5 s ALA 8 Ca -0.09 -0.97 -0.16 0.00 0.00 0.00 0.00 51.96 50.75 1uk5 s ALA 8 Cb -0.04 0.01 0.21 0.00 0.00 0.00 0.00 23.12 23.30 1uk5 s ALA 8 CO 0.04 0.01 1.19 -1.25 0.00 0.00 0.00 175.76 175.75 1uk5 s PRO 9 N -2.06 0.23 0.12 0.00 0.04 -1.26 -4.82 135.00 127.24 1uk5 s PRO 9 Ca -0.03 -0.05 0.00 0.00 0.04 0.00 0.00 61.00 60.96 1uk5 s PRO 9 Cb -0.07 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.70 1uk5 s PRO 9 CO 0.00 -2.75 0.00 0.00 0.04 0.00 0.00 177.00 174.30 1uk5 n ALA 10 N -4.08 -2.00 0.00 8.56 0.00 -1.26 -5.07 120.51 116.66 1uk5 n ALA 10 Ca 0.11 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1uk5 n ALA 10 Cb 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1uk5 n ALA 10 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uk5 n GLU 11 N 1.93 0.00 -2.35 0.00 1.02 -1.26 -5.16 120.64 114.81 1uk5 n GLU 11 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.81 1uk5 n GLU 11 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 1uk5 n GLU 11 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1uk5 s PRO 12 N 0.00 3.63 1.10 3.49 0.04 -1.26 -5.01 135.00 137.00 1uk5 s PRO 12 Ca 0.00 1.28 -0.20 0.00 0.04 0.00 0.00 61.00 62.12 1uk5 s PRO 12 Cb 0.00 -2.07 0.05 0.00 0.04 0.00 0.00 34.50 32.52 1uk5 s PRO 12 CO 0.00 -0.56 -0.27 0.00 0.04 0.00 0.00 177.00 176.21 1uk5 n ALA 13 N -1.39 -4.48 -2.41 8.56 0.00 -1.26 -5.02 120.51 114.52 1uk5 n ALA 13 Ca 0.09 -1.32 -0.21 0.00 0.00 0.00 0.00 53.44 52.00 1uk5 n ALA 13 Cb 0.53 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.49 1uk5 n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uk5 s ALA 14 N -2.19 2.36 1.01 0.00 0.00 -1.26 -5.14 121.76 116.55 1uk5 s ALA 14 Ca 0.53 -1.77 -0.16 0.00 0.00 0.00 0.00 51.96 50.56 1uk5 s ALA 14 Cb -0.08 -0.16 0.20 0.00 0.00 0.00 0.00 23.12 23.09 1uk5 s ALA 14 CO 0.66 0.16 1.19 -1.25 0.00 0.00 0.00 175.76 176.52 1uk5 s PRO 15 N -3.59 0.27 0.39 0.00 0.04 -1.26 -5.10 135.00 125.76 1uk5 s PRO 15 Ca 0.26 -0.04 0.05 0.00 0.04 0.00 0.00 61.00 61.32 1uk5 s PRO 15 Cb -0.03 -1.77 -0.02 0.00 0.04 0.00 0.00 34.50 32.72 1uk5 s PRO 15 CO 0.11 -2.72 0.19 0.15 0.04 0.00 0.00 177.00 174.76 1uk5 s LYS 16 N -5.51 1.90 0.01 4.56 1.02 -1.26 -5.03 119.74 115.43 1uk5 s LYS 16 Ca 0.69 -2.15 -0.04 0.00 0.02 0.00 0.00 55.97 54.49 1uk5 s LYS 16 Cb -0.10 -0.27 -0.01 0.00 -0.52 0.00 0.00 37.83 36.93 1uk5 s LYS 16 CO 0.54 -0.56 0.06 -1.12 -0.92 0.00 0.00 175.35 173.35 1uk5 s SER 17 N -3.54 0.11 -0.32 2.83 0.01 -1.26 -5.09 113.70 106.43 1uk5 s SER 17 Ca 0.29 -0.30 -0.04 0.00 1.31 0.00 0.00 55.95 57.21 1uk5 s SER 17 Cb 0.02 0.16 0.27 0.00 0.21 0.00 0.00 66.02 66.68 1uk5 s SER 17 CO 0.19 -0.32 1.24 0.61 0.41 0.00 0.00 173.24 175.37 1uk5 n GLY 18 N 1.63 -1.83 3.55 3.44 0.00 -1.26 -5.17 105.19 105.54 1uk5 n GLY 18 Ca -0.22 1.09 -0.26 0.00 0.00 0.00 0.00 46.02 46.63 1uk5 n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uk5 s GLU 19 N 0.22 1.84 0.56 1.61 2.02 -1.26 -5.15 118.70 118.53 1uk5 s GLU 19 Ca 0.25 -1.91 0.03 0.00 0.02 0.00 0.00 54.97 53.36 1uk5 s GLU 19 Cb 0.19 -1.73 0.05 0.00 0.10 0.00 0.00 34.13 32.74 1uk5 s GLU 19 CO -0.08 0.15 0.77 0.00 0.02 0.00 0.00 175.26 176.12 1uk5 s ALA 20 N -2.60 4.02 0.41 5.21 0.00 -1.26 -4.95 121.76 122.60 1uk5 s ALA 20 Ca 0.33 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.80 1uk5 s ALA 20 Cb 0.02 -1.96 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1uk5 s ALA 20 CO 0.17 -0.78 0.00 -1.91 0.00 0.00 0.00 175.76 173.24 1uk5 n GLU 21 N -2.33 -4.88 -3.35 0.00 2.13 -1.26 -5.01 120.64 105.94 1uk5 n GLU 21 Ca 0.09 3.56 -0.15 0.00 0.66 0.00 0.00 57.16 61.32 1uk5 n GLU 21 Cb 0.60 -3.94 -0.07 0.00 0.27 0.00 0.00 31.44 28.30 1uk5 n GLU 21 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1uk5 s THR 22 N -2.38 -0.41 0.95 6.31 2.01 -1.26 -5.15 115.64 115.70 1uk5 s THR 22 Ca 0.00 -0.80 -0.13 0.00 0.31 0.00 0.00 61.69 61.06 1uk5 s THR 22 Cb 0.00 -0.69 0.16 0.00 0.01 0.00 0.00 72.50 71.98 1uk5 s THR 22 CO 0.00 -0.50 1.16 -2.16 -0.69 0.00 0.00 174.62 172.42 1uk5 s PRO 23 N 1.67 0.82 -0.01 4.92 0.04 -1.26 -4.99 135.00 136.19 1uk5 s PRO 23 Ca 0.15 0.17 -0.30 0.00 0.04 0.00 0.00 61.00 61.06 1uk5 s PRO 23 Cb -0.14 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 1uk5 s PRO 23 CO -0.10 -2.39 1.20 -1.25 0.04 0.00 0.00 177.00 174.50 1uk5 s PRO 24 N -5.37 4.39 0.00 0.56 0.04 -1.26 -4.99 135.00 128.37 1uk5 s PRO 24 Ca 0.66 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.40 1uk5 s PRO 24 Cb -0.13 -3.48 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1uk5 s PRO 24 CO 0.54 -0.37 0.00 0.36 0.04 0.00 0.00 177.00 177.56 1uk5 n LYS 25 N 4.72 1.88 -3.35 4.56 2.85 -1.26 -5.13 118.16 122.44 1uk5 n LYS 25 Ca 0.10 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.98 1uk5 n LYS 25 Cb 0.46 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.78 1uk5 n LYS 25 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 1uk5 s HIS 26 N 3.13 3.73 0.15 5.58 5.65 -1.26 -4.98 115.29 127.28 1uk5 s HIS 26 Ca 0.00 1.11 -0.03 0.00 0.25 0.00 0.00 55.06 56.39 1uk5 s HIS 26 Cb 0.00 -2.44 -0.04 0.00 -1.18 0.00 0.00 32.58 28.92 1uk5 s HIS 26 CO 0.00 0.52 1.35 -1.00 -0.65 0.00 0.00 174.74 174.97 1uk5 h PRO 27 N 5.03 0.41 -0.78 2.88 0.13 -2.00 -2.99 132.00 134.68 1uk5 h PRO 27 Ca -0.49 -0.39 0.16 0.00 -0.87 0.00 0.00 66.00 64.41 1uk5 h PRO 27 Cb 1.21 0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 1uk5 h PRO 27 CO 0.65 1.05 0.52 0.78 -0.23 0.00 0.00 178.00 180.78 1uk5 h GLY 28 N 1.27 0.75 0.20 1.56 0.00 -1.94 0.33 103.07 105.25 1uk5 h GLY 28 Ca -0.06 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 1uk5 h GLY 28 CO 0.15 0.05 -0.03 -2.08 0.00 0.00 0.00 176.54 174.63 1uk5 h VAL 29 N 0.43 1.18 -1.11 4.60 2.07 -1.87 -3.21 116.25 118.34 1uk5 h VAL 29 Ca 0.39 -1.58 0.30 0.00 0.82 0.00 0.00 66.70 66.63 1uk5 h VAL 29 Cb 0.89 2.11 -0.09 0.00 -1.52 0.00 0.00 31.29 32.68 1uk5 h VAL 29 CO -0.13 0.35 0.73 -0.07 0.02 0.00 0.00 177.57 178.47 1uk5 h LEU 30 N -0.88 0.33 -1.00 2.57 3.38 -1.20 0.41 115.31 118.93 1uk5 h LEU 30 Ca -0.01 0.07 0.38 0.00 0.09 0.00 0.00 57.88 58.42 1uk5 h LEU 30 Cb 0.64 0.03 -0.17 0.00 0.09 0.00 0.00 40.66 41.24 1uk5 h LEU 30 CO 0.01 0.03 0.52 0.50 0.09 0.00 0.00 178.44 179.60 1uk5 h LYS 31 N 0.28 0.09 0.04 1.13 3.64 -0.96 1.46 116.57 122.24 1uk5 h LYS 31 Ca 0.62 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.88 1uk5 h LYS 31 Cb 1.80 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 33.61 1uk5 h LYS 31 CO -0.26 0.06 -0.48 -0.39 -2.27 0.00 0.00 179.45 176.11 1uk5 h VAL 32 N 0.10 1.53 -0.57 2.00 -1.51 -0.35 -3.18 116.25 114.27 1uk5 h VAL 32 Ca 0.80 -2.19 0.11 0.00 -1.23 0.00 0.00 66.70 64.19 1uk5 h VAL 32 Cb 2.03 2.90 -0.03 0.00 -2.13 0.00 0.00 31.29 34.06 1uk5 h VAL 32 CO -0.73 0.61 0.39 -0.33 -1.23 0.00 0.00 177.57 176.28 1uk5 h GLU 33 N -0.40 0.30 -0.44 5.19 5.08 0.98 0.60 114.58 125.88 1uk5 h GLU 33 Ca -0.07 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1uk5 h GLU 33 Cb 1.27 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 1uk5 h GLU 33 CO 0.09 0.20 0.20 0.00 -1.00 0.00 0.00 179.01 178.50 1uk5 h ALA 34 N 1.72 0.57 -0.02 3.43 0.00 0.15 0.12 119.26 125.23 1uk5 h ALA 34 Ca 0.27 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1uk5 h ALA 34 Cb 0.64 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1uk5 h ALA 34 CO -0.06 0.15 -0.09 0.82 0.00 0.00 0.00 179.25 180.06 1uk5 h ILE 35 N 0.57 1.50 -0.92 0.00 2.04 -0.98 -3.09 117.51 116.63 1uk5 h ILE 35 Ca 0.15 -1.60 0.22 0.00 1.00 0.00 0.00 64.86 64.63 1uk5 h ILE 35 Cb 0.14 2.50 -0.07 0.00 -0.74 0.00 0.00 36.82 38.66 1uk5 h ILE 35 CO -0.02 0.43 0.61 -0.07 0.00 0.00 0.00 178.15 179.11 1uk5 h LEU 36 N -0.51 0.35 -1.52 1.44 -0.00 0.20 0.79 115.31 116.07 1uk5 h LEU 36 Ca -0.01 0.04 0.01 0.00 -0.00 0.00 0.00 57.88 57.92 1uk5 h LEU 36 Cb 0.75 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.36 1uk5 h LEU 36 CO 0.02 0.13 0.33 -0.08 -0.00 0.00 0.00 178.44 178.84 1uk5 h GLU 37 N 0.35 0.64 0.12 1.13 4.81 -0.66 -1.88 114.58 119.08 1uk5 h GLU 37 Ca 0.48 -0.04 -0.24 0.00 -0.13 0.00 0.00 59.36 59.42 1uk5 h GLU 37 Cb 1.29 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1uk5 h GLU 37 CO -0.17 0.42 -1.21 0.87 -0.73 0.00 0.00 179.01 178.20 1uk5 h LYS 38 N 0.66 0.25 -0.87 1.92 1.57 0.36 -3.34 116.57 117.11 1uk5 h LYS 38 Ca 0.18 -0.43 0.22 0.00 -1.87 0.00 0.00 60.65 58.75 1uk5 h LYS 38 Cb -0.05 0.16 -0.16 0.00 0.08 0.00 0.00 32.23 32.26 1uk5 h LYS 38 CO -0.04 1.20 0.02 0.28 -0.57 0.00 0.00 179.45 180.34 1uk5 h VAL 39 N -0.36 0.19 -0.80 0.50 2.07 -0.07 0.68 116.25 118.46 1uk5 h VAL 39 Ca -0.25 -0.02 0.19 0.00 0.82 0.00 0.00 66.70 67.43 1uk5 h VAL 39 Cb 1.70 0.12 -0.14 0.00 -1.52 0.00 0.00 31.29 31.45 1uk5 h VAL 39 CO 0.08 0.01 -0.01 1.56 0.02 0.00 0.00 177.57 179.23 1uk5 h GLN 40 N 0.07 0.08 -0.38 1.57 1.08 -1.47 1.30 115.11 117.36 1uk5 h GLN 40 Ca 0.50 -0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.77 1uk5 h GLN 40 Cb 0.95 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.34 1uk5 h GLN 40 CO -0.79 0.05 0.26 0.78 -0.95 0.00 0.00 178.83 178.19 1uk5 h GLY 41 N 0.08 0.22 1.92 3.46 0.00 0.20 0.13 103.07 109.08 1uk5 h GLY 41 Ca 0.44 -0.07 -0.21 0.00 0.00 0.00 0.00 47.33 47.49 1uk5 h GLY 41 CO -0.72 0.05 -1.00 1.41 0.00 0.00 0.00 176.54 176.27 1uk5 h LEU 42 N 0.17 0.09 -0.95 3.11 3.38 0.17 -3.21 115.31 118.07 1uk5 h LEU 42 Ca 0.17 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 1uk5 h LEU 42 Cb 0.48 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1uk5 h LEU 42 CO -0.03 1.03 -0.00 -0.08 0.09 0.00 0.00 178.44 179.45 1uk5 h GLU 43 N 0.02 0.76 -0.92 1.13 4.22 0.20 -2.51 114.58 117.48 1uk5 h GLU 43 Ca -0.03 -0.20 -0.00 0.00 0.08 0.00 0.00 59.36 59.20 1uk5 h GLU 43 Cb 1.73 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.85 1uk5 h GLU 43 CO 0.14 0.78 0.57 1.96 -2.18 0.00 0.00 179.01 180.27 1uk5 h GLN 44 N 0.71 1.25 0.01 1.92 1.08 -1.26 0.18 115.11 119.00 1uk5 h GLN 44 Ca 0.14 -0.11 -0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1uk5 h GLN 44 Cb 0.44 -0.26 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 1uk5 h GLN 44 CO 0.02 0.87 -0.00 0.00 -0.95 0.00 0.00 178.83 178.76 1uk5 h ALA 45 N 1.31 -0.01 0.82 3.87 0.00 -1.50 0.30 119.26 124.04 1uk5 h ALA 45 Ca 0.33 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 1uk5 h ALA 45 Cb -0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1uk5 h ALA 45 CO -0.06 -0.49 -0.43 0.28 0.00 0.00 0.00 179.25 178.55 1uk5 h VAL 46 N -0.05 0.00 -0.48 0.00 2.07 -1.09 1.25 116.25 117.94 1uk5 h VAL 46 Ca -0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 1uk5 h VAL 46 Cb 0.05 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.80 1uk5 h VAL 46 CO 0.00 0.00 0.55 -0.78 0.02 0.00 0.00 177.57 177.36 1uk5 h ASP 47 N -1.14 0.00 -0.50 0.57 1.82 -0.62 0.79 116.42 117.34 1uk5 h ASP 47 Ca -0.11 0.00 -0.36 0.00 -0.39 0.00 0.00 57.03 56.17 1uk5 h ASP 47 Cb 0.89 0.00 -0.26 0.00 0.68 0.00 0.00 39.33 40.64 1uk5 h ASP 47 CO 0.16 0.00 -0.55 -1.54 -1.61 0.00 0.00 179.24 175.70 1uk5 n SER 48 N -3.61 3.88 -4.99 2.28 3.41 0.10 -5.04 113.62 109.65 1uk5 n SER 48 Ca 0.09 -3.81 -0.19 0.00 -0.26 0.00 0.00 58.87 54.71 1uk5 n SER 48 Cb 0.74 -0.47 -0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1uk5 n SER 48 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1uk5 s PHE 49 N -3.47 3.08 -0.30 7.33 5.36 0.42 -4.83 117.98 125.57 1uk5 s PHE 49 Ca 0.47 -0.24 -0.12 0.00 -0.96 0.00 0.00 56.93 56.08 1uk5 s PHE 49 Cb 0.40 -2.02 0.14 0.00 -0.34 0.00 0.00 43.02 41.21 1uk5 s PHE 49 CO -0.00 -0.04 0.78 -1.83 -1.46 0.00 0.00 175.22 172.67 1uk5 s GLU 50 N -4.18 0.47 0.00 10.12 -1.05 -1.26 -4.96 118.70 117.84 1uk5 s GLU 50 Ca 0.46 1.18 0.00 0.00 -0.15 0.00 0.00 54.97 56.45 1uk5 s GLU 50 Cb -0.09 0.70 0.00 0.00 -0.44 0.00 0.00 34.13 34.30 1uk5 s GLU 50 CO 0.31 -0.16 0.00 0.41 0.95 0.00 0.00 175.26 176.77 1uk5 n GLY 51 N 5.25 -0.24 0.00 -3.83 0.00 -1.26 -4.95 105.19 100.16 1uk5 n GLY 51 Ca -0.11 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 0.00 0.06 1.61 2.85 -1.25 -4.33 118.16 117.10 1uk5 n LYS 52 Ca 0.00 0.00 0.13 0.00 -1.05 0.00 0.00 58.31 57.39 1uk5 n LYS 52 Cb 0.00 0.00 0.37 0.00 -0.65 0.00 0.00 35.03 34.75 1uk5 n LYS 52 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1uk5 n LYS 53 N 0.00 0.19 -0.02 -1.58 5.02 -1.26 -3.42 118.16 117.09 1uk5 n LYS 53 Ca 0.00 0.12 -0.10 0.00 -2.02 0.00 0.00 58.31 56.30 1uk5 n LYS 53 Cb 0.00 -1.68 -0.14 0.00 -0.02 0.00 0.00 35.03 33.19 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 -1.99 1.62 -1.64 -0.18 -2.24 -1.26 -4.69 114.28 103.89 1uk5 n THR 54 Ca 0.05 -0.78 -0.38 0.00 -2.27 0.00 0.00 64.05 60.67 1uk5 n THR 54 Cb 0.41 -1.09 0.05 0.00 -2.10 0.00 0.00 70.33 67.60 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 -3.08 1.28 -0.09 3.42 9.92 -1.22 -4.84 116.55 121.93 1uk5 n ASP 55 Ca -0.20 0.87 -0.10 0.00 -0.53 0.00 0.00 54.79 54.83 1uk5 n ASP 55 Cb 1.06 -1.43 -0.03 0.00 -0.64 0.00 0.00 41.12 40.08 1uk5 n ASP 55 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 1uk5 h LYS 56 N 0.83 0.46 -1.60 -1.24 3.11 -1.91 -2.10 116.57 114.11 1uk5 h LYS 56 Ca -0.48 -0.11 0.48 0.00 -2.81 0.00 0.00 60.65 57.73 1uk5 h LYS 56 Cb 1.35 -0.06 -0.09 0.00 -1.00 0.00 0.00 32.23 32.43 1uk5 h LYS 56 CO 0.53 0.53 1.12 -0.22 -2.81 0.00 0.00 179.45 178.60 1uk5 h LYS 57 N 0.30 0.03 0.23 1.90 3.64 -1.92 1.64 116.57 122.40 1uk5 h LYS 57 Ca 0.09 -0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.16 1uk5 h LYS 57 Cb 0.27 -0.01 0.03 0.00 -0.41 0.00 0.00 32.23 32.12 1uk5 h LYS 57 CO -0.00 0.02 -1.38 -0.92 -2.27 0.00 0.00 179.45 174.91 1uk5 h TYR 58 N 0.03 0.88 0.18 1.91 3.20 -1.61 -2.89 116.97 118.67 1uk5 h TYR 58 Ca 0.82 -0.64 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1uk5 h TYR 58 Cb 3.06 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 41.30 1uk5 h TYR 58 CO -0.00 1.53 -0.09 -0.07 -1.64 0.00 0.00 178.16 177.89 1uk5 h LEU 59 N 0.04 -0.20 -1.95 2.82 4.07 0.24 0.53 115.31 120.86 1uk5 h LEU 59 Ca -0.24 -0.14 0.08 0.00 0.08 0.00 0.00 57.88 57.66 1uk5 h LEU 59 Cb 2.06 0.05 -0.01 0.00 1.08 0.00 0.00 40.66 43.84 1uk5 h LEU 59 CO 0.24 0.02 0.22 0.00 -1.08 0.00 0.00 178.44 177.84 1uk5 h MET 60 N -0.42 0.05 0.08 1.13 -0.00 -0.18 -1.81 114.93 113.78 1uk5 h MET 60 Ca -0.02 -0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.67 1uk5 h MET 60 Cb 0.33 -0.01 0.00 0.00 -0.00 0.00 0.00 31.60 31.91 1uk5 h MET 60 CO 0.04 0.04 -0.04 0.82 -0.00 0.00 0.00 176.91 177.77 1uk5 h ILE 61 N 0.06 0.00 -0.83 -0.10 2.04 -1.22 -3.06 117.51 114.39 1uk5 h ILE 61 Ca 0.14 -0.68 0.16 0.00 1.00 0.00 0.00 64.86 65.48 1uk5 h ILE 61 Cb 0.50 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.43 1uk5 h ILE 61 CO -0.01 0.00 -0.23 1.21 0.00 0.00 0.00 178.15 179.12 1uk5 n GLU 62 N -4.18 -0.09 -0.15 2.37 0.00 0.18 0.22 120.64 118.98 1uk5 n GLU 62 Ca -0.01 1.30 -0.04 0.00 0.00 0.00 0.00 57.16 58.40 1uk5 n GLU 62 Cb 0.04 -1.94 0.05 0.00 0.00 0.00 0.00 31.44 29.59 1uk5 n GLU 62 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 1uk5 h GLU 63 N 0.00 0.37 -0.31 5.31 4.11 -1.46 -0.21 114.58 122.39 1uk5 h GLU 63 Ca 0.38 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.78 1uk5 h GLU 63 Cb 0.59 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1uk5 h GLU 63 CO -0.85 0.24 0.17 1.88 0.07 0.00 0.00 179.01 180.52 1uk5 h TYR 64 N 0.38 0.43 0.00 2.06 0.05 0.27 0.11 116.97 120.28 1uk5 h TYR 64 Ca 0.22 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.99 1uk5 h TYR 64 Cb 0.19 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 37.79 1uk5 h TYR 64 CO -0.14 0.35 0.00 1.28 -1.05 0.00 0.00 178.16 178.60 1uk5 n LEU 65 N -4.80 0.00 -0.31 3.88 4.32 0.11 -2.60 117.00 117.59 1uk5 n LEU 65 Ca -0.01 0.89 0.15 0.00 -0.02 0.00 0.00 56.01 57.01 1uk5 n LEU 65 Cb 0.08 -0.39 0.31 0.00 -1.62 0.00 0.00 43.42 41.81 1uk5 n LEU 65 CO 0.35 -0.39 0.93 0.74 -1.22 0.00 0.00 177.39 177.81 1uk5 h THR 66 N 0.00 0.25 -0.96 -5.08 2.02 -1.11 0.42 112.91 108.45 1uk5 h THR 66 Ca 0.00 -0.06 0.25 0.00 0.77 0.00 0.00 66.41 67.37 1uk5 h THR 66 Cb 0.00 0.07 -0.18 0.00 -1.74 0.00 0.00 68.15 66.30 1uk5 h THR 66 CO 0.00 0.03 -0.04 0.29 0.37 0.00 0.00 175.52 176.17 1uk5 n LYS 67 N -5.26 -0.08 -0.08 6.66 5.02 0.40 0.19 118.16 125.00 1uk5 n LYS 67 Ca 0.23 1.45 -0.09 0.00 -2.02 0.00 0.00 58.31 57.88 1uk5 n LYS 67 Cb 0.74 -2.27 -0.02 0.00 -0.02 0.00 0.00 35.03 33.46 1uk5 n LYS 67 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1uk5 h GLU 68 N 0.00 0.36 -0.45 1.97 4.39 0.04 -2.48 114.58 118.41 1uk5 h GLU 68 Ca 0.56 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 60.30 1uk5 h GLU 68 Cb 1.09 -0.08 -0.09 0.00 -0.10 0.00 0.00 28.75 29.57 1uk5 h GLU 68 CO -0.92 0.24 -0.48 -0.07 -1.16 0.00 0.00 179.01 176.61 1uk5 h LEU 69 N 0.37 -1.61 -0.92 1.33 4.07 0.21 1.07 115.31 119.82 1uk5 h LEU 69 Ca 0.11 0.23 0.21 0.00 0.08 0.00 0.00 57.88 58.52 1uk5 h LEU 69 Cb -0.02 0.69 -0.12 0.00 1.08 0.00 0.00 40.66 42.29 1uk5 h LEU 69 CO -0.04 -0.38 0.46 -0.07 -1.08 0.00 0.00 178.44 177.33 1uk5 h LEU 70 N -0.33 0.47 -1.05 1.67 3.38 -1.08 1.32 115.31 119.68 1uk5 h LEU 70 Ca 0.12 0.14 -0.10 0.00 0.09 0.00 0.00 57.88 58.13 1uk5 h LEU 70 Cb 0.59 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1uk5 h LEU 70 CO -0.61 0.07 -0.43 0.00 0.09 0.00 0.00 178.44 177.57 1uk5 h ALA 71 N 1.69 1.21 0.00 1.53 0.00 0.43 1.18 119.26 125.30 1uk5 h ALA 71 Ca 0.57 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1uk5 h ALA 71 Cb 1.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1uk5 h ALA 71 CO -0.48 0.57 -0.40 -0.07 0.00 0.00 0.00 179.25 178.86 1uk5 h LEU 72 N 0.08 0.00 0.00 0.00 3.38 0.92 -3.00 115.31 116.69 1uk5 h LEU 72 Ca 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 1uk5 h LEU 72 Cb 0.79 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.49 1uk5 h LEU 72 CO 0.06 0.40 -1.92 -0.67 0.09 0.00 0.00 178.44 176.40 1uk5 n ASP 73 N -3.53 0.59 -0.22 -0.43 2.03 0.12 -4.18 116.55 110.94 1uk5 n ASP 73 Ca -0.00 0.28 0.01 0.00 0.52 0.00 0.00 54.79 55.60 1uk5 n ASP 73 Cb 0.53 0.28 0.13 0.00 -0.72 0.00 0.00 41.12 41.34 1uk5 n ASP 73 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1uk5 h SER 74 N 0.00 0.24 -3.60 1.67 0.87 0.15 -3.42 113.55 109.47 1uk5 h SER 74 Ca -0.37 0.09 -0.57 0.00 -1.23 0.00 0.00 61.79 59.71 1uk5 h SER 74 Cb 2.08 0.07 0.15 0.00 -0.44 0.00 0.00 62.40 64.26 1uk5 h SER 74 CO 0.06 0.13 0.24 1.33 -0.53 0.00 0.00 176.83 178.06 1uk5 n VAL 75 N -5.00 3.55 -3.95 2.23 0.24 -1.16 -4.98 118.33 109.26 1uk5 n VAL 75 Ca 0.10 -0.50 -0.35 0.00 -2.04 0.00 0.00 64.34 61.55 1uk5 n VAL 75 Cb 0.31 -1.27 -0.14 0.00 -1.47 0.00 0.00 33.84 31.27 1uk5 n VAL 75 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1uk5 s ASP 76 N -1.09 4.28 0.41 -1.34 2.15 -1.26 -4.97 116.67 114.85 1uk5 s ASP 76 Ca 0.73 -0.76 0.22 0.00 0.43 0.00 0.00 52.55 53.18 1uk5 s ASP 76 Cb -0.44 -1.68 0.64 0.00 -0.30 0.00 0.00 42.92 41.14 1uk5 s ASP 76 CO 0.49 -0.10 1.71 1.55 -0.17 0.00 0.00 175.17 178.64 1uk5 h PRO 77 N 8.04 0.00 0.00 4.34 0.13 -1.92 -3.47 132.00 139.12 1uk5 h PRO 77 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1uk5 h PRO 77 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1uk5 h PRO 77 CO 0.59 0.24 0.00 0.39 -0.23 0.00 0.00 178.00 178.99 1uk5 n GLU 78 N -3.27 -1.03 0.00 0.86 -0.58 -1.26 -1.07 120.64 114.28 1uk5 n GLU 78 Ca 0.01 0.26 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 1uk5 n GLU 78 Cb 0.51 -4.13 0.00 0.00 -0.57 0.00 0.00 31.44 27.26 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 -0.80 0.27 3.56 0.62 0.00 -1.26 -5.02 105.19 102.56 1uk5 n GLY 79 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.92 2.74 0.24 1.61 3.00 -0.23 -4.83 118.95 120.54 1uk5 s ARG 80 Ca 0.00 0.97 -0.08 0.00 0.00 0.00 0.00 55.73 56.62 1uk5 s ARG 80 Cb 0.00 -4.37 0.40 0.00 0.00 0.00 0.00 34.95 30.98 1uk5 s ARG 80 CO 0.00 -2.58 1.63 0.00 0.00 0.00 0.00 175.30 174.35 1uk5 h ALA 81 N 15.13 0.71 -0.73 2.13 0.00 -1.96 0.67 119.26 135.22 1uk5 h ALA 81 Ca -0.28 0.24 0.14 0.00 0.00 0.00 0.00 54.91 55.01 1uk5 h ALA 81 Cb 1.18 0.44 -0.14 0.00 0.00 0.00 0.00 17.79 19.27 1uk5 h ALA 81 CO 1.16 -0.42 -0.25 -0.44 0.00 0.00 0.00 179.25 179.29 1uk5 h ASP 82 N 0.08 -0.91 0.46 0.00 5.19 -1.96 0.98 116.42 120.26 1uk5 h ASP 82 Ca 0.39 0.24 -0.02 0.00 -0.62 0.00 0.00 57.03 57.02 1uk5 h ASP 82 Cb 0.68 0.53 0.00 0.00 0.18 0.00 0.00 39.33 40.72 1uk5 h ASP 82 CO -0.67 -0.27 -0.22 0.58 -3.12 0.00 0.00 179.24 175.54 1uk5 h VAL 83 N -0.05 0.08 -0.94 -1.35 2.07 -0.75 -3.00 116.25 112.31 1uk5 h VAL 83 Ca 0.32 -0.56 0.23 0.00 0.82 0.00 0.00 66.70 67.51 1uk5 h VAL 83 Cb 0.56 0.13 -0.18 0.00 -1.52 0.00 0.00 31.29 30.28 1uk5 h VAL 83 CO -0.77 0.02 -0.08 0.54 0.02 0.00 0.00 177.57 177.29 1uk5 n ARG 84 N -5.19 -0.08 0.18 1.57 1.74 0.19 0.27 116.66 115.35 1uk5 n ARG 84 Ca -0.08 1.44 -0.16 0.00 -0.77 0.00 0.00 57.85 58.28 1uk5 n ARG 84 Cb 0.26 -2.23 -0.08 0.00 -1.02 0.00 0.00 32.46 29.38 1uk5 n ARG 84 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1uk5 h GLN 85 N 0.00 -0.74 -0.42 5.56 5.75 0.96 -0.56 115.11 125.66 1uk5 h GLN 85 Ca 0.52 0.05 0.09 0.00 -0.15 0.00 0.00 58.65 59.16 1uk5 h GLN 85 Cb 0.98 0.17 -0.09 0.00 1.07 0.00 0.00 27.48 29.61 1uk5 h GLN 85 CO -0.92 -0.50 -0.25 0.00 -2.65 0.00 0.00 178.83 174.51 1uk5 h ALA 86 N -0.42 0.01 -1.02 3.38 0.00 -0.03 0.42 119.26 121.60 1uk5 h ALA 86 Ca -0.01 0.13 0.25 0.00 0.00 0.00 0.00 54.91 55.29 1uk5 h ALA 86 Cb 0.74 0.57 -0.11 0.00 0.00 0.00 0.00 17.79 19.00 1uk5 h ALA 86 CO -0.18 -0.62 0.64 -0.09 0.00 0.00 0.00 179.25 179.00 1uk5 h ARG 87 N -0.17 0.48 0.16 0.00 2.43 -0.42 0.29 114.38 117.15 1uk5 h ARG 87 Ca 0.20 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1uk5 h ARG 87 Cb 0.48 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1uk5 h ARG 87 CO -0.52 0.32 -0.08 0.00 -1.51 0.00 0.00 179.97 178.19 1uk5 h ARG 88 N 0.50 -0.20 -0.82 0.20 3.08 0.13 -1.89 114.38 115.37 1uk5 h ARG 88 Ca 0.61 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.80 1uk5 h ARG 88 Cb 1.35 0.05 -0.13 0.00 0.08 0.00 0.00 29.97 31.31 1uk5 h ARG 88 CO -0.37 -0.14 -0.41 0.22 -1.07 0.00 0.00 179.97 178.21 1uk5 h ASP 89 N -0.34 -1.46 -0.71 7.04 1.82 -0.49 0.78 116.42 123.07 1uk5 h ASP 89 Ca -0.02 0.28 0.15 0.00 -0.39 0.00 0.00 57.03 57.05 1uk5 h ASP 89 Cb 0.16 0.72 -0.11 0.00 0.68 0.00 0.00 39.33 40.79 1uk5 h ASP 89 CO 0.04 -0.30 0.15 1.23 -1.61 0.00 0.00 179.24 178.75 1uk5 h GLY 90 N -0.08 0.95 0.86 -0.78 0.00 -0.52 0.62 103.07 104.11 1uk5 h GLY 90 Ca 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 1uk5 h GLY 90 CO -0.85 -0.19 0.05 -2.08 0.00 0.00 0.00 176.54 173.47 1uk5 h VAL 91 N 0.25 1.21 -0.16 4.60 2.07 0.10 -1.65 116.25 122.67 1uk5 h VAL 91 Ca 0.39 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1uk5 h VAL 91 Cb 0.65 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1uk5 h VAL 91 CO -0.50 0.21 0.11 0.03 0.02 0.00 0.00 177.57 177.44 1uk5 h ARG 92 N 0.15 0.10 0.37 1.57 3.08 0.22 0.83 114.38 120.70 1uk5 h ARG 92 Ca 0.07 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1uk5 h ARG 92 Cb 0.27 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1uk5 h ARG 92 CO 0.00 0.07 -0.18 -0.22 -1.07 0.00 0.00 179.97 178.57 1uk5 h LYS 93 N 0.11 -0.47 -0.17 0.04 1.63 0.71 -2.31 116.57 116.11 1uk5 h LYS 93 Ca 0.07 0.03 0.04 0.00 -0.85 0.00 0.00 60.65 59.94 1uk5 h LYS 93 Cb 0.13 0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.83 1uk5 h LYS 93 CO -0.01 -0.16 -0.10 0.28 -3.45 0.00 0.00 179.45 176.01 1uk5 h VAL 94 N -0.86 0.69 -0.80 2.00 2.07 -0.79 -1.51 116.25 117.05 1uk5 h VAL 94 Ca -0.05 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.66 1uk5 h VAL 94 Cb 0.54 0.69 -0.14 0.00 -1.52 0.00 0.00 31.29 30.86 1uk5 h VAL 94 CO 0.08 0.00 0.04 1.56 0.02 0.00 0.00 177.57 179.27 1uk5 h GLN 95 N -0.10 0.11 -0.39 1.57 4.20 -0.87 1.32 115.11 120.95 1uk5 h GLN 95 Ca 0.10 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.89 1uk5 h GLN 95 Cb 0.24 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1uk5 h GLN 95 CO -0.23 0.07 0.27 1.15 -0.67 0.00 0.00 178.83 179.43 1uk5 h THR 96 N 0.11 0.87 -0.38 -0.54 2.02 -0.69 0.12 112.91 114.43 1uk5 h THR 96 Ca 0.45 -0.05 -0.13 0.00 0.77 0.00 0.00 66.41 67.45 1uk5 h THR 96 Cb 0.82 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1uk5 h THR 96 CO -0.69 0.03 -0.28 0.40 0.37 0.00 0.00 175.52 175.35 1uk5 h ILE 97 N 0.14 1.28 0.27 3.11 2.04 0.20 -2.06 117.51 122.49 1uk5 h ILE 97 Ca 0.18 -1.42 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 1uk5 h ILE 97 Cb 0.54 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1uk5 h ILE 97 CO -0.02 0.47 -0.13 -0.07 0.00 0.00 0.00 178.15 178.40 1uk5 h LEU 98 N 0.69 -0.30 -2.24 1.44 -0.00 0.01 0.85 115.31 115.76 1uk5 h LEU 98 Ca 0.08 -0.14 0.00 0.00 -0.00 0.00 0.00 57.88 57.83 1uk5 h LEU 98 Cb 0.82 0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.56 1uk5 h LEU 98 CO 0.07 -0.04 0.09 -0.08 -0.00 0.00 0.00 178.44 178.49 1uk5 h GLU 99 N -0.58 0.00 0.00 1.13 4.22 -1.21 -1.42 114.58 116.72 1uk5 h GLU 99 Ca -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.40 1uk5 h GLU 99 Cb 0.42 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1uk5 h GLU 99 CO 0.06 0.00 -0.19 -0.22 -2.18 0.00 0.00 179.01 176.48 1uk5 h LYS 100 N 0.00 0.00 -0.64 1.92 3.64 -0.63 -3.31 116.57 117.55 1uk5 h LYS 100 Ca 0.00 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.49 1uk5 h LYS 100 Cb 0.19 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 31.89 1uk5 h LYS 100 CO 0.00 0.08 -0.33 1.25 -2.27 0.00 0.00 179.45 178.18 1uk5 h LEU 101 N -1.00 -1.15 -0.03 5.20 5.85 -0.26 0.11 115.31 124.03 1uk5 h LEU 101 Ca -0.01 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1uk5 h LEU 101 Cb 0.25 0.58 -0.00 0.00 0.37 0.00 0.00 40.66 41.86 1uk5 h LEU 101 CO -0.01 -0.30 -0.02 -0.62 -0.34 0.00 0.00 178.44 177.16 1uk5 n GLU 102 N -5.44 -0.01 -0.28 1.25 1.02 -0.59 0.27 120.64 116.86 1uk5 n GLU 102 Ca 0.05 0.95 0.07 0.00 -0.02 0.00 0.00 57.16 58.20 1uk5 n GLU 102 Cb 0.36 -1.42 0.21 0.00 -0.02 0.00 0.00 31.44 30.57 1uk5 n GLU 102 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1uk5 h GLN 103 N 0.00 0.52 -0.91 3.49 4.20 -1.45 0.30 115.11 121.26 1uk5 h GLN 103 Ca 0.00 -0.03 0.18 0.00 0.06 0.00 0.00 58.65 58.86 1uk5 h GLN 103 Cb 0.01 -0.12 -0.10 0.00 0.30 0.00 0.00 27.48 27.57 1uk5 h GLN 103 CO -0.03 0.34 0.48 0.87 -0.67 0.00 0.00 178.83 179.83 1uk5 h LYS 104 N 0.53 0.60 -0.07 1.46 1.79 0.23 1.61 116.57 122.72 1uk5 h LYS 104 Ca 0.45 -0.04 -0.09 0.00 -2.18 0.00 0.00 60.65 58.79 1uk5 h LYS 104 Cb 0.66 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.18 1uk5 h LYS 104 CO -0.39 0.40 -0.32 0.00 -1.08 0.00 0.00 179.45 178.05 1uk5 h ALA 105 N 1.62 0.14 0.00 3.86 0.00 0.32 -2.83 119.26 122.36 1uk5 h ALA 105 Ca 0.52 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1uk5 h ALA 105 Cb 0.82 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1uk5 h ALA 105 CO -0.41 0.19 0.00 0.43 0.00 0.00 0.00 179.25 179.47 1uk5 n SER 106 N -4.42 0.00 -1.22 0.00 7.64 0.46 -3.95 113.62 112.13 1uk5 n SER 106 Ca -0.08 0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1uk5 n SER 106 Cb 0.50 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 1uk5 n SER 106 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uk5 n GLY 107 N -0.04 -2.83 3.76 0.23 0.00 0.53 -4.91 105.19 101.93 1uk5 n GLY 107 Ca 0.07 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 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 0.00 4.63 -0.64 1.61 0.04 -1.26 -4.97 135.00 134.42 1uk5 s PRO 108 Ca 0.00 1.76 -0.27 0.00 0.04 0.00 0.00 61.00 62.52 1uk5 s PRO 108 Cb 0.00 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.40 1uk5 s PRO 108 CO 0.00 0.22 1.38 -1.12 0.04 0.00 0.00 177.00 177.52 1uk5 s SER 109 N -0.95 6.09 0.04 6.66 0.01 -1.26 -4.61 113.70 119.68 1uk5 s SER 109 Ca 0.45 -0.02 -0.28 0.00 1.31 0.00 0.00 55.95 57.40 1uk5 s SER 109 Cb -0.31 -2.55 -0.17 0.00 0.21 0.00 0.00 66.02 63.20 1uk5 s SER 109 CO 0.39 -1.80 1.38 -1.28 0.41 0.00 0.00 173.24 172.34 1uk5 h SER 110 N 10.88 -0.60 -0.02 2.44 0.87 -1.92 -3.51 113.55 121.69 1uk5 h SER 110 Ca -0.27 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1uk5 h SER 110 Cb 1.08 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 1uk5 h SER 110 CO 1.22 -0.30 0.00 0.61 -0.53 0.00 0.00 176.83 177.83