#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uk5 n SER 2 N 0.00 0.00 -0.92 1.61 7.64 -1.26 -4.90 113.62 115.79 1uk5 n SER 2 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 1uk5 n SER 2 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 1uk5 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1uk5 n SER 3 N 2.83 -5.34 0.00 6.43 2.88 -1.26 -5.04 113.62 114.13 1uk5 n SER 3 Ca 0.00 0.77 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 1uk5 n SER 3 Cb 0.00 -3.07 0.00 0.00 -0.75 0.00 0.00 64.21 60.39 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 -3.60 0.76 3.47 0.46 0.00 -1.26 -5.13 105.19 99.89 1uk5 n GLY 4 Ca -0.04 0.08 -0.53 0.00 0.00 0.00 0.00 46.02 45.53 1uk5 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uk5 n SER 5 N 0.00 -0.40 -3.61 1.61 7.64 -1.26 -4.93 113.62 112.67 1uk5 n SER 5 Ca 0.00 1.15 -0.01 0.00 1.01 0.00 0.00 58.87 61.01 1uk5 n SER 5 Cb 0.00 -0.97 -0.01 0.00 -1.01 0.00 0.00 64.21 62.22 1uk5 n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1uk5 s SER 6 N -0.44 -0.05 0.00 6.43 1.04 -1.26 -5.16 113.70 114.26 1uk5 s SER 6 Ca 0.77 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 57.18 1uk5 s SER 6 Cb -1.08 0.07 0.00 0.00 0.10 0.00 0.00 66.02 65.12 1uk5 s SER 6 CO 0.56 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 175.27 1uk5 n GLY 7 N -0.18 -0.06 2.24 7.32 0.00 -1.26 -5.10 105.19 108.15 1uk5 n GLY 7 Ca -0.01 0.53 -0.02 0.00 0.00 0.00 0.00 46.02 46.52 1uk5 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uk5 n ALA 8 N -3.00 -2.57 -1.36 4.61 0.00 -1.26 -5.04 120.51 111.89 1uk5 n ALA 8 Ca 0.00 0.34 -0.15 0.00 0.00 0.00 0.00 53.44 53.63 1uk5 n ALA 8 Cb 0.00 -1.43 0.16 0.00 0.00 0.00 0.00 19.45 18.18 1uk5 n ALA 8 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1uk5 n PRO 9 N -0.84 -1.70 -3.69 0.00 -0.04 -1.26 -5.10 135.00 122.37 1uk5 n PRO 9 Ca 0.03 -1.35 -0.02 0.00 -0.04 0.00 0.00 63.50 62.12 1uk5 n PRO 9 Cb 0.35 -1.06 -0.01 0.00 -0.04 0.00 0.00 33.50 32.74 1uk5 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uk5 s ALA 10 N -3.51 -1.89 0.00 0.55 0.00 -1.26 -5.14 121.76 110.52 1uk5 s ALA 10 Ca 0.52 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.91 1uk5 s ALA 10 Cb -0.03 0.50 0.00 0.00 0.00 0.00 0.00 23.12 23.59 1uk5 s ALA 10 CO 0.38 -1.01 0.00 0.39 0.00 0.00 0.00 175.76 175.52 1uk5 n GLU 11 N -0.45 0.00 -1.52 0.00 1.02 -1.26 -5.04 120.64 113.39 1uk5 n GLU 11 Ca -0.07 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.77 1uk5 n GLU 11 Cb 0.61 0.00 0.20 0.00 -0.02 0.00 0.00 31.44 32.23 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 -0.01 -0.07 3.49 0.04 -1.26 -5.09 135.00 132.09 1uk5 s PRO 12 Ca 0.00 -0.14 -0.32 0.00 0.04 0.00 0.00 61.00 60.58 1uk5 s PRO 12 Cb 0.00 -1.74 0.12 0.00 0.04 0.00 0.00 34.50 32.92 1uk5 s PRO 12 CO 0.00 -2.89 1.24 0.00 0.04 0.00 0.00 177.00 175.38 1uk5 s ALA 13 N -3.42 -2.15 -0.15 8.56 0.00 -1.26 -5.19 121.76 118.15 1uk5 s ALA 13 Ca 0.71 0.99 -0.30 0.00 0.00 0.00 0.00 51.96 53.35 1uk5 s ALA 13 Cb -0.08 0.21 0.13 0.00 0.00 0.00 0.00 23.12 23.38 1uk5 s ALA 13 CO 0.54 -0.89 1.04 0.00 0.00 0.00 0.00 175.76 176.45 1uk5 s ALA 14 N -2.47 -1.95 0.08 0.00 0.00 -1.26 -5.15 121.76 111.02 1uk5 s ALA 14 Ca 0.12 1.52 -0.30 0.00 0.00 0.00 0.00 51.96 53.30 1uk5 s ALA 14 Cb 0.02 -0.53 -0.06 0.00 0.00 0.00 0.00 23.12 22.56 1uk5 s ALA 14 CO -0.04 -0.40 1.16 -1.25 0.00 0.00 0.00 175.76 175.23 1uk5 s PRO 15 N -1.60 4.48 0.00 0.00 0.04 -1.26 -5.00 135.00 131.65 1uk5 s PRO 15 Ca 0.02 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.78 1uk5 s PRO 15 Cb -0.01 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.19 1uk5 s PRO 15 CO -0.02 -0.17 0.00 1.63 0.04 0.00 0.00 177.00 178.49 1uk5 n LYS 16 N 3.57 0.00 -3.83 4.56 4.01 -1.26 -5.11 118.16 120.10 1uk5 n LYS 16 Ca 0.07 0.00 -0.06 0.00 -0.51 0.00 0.00 58.31 57.81 1uk5 n LYS 16 Cb 0.47 0.00 -0.01 0.00 -0.51 0.00 0.00 35.03 34.97 1uk5 n LYS 16 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1uk5 s SER 17 N -1.00 -0.22 -0.44 4.39 0.15 -1.26 -5.07 113.70 110.25 1uk5 s SER 17 Ca 0.00 -0.59 0.06 0.00 0.70 0.00 0.00 55.95 56.12 1uk5 s SER 17 Cb 0.00 0.67 0.41 0.00 -1.71 0.00 0.00 66.02 65.39 1uk5 s SER 17 CO 0.00 -1.25 1.08 0.61 1.20 0.00 0.00 173.24 174.88 1uk5 n GLY 18 N -0.47 5.58 3.54 9.45 0.00 -1.26 -5.09 105.19 116.93 1uk5 n GLY 18 Ca -0.05 -2.64 0.04 0.00 0.00 0.00 0.00 46.02 43.37 1uk5 n GLY 18 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1uk5 n GLU 19 N -0.41 -0.62 -3.62 1.61 0.28 -1.26 -5.00 120.64 111.61 1uk5 n GLU 19 Ca 0.36 0.41 -0.03 0.00 -0.16 0.00 0.00 57.16 57.73 1uk5 n GLU 19 Cb 0.64 -0.76 -0.03 0.00 1.43 0.00 0.00 31.44 32.73 1uk5 n GLU 19 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1uk5 s ALA 20 N -1.44 -2.11 0.34 -1.84 0.00 -1.26 -5.14 121.76 110.30 1uk5 s ALA 20 Ca 0.00 1.79 -0.27 0.00 0.00 0.00 0.00 51.96 53.49 1uk5 s ALA 20 Cb 0.00 -0.80 -0.13 0.00 0.00 0.00 0.00 23.12 22.19 1uk5 s ALA 20 CO 0.00 -0.42 1.00 -1.91 0.00 0.00 0.00 175.76 174.43 1uk5 n GLU 21 N 0.24 1.35 -3.71 0.00 2.13 -1.26 -5.00 120.64 114.40 1uk5 n GLU 21 Ca 0.01 0.48 -0.12 0.00 0.66 0.00 0.00 57.16 58.18 1uk5 n GLU 21 Cb 0.58 -1.91 -0.10 0.00 0.27 0.00 0.00 31.44 30.29 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 -1.15 -0.01 0.95 6.31 2.01 -1.26 -5.17 115.64 117.32 1uk5 s THR 22 Ca 0.60 0.03 -0.14 0.00 0.31 0.00 0.00 61.69 62.50 1uk5 s THR 22 Cb -0.65 -0.65 0.16 0.00 0.01 0.00 0.00 72.50 71.38 1uk5 s THR 22 CO 0.59 0.01 1.16 -2.16 -0.69 0.00 0.00 174.62 173.53 1uk5 s PRO 23 N 0.73 0.81 -0.01 4.92 0.04 -1.26 -4.99 135.00 135.24 1uk5 s PRO 23 Ca -0.04 0.16 -0.30 0.00 0.04 0.00 0.00 61.00 60.86 1uk5 s PRO 23 Cb -0.05 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1uk5 s PRO 23 CO -0.05 -2.40 1.20 -1.25 0.04 0.00 0.00 177.00 174.53 1uk5 s PRO 24 N -5.37 4.39 0.00 0.56 0.04 -1.26 -5.00 135.00 128.36 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 0.00 177.00 177.57 1uk5 n LYS 25 N 4.70 1.33 -3.86 4.56 2.85 -1.26 -5.10 118.16 121.39 1uk5 n LYS 25 Ca 0.10 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 57.00 1uk5 n LYS 25 Cb 0.46 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.77 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 4.21 3.47 0.17 5.58 5.65 -1.26 -4.99 115.29 128.12 1uk5 s HIS 26 Ca 0.00 0.40 0.00 0.00 0.25 0.00 0.00 55.06 55.71 1uk5 s HIS 26 Cb 0.00 -2.03 0.02 0.00 -1.18 0.00 0.00 32.58 29.39 1uk5 s HIS 26 CO 0.00 0.50 1.39 -1.00 -0.65 0.00 0.00 174.74 174.98 1uk5 h PRO 27 N 5.79 0.29 -0.41 2.88 0.13 -1.99 -2.77 132.00 135.92 1uk5 h PRO 27 Ca -0.48 -0.28 0.11 0.00 -0.87 0.00 0.00 66.00 64.48 1uk5 h PRO 27 Cb 1.19 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1uk5 h PRO 27 CO 0.66 0.97 0.29 0.78 -0.23 0.00 0.00 178.00 180.47 1uk5 h GLY 28 N 1.56 0.06 0.00 1.56 0.00 -1.96 0.16 103.07 104.46 1uk5 h GLY 28 Ca -0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.25 1uk5 h GLY 28 CO 0.13 0.01 -0.20 -2.08 0.00 0.00 0.00 176.54 174.40 1uk5 h VAL 29 N 0.04 0.36 -1.33 4.60 2.07 -1.87 -3.32 116.25 116.80 1uk5 h VAL 29 Ca 0.20 -1.31 0.41 0.00 0.82 0.00 0.00 66.70 66.82 1uk5 h VAL 29 Cb 0.72 0.72 -0.11 0.00 -1.52 0.00 0.00 31.29 31.11 1uk5 h VAL 29 CO -0.01 0.12 0.88 -0.07 0.02 0.00 0.00 177.57 178.51 1uk5 h LEU 30 N -1.00 0.23 -1.33 2.57 3.38 -1.19 1.86 115.31 119.83 1uk5 h LEU 30 Ca -0.02 0.10 0.23 0.00 0.09 0.00 0.00 57.88 58.27 1uk5 h LEU 30 Cb 0.37 0.08 -0.09 0.00 0.09 0.00 0.00 40.66 41.11 1uk5 h LEU 30 CO -0.02 -0.10 0.63 0.11 0.09 0.00 0.00 178.44 179.16 1uk5 h LYS 31 N 0.12 0.48 0.05 1.13 1.57 -1.07 1.26 116.57 120.11 1uk5 h LYS 31 Ca 0.77 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 59.45 1uk5 h LYS 31 Cb 2.49 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 34.70 1uk5 h LYS 31 CO -0.31 0.31 -0.33 -0.39 -0.57 0.00 0.00 179.45 178.16 1uk5 h VAL 32 N 0.49 1.67 -0.65 0.50 -1.51 0.27 -3.23 116.25 113.80 1uk5 h VAL 32 Ca 0.55 -2.40 0.10 0.00 -1.23 0.00 0.00 66.70 63.72 1uk5 h VAL 32 Cb 1.24 3.29 -0.04 0.00 -2.13 0.00 0.00 31.29 33.65 1uk5 h VAL 32 CO -0.28 0.65 0.43 -0.33 -1.23 0.00 0.00 177.57 176.81 1uk5 h GLU 33 N -0.73 0.48 -0.40 5.19 5.08 -0.54 0.50 114.58 124.16 1uk5 h GLU 33 Ca -0.06 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1uk5 h GLU 33 Cb 1.25 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1uk5 h GLU 33 CO 0.06 0.31 0.14 0.00 -1.00 0.00 0.00 179.01 178.52 1uk5 h ALA 34 N 1.67 1.49 0.00 3.43 0.00 0.14 -1.28 119.26 124.72 1uk5 h ALA 34 Ca 0.30 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1uk5 h ALA 34 Cb 0.52 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1uk5 h ALA 34 CO -0.09 0.39 -0.15 0.82 0.00 0.00 0.00 179.25 180.21 1uk5 h ILE 35 N 0.57 0.93 -0.98 0.00 2.04 -0.62 -3.33 117.51 116.12 1uk5 h ILE 35 Ca 0.14 -1.74 0.20 0.00 1.00 0.00 0.00 64.86 64.46 1uk5 h ILE 35 Cb 0.15 1.79 -0.19 0.00 -0.74 0.00 0.00 36.82 37.84 1uk5 h ILE 35 CO -0.01 0.31 -0.24 -0.07 0.00 0.00 0.00 178.15 178.14 1uk5 h LEU 36 N -1.00 -0.90 -0.84 1.44 3.38 -0.08 1.46 115.31 118.77 1uk5 h LEU 36 Ca -0.03 0.29 0.21 0.00 0.09 0.00 0.00 57.88 58.44 1uk5 h LEU 36 Cb 0.62 0.60 -0.13 0.00 0.09 0.00 0.00 40.66 41.85 1uk5 h LEU 36 CO -0.02 -0.32 0.23 -0.08 0.09 0.00 0.00 178.44 178.33 1uk5 h GLU 37 N 0.00 0.24 -0.01 1.13 4.81 -1.36 0.14 114.58 119.53 1uk5 h GLU 37 Ca 0.47 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.68 1uk5 h GLU 37 Cb 0.72 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.05 1uk5 h GLU 37 CO -1.01 0.16 -0.00 0.87 -0.73 0.00 0.00 179.01 178.30 1uk5 h LYS 38 N 0.24 0.02 -0.71 1.92 1.57 0.18 -3.15 116.57 116.65 1uk5 h LYS 38 Ca 0.51 -0.01 0.13 0.00 -1.87 0.00 0.00 60.65 59.41 1uk5 h LYS 38 Cb 0.97 -0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.15 1uk5 h LYS 38 CO -0.60 0.43 -0.30 0.28 -0.57 0.00 0.00 179.45 178.68 1uk5 h VAL 39 N -0.38 0.16 -0.88 0.50 2.07 0.14 0.23 116.25 118.08 1uk5 h VAL 39 Ca 0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.68 1uk5 h VAL 39 Cb 0.42 0.16 -0.16 0.00 -1.52 0.00 0.00 31.29 30.19 1uk5 h VAL 39 CO 0.00 0.00 -0.32 1.56 0.02 0.00 0.00 177.57 178.83 1uk5 h GLN 40 N -0.09 -0.03 -0.96 1.57 1.08 -0.81 1.29 115.11 117.16 1uk5 h GLN 40 Ca 0.29 0.00 0.13 0.00 -1.45 0.00 0.00 58.65 57.62 1uk5 h GLN 40 Cb 0.56 0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.92 1uk5 h GLN 40 CO -0.76 -0.02 0.61 0.78 -0.95 0.00 0.00 178.83 178.49 1uk5 h GLY 41 N -0.03 1.49 1.46 3.46 0.00 -0.58 0.64 103.07 109.50 1uk5 h GLY 41 Ca 0.35 -0.38 -0.20 0.00 0.00 0.00 0.00 47.33 47.11 1uk5 h GLY 41 CO -0.91 0.13 -0.75 1.41 0.00 0.00 0.00 176.54 176.42 1uk5 h LEU 42 N 0.88 0.63 -0.87 3.11 3.38 0.17 -2.85 115.31 119.77 1uk5 h LEU 42 Ca 0.48 -0.42 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1uk5 h LEU 42 Cb 0.58 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1uk5 h LEU 42 CO -0.25 1.18 -0.28 -0.08 0.09 0.00 0.00 178.44 179.10 1uk5 h GLU 43 N 0.36 0.51 -0.03 1.13 4.22 0.29 -2.45 114.58 118.61 1uk5 h GLU 43 Ca -0.04 -0.21 -0.07 0.00 0.08 0.00 0.00 59.36 59.13 1uk5 h GLU 43 Cb 1.34 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 1uk5 h GLU 43 CO 0.14 0.74 -0.31 1.96 -2.18 0.00 0.00 179.01 179.36 1uk5 h GLN 44 N 0.44 0.05 0.00 1.92 4.20 0.27 -1.64 115.11 120.35 1uk5 h GLN 44 Ca 0.06 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 1uk5 h GLN 44 Cb 0.72 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 1uk5 h GLN 44 CO 0.06 0.35 -0.50 0.00 -0.67 0.00 0.00 178.83 178.07 1uk5 h ALA 45 N 1.65 1.11 0.34 3.87 0.00 -1.21 -2.97 119.26 122.05 1uk5 h ALA 45 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1uk5 h ALA 45 Cb 0.57 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1uk5 h ALA 45 CO 0.04 0.63 -0.16 0.28 0.00 0.00 0.00 179.25 180.04 1uk5 h VAL 46 N 0.00 0.00 -1.81 0.00 2.07 -1.09 -1.69 116.25 113.73 1uk5 h VAL 46 Ca -0.01 -0.58 0.54 0.00 0.82 0.00 0.00 66.70 67.48 1uk5 h VAL 46 Cb 0.92 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.60 1uk5 h VAL 46 CO 0.07 0.00 1.28 -0.78 0.02 0.00 0.00 177.57 178.16 1uk5 h ASP 47 N -1.03 0.04 -1.51 0.57 3.58 -1.38 1.29 116.42 117.98 1uk5 h ASP 47 Ca -0.05 0.03 -0.57 0.00 0.42 0.00 0.00 57.03 56.86 1uk5 h ASP 47 Cb 0.34 0.03 -0.42 0.00 1.72 0.00 0.00 39.33 41.01 1uk5 h ASP 47 CO 0.08 -0.05 -0.77 -1.20 -2.88 0.00 0.00 179.24 174.42 1uk5 n SER 48 N -4.10 4.38 -4.76 2.28 7.64 -1.12 -5.05 113.62 112.89 1uk5 n SER 48 Ca 0.42 -3.62 -0.22 0.00 1.01 0.00 0.00 58.87 56.46 1uk5 n SER 48 Cb 1.88 -0.47 -0.06 0.00 -1.01 0.00 0.00 64.21 64.55 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 -3.49 2.80 -0.12 1.43 2.19 0.44 -4.87 117.98 116.36 1uk5 s PHE 49 Ca 0.46 -0.30 -0.08 0.00 0.33 0.00 0.00 56.93 57.34 1uk5 s PHE 49 Cb 0.40 -1.57 0.04 0.00 -1.31 0.00 0.00 43.02 40.58 1uk5 s PHE 49 CO -0.17 0.38 0.29 -2.00 1.83 0.00 0.00 175.22 175.55 1uk5 s GLU 50 N -3.85 0.29 0.00 10.12 2.12 -1.26 -4.98 118.70 121.14 1uk5 s GLU 50 Ca 0.37 0.51 0.00 0.00 0.36 0.00 0.00 54.97 56.21 1uk5 s GLU 50 Cb -0.05 0.01 0.00 0.00 0.26 0.00 0.00 34.13 34.36 1uk5 s GLU 50 CO 0.23 -0.11 0.00 0.41 -0.54 0.00 0.00 175.26 175.25 1uk5 n GLY 51 N 3.69 0.90 0.00 -1.50 0.00 -1.26 -4.89 105.19 102.13 1uk5 n GLY 51 Ca -0.20 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 43.92 1uk5 n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uk5 n LYS 52 N 0.00 3.34 -0.65 1.61 4.76 -1.26 -4.11 118.16 121.84 1uk5 n LYS 52 Ca 0.00 0.00 0.09 0.00 -2.87 0.00 0.00 58.31 55.53 1uk5 n LYS 52 Cb 0.00 0.00 0.36 0.00 -1.84 0.00 0.00 35.03 33.55 1uk5 n LYS 52 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1uk5 n LYS 53 N 0.00 3.89 -0.02 1.97 5.02 -1.01 -4.23 118.16 123.78 1uk5 n LYS 53 Ca 0.00 -2.93 -0.03 0.00 -2.02 0.00 0.00 58.31 53.33 1uk5 n LYS 53 Cb 0.00 -1.94 -0.02 0.00 -0.02 0.00 0.00 35.03 33.05 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 1.02 0.23 -1.55 -0.18 -2.24 -1.26 -4.87 114.28 105.43 1uk5 n THR 54 Ca 0.26 -0.09 -0.47 0.00 -2.27 0.00 0.00 64.05 61.48 1uk5 n THR 54 Cb 0.93 -0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 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 -2.61 0.90 -0.25 3.42 9.92 -1.26 -4.79 116.55 121.88 1uk5 n ASP 55 Ca -0.07 1.16 0.20 0.00 -0.53 0.00 0.00 54.79 55.55 1uk5 n ASP 55 Cb 0.58 -1.20 0.52 0.00 -0.64 0.00 0.00 41.12 40.38 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 2.45 0.37 0.12 -1.24 3.11 -1.96 -0.91 116.57 118.52 1uk5 h LYS 56 Ca -0.40 -0.02 0.01 0.00 -2.81 0.00 0.00 60.65 57.43 1uk5 h LYS 56 Cb 1.36 -0.08 -0.05 0.00 -1.00 0.00 0.00 32.23 32.46 1uk5 h LYS 56 CO 0.64 0.25 -0.53 -0.22 -2.81 0.00 0.00 179.45 176.78 1uk5 h LYS 57 N 0.38 -0.73 -0.77 1.90 3.64 -1.94 1.02 116.57 120.08 1uk5 h LYS 57 Ca 0.49 0.05 0.14 0.00 -1.27 0.00 0.00 60.65 60.05 1uk5 h LYS 57 Cb 1.26 0.16 -0.14 0.00 -0.41 0.00 0.00 32.23 33.10 1uk5 h LYS 57 CO -0.18 -0.48 -0.30 -0.92 -2.27 0.00 0.00 179.45 175.30 1uk5 h TYR 58 N -0.75 -0.77 0.00 1.91 3.20 -1.39 1.54 116.97 120.71 1uk5 h TYR 58 Ca -0.01 0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 1uk5 h TYR 58 Cb 0.76 0.45 -0.01 0.00 1.54 0.00 0.00 36.73 39.47 1uk5 h TYR 58 CO -0.46 -0.37 -0.25 -0.07 -1.64 0.00 0.00 178.16 175.37 1uk5 h LEU 59 N -0.06 0.00 -0.46 2.82 -0.00 -1.25 0.76 115.31 117.11 1uk5 h LEU 59 Ca 0.32 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 58.13 1uk5 h LEU 59 Cb 0.58 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.22 1uk5 h LEU 59 CO -0.81 0.25 0.01 -0.03 -0.00 0.00 0.00 178.44 177.86 1uk5 h MET 60 N 0.00 0.81 0.12 1.13 4.05 1.03 -2.27 114.93 119.80 1uk5 h MET 60 Ca -0.00 -0.26 -0.01 0.00 -0.28 0.00 0.00 59.70 59.16 1uk5 h MET 60 Cb 0.52 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.25 1uk5 h MET 60 CO 0.03 0.86 -0.06 0.82 0.23 0.00 0.00 176.91 178.80 1uk5 h ILE 61 N 0.66 0.28 -0.77 1.77 2.04 -0.15 -3.27 117.51 118.07 1uk5 h ILE 61 Ca 0.13 -1.05 0.07 0.00 1.00 0.00 0.00 64.86 65.01 1uk5 h ILE 61 Cb 0.49 0.51 -0.09 0.00 -0.74 0.00 0.00 36.82 36.99 1uk5 h ILE 61 CO 0.02 0.09 -0.46 1.21 0.00 0.00 0.00 178.15 179.02 1uk5 n GLU 62 N -4.87 -0.34 -0.22 2.37 0.00 0.22 -0.64 120.64 117.16 1uk5 n GLU 62 Ca -0.04 1.26 -0.06 0.00 0.00 0.00 0.00 57.16 58.32 1uk5 n GLU 62 Cb 0.13 -1.85 -0.06 0.00 0.00 0.00 0.00 31.44 29.67 1uk5 n GLU 62 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1uk5 h GLU 63 N 0.00 -0.02 -0.73 5.31 3.07 -1.55 0.34 114.58 121.00 1uk5 h GLU 63 Ca 0.12 0.00 0.16 0.00 -0.50 0.00 0.00 59.36 59.15 1uk5 h GLU 63 Cb 0.32 0.01 -0.12 0.00 -0.84 0.00 0.00 28.75 28.11 1uk5 h GLU 63 CO -0.73 -0.02 0.07 1.88 -1.40 0.00 0.00 179.01 178.82 1uk5 h TYR 64 N -0.02 0.07 0.00 4.33 0.05 -0.93 1.04 116.97 121.51 1uk5 h TYR 64 Ca 0.08 0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.91 1uk5 h TYR 64 Cb 0.24 0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1uk5 h TYR 64 CO -0.96 -0.18 0.00 1.28 -1.05 0.00 0.00 178.16 177.25 1uk5 n LEU 65 N -5.27 0.00 -0.29 3.88 4.32 0.95 -1.81 117.00 118.78 1uk5 n LEU 65 Ca 0.13 0.72 0.11 0.00 -0.02 0.00 0.00 56.01 56.95 1uk5 n LEU 65 Cb 0.46 -0.22 0.26 0.00 -1.62 0.00 0.00 43.42 42.30 1uk5 n LEU 65 CO 0.08 -0.22 0.94 0.74 -1.22 0.00 0.00 177.39 177.71 1uk5 h THR 66 N 0.00 0.37 -1.02 -5.08 2.02 -0.55 0.66 112.91 109.30 1uk5 h THR 66 Ca 0.00 -0.08 0.35 0.00 0.77 0.00 0.00 66.41 67.45 1uk5 h THR 66 Cb 0.00 0.12 -0.15 0.00 -1.74 0.00 0.00 68.15 66.38 1uk5 h THR 66 CO 0.00 0.04 0.58 0.11 0.37 0.00 0.00 175.52 176.63 1uk5 h LYS 67 N 0.23 0.23 -0.34 6.66 1.57 0.14 1.45 116.57 126.51 1uk5 h LYS 67 Ca 0.51 -0.01 -0.17 0.00 -1.87 0.00 0.00 60.65 59.11 1uk5 h LYS 67 Cb 0.99 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.25 1uk5 h LYS 67 CO -0.62 0.15 -0.46 0.93 -0.57 0.00 0.00 179.45 178.89 1uk5 h GLU 68 N 0.24 0.91 -0.33 3.15 4.39 0.11 -3.11 114.58 119.94 1uk5 h GLU 68 Ca 0.76 -0.52 0.06 0.00 0.34 0.00 0.00 59.36 60.00 1uk5 h GLU 68 Cb 1.86 0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 30.46 1uk5 h GLU 68 CO -0.62 1.17 -0.43 -0.07 -1.16 0.00 0.00 179.01 177.89 1uk5 h LEU 69 N 0.72 -1.42 -1.57 1.33 4.07 0.23 0.82 115.31 119.50 1uk5 h LEU 69 Ca 0.04 0.21 0.20 0.00 0.08 0.00 0.00 57.88 58.41 1uk5 h LEU 69 Cb 1.06 0.61 -0.06 0.00 1.08 0.00 0.00 40.66 43.35 1uk5 h LEU 69 CO 0.11 -0.38 0.58 -0.07 -1.08 0.00 0.00 178.44 177.60 1uk5 h LEU 70 N -0.37 0.36 -0.73 1.67 3.38 -1.41 1.34 115.31 119.56 1uk5 h LEU 70 Ca 0.12 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 1uk5 h LEU 70 Cb 0.59 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1uk5 h LEU 70 CO -0.53 0.15 -0.42 0.00 0.09 0.00 0.00 178.44 177.73 1uk5 h ALA 71 N 1.61 0.91 0.04 1.53 0.00 0.39 0.66 119.26 124.40 1uk5 h ALA 71 Ca 0.45 -0.38 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 1uk5 h ALA 71 Cb 1.17 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1uk5 h ALA 71 CO -0.15 0.53 -1.03 -0.07 0.00 0.00 0.00 179.25 178.52 1uk5 h LEU 72 N 0.00 0.21 0.11 0.00 3.38 0.73 -3.28 115.31 116.46 1uk5 h LEU 72 Ca -0.00 -0.20 -0.31 0.00 0.09 0.00 0.00 57.88 57.46 1uk5 h LEU 72 Cb 1.02 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1uk5 h LEU 72 CO 0.05 1.11 -1.56 -0.78 0.09 0.00 0.00 178.44 177.35 1uk5 h ASP 73 N 0.05 0.37 -0.35 -0.43 3.58 -0.23 -3.27 116.42 116.14 1uk5 h ASP 73 Ca -0.06 -0.53 0.10 0.00 0.42 0.00 0.00 57.03 56.96 1uk5 h ASP 73 Cb 1.75 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 42.66 1uk5 h ASP 73 CO 0.15 1.45 0.61 -1.28 -2.88 0.00 0.00 179.24 177.29 1uk5 h SER 74 N 0.06 0.00 -3.55 2.28 0.87 0.27 -3.39 113.55 110.09 1uk5 h SER 74 Ca -0.25 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 59.79 1uk5 h SER 74 Cb 2.01 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 64.00 1uk5 h SER 74 CO 0.15 0.00 0.59 -0.69 -0.53 0.00 0.00 176.83 176.36 1uk5 s VAL 75 N -4.36 3.29 -0.36 2.23 1.01 -1.24 -5.00 120.40 115.97 1uk5 s VAL 75 Ca -0.03 1.13 -0.01 0.00 0.00 0.00 0.00 61.98 63.07 1uk5 s VAL 75 Cb 0.11 -3.72 0.09 0.00 0.00 0.00 0.00 36.38 32.86 1uk5 s VAL 75 CO 0.39 0.20 0.12 -1.81 0.00 0.00 0.00 175.10 174.00 1uk5 s ASP 76 N -0.03 5.06 0.44 3.32 1.01 -1.26 -4.93 116.67 120.27 1uk5 s ASP 76 Ca 0.52 -1.84 0.25 0.00 0.71 0.00 0.00 52.55 52.19 1uk5 s ASP 76 Cb -0.35 -1.76 0.72 0.00 1.01 0.00 0.00 42.92 42.54 1uk5 s ASP 76 CO 0.40 -0.43 1.74 1.55 0.21 0.00 0.00 175.17 178.64 1uk5 h PRO 77 N 7.95 0.00 0.00 8.23 0.13 -1.93 -3.47 132.00 142.91 1uk5 h PRO 77 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1uk5 h PRO 77 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1uk5 h PRO 77 CO 0.62 0.15 0.00 0.39 -0.23 0.00 0.00 178.00 178.93 1uk5 n GLU 78 N -3.21 0.00 -1.42 0.86 1.02 -1.26 -2.16 120.64 114.48 1uk5 n GLU 78 Ca 0.02 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.15 1uk5 n GLU 78 Cb 0.48 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.92 1uk5 n GLU 78 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1uk5 n GLY 79 N 0.00 -0.18 3.83 0.62 0.00 -1.26 -5.15 105.19 103.05 1uk5 n GLY 79 Ca 0.00 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 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 0.02 3.26 -0.13 1.61 1.81 -0.92 -5.03 118.95 119.58 1uk5 s ARG 80 Ca 0.02 -0.33 -0.08 0.00 -1.72 0.00 0.00 55.73 53.61 1uk5 s ARG 80 Cb 0.08 -3.01 -0.06 0.00 -0.45 0.00 0.00 34.95 31.52 1uk5 s ARG 80 CO -0.02 0.70 0.05 0.00 -0.68 0.00 0.00 175.30 175.34 1uk5 h ALA 81 N 4.39 0.02 -1.34 2.13 0.00 -1.97 -0.04 119.26 122.46 1uk5 h ALA 81 Ca -0.51 -0.34 0.40 0.00 0.00 0.00 0.00 54.91 54.45 1uk5 h ALA 81 Cb 1.20 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 19.14 1uk5 h ALA 81 CO 0.62 0.24 0.92 -0.44 0.00 0.00 0.00 179.25 180.59 1uk5 h ASP 82 N -1.00 0.17 0.00 0.00 5.19 -1.99 0.33 116.42 119.11 1uk5 h ASP 82 Ca -0.03 0.06 -0.03 0.00 -0.62 0.00 0.00 57.03 56.41 1uk5 h ASP 82 Cb 0.41 0.04 -0.00 0.00 0.18 0.00 0.00 39.33 39.96 1uk5 h ASP 82 CO -0.02 -0.04 -0.32 0.58 -3.12 0.00 0.00 179.24 176.32 1uk5 h VAL 83 N 0.11 0.42 -1.00 -1.35 2.07 -1.92 -2.95 116.25 111.64 1uk5 h VAL 83 Ca 0.71 -1.38 0.37 0.00 0.82 0.00 0.00 66.70 67.22 1uk5 h VAL 83 Cb 2.47 0.86 -0.18 0.00 -1.52 0.00 0.00 31.29 32.92 1uk5 h VAL 83 CO -0.19 0.14 0.39 0.03 0.02 0.00 0.00 177.57 177.96 1uk5 h ARG 84 N -1.00 0.03 0.48 1.57 3.08 0.10 0.30 114.38 118.94 1uk5 h ARG 84 Ca -0.05 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1uk5 h ARG 84 Cb 0.49 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1uk5 h ARG 84 CO -0.03 0.02 -0.23 0.37 -1.07 0.00 0.00 179.97 179.03 1uk5 h GLN 85 N 0.03 -0.62 -0.85 0.04 4.15 -0.58 -2.53 115.11 114.73 1uk5 h GLN 85 Ca 0.77 0.04 0.12 0.00 0.77 0.00 0.00 58.65 60.34 1uk5 h GLN 85 Cb 1.91 0.14 -0.13 0.00 0.21 0.00 0.00 27.48 29.61 1uk5 h GLN 85 CO -0.80 -0.42 -0.45 0.00 -1.93 0.00 0.00 178.83 175.23 1uk5 h ALA 86 N -1.30 -0.18 -0.44 3.38 0.00 -0.67 0.36 119.26 120.41 1uk5 h ALA 86 Ca -0.07 0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.10 1uk5 h ALA 86 Cb 0.50 1.08 -0.09 0.00 0.00 0.00 0.00 17.79 19.28 1uk5 h ALA 86 CO 0.11 -0.78 -0.37 -0.09 0.00 0.00 0.00 179.25 178.12 1uk5 h ARG 87 N -0.08 -0.26 0.33 0.00 2.43 -0.60 1.05 114.38 117.25 1uk5 h ARG 87 Ca 0.24 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1uk5 h ARG 87 Cb 0.54 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 1uk5 h ARG 87 CO -0.87 -0.17 -0.44 -0.09 -1.51 0.00 0.00 179.97 176.89 1uk5 h ARG 88 N -0.27 -0.77 -0.31 0.20 2.43 -0.09 0.16 114.38 115.73 1uk5 h ARG 88 Ca 0.17 0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.46 1uk5 h ARG 88 Cb 0.56 0.17 -0.08 0.00 -0.42 0.00 0.00 29.97 30.20 1uk5 h ARG 88 CO -0.58 -0.51 -0.36 0.22 -1.51 0.00 0.00 179.97 177.23 1uk5 h ASP 89 N -0.79 -1.17 -1.04 -3.80 3.58 0.14 1.72 116.42 115.06 1uk5 h ASP 89 Ca -0.04 0.19 0.29 0.00 0.42 0.00 0.00 57.03 57.89 1uk5 h ASP 89 Cb 0.72 0.52 -0.13 0.00 1.72 0.00 0.00 39.33 42.16 1uk5 h ASP 89 CO -0.11 -0.35 0.62 1.23 -2.88 0.00 0.00 179.24 177.75 1uk5 h GLY 90 N -0.33 1.78 1.59 -0.78 0.00 0.15 1.05 103.07 106.53 1uk5 h GLY 90 Ca 0.14 -0.25 -0.26 0.00 0.00 0.00 0.00 47.33 46.95 1uk5 h GLY 90 CO -0.49 -0.32 -1.28 -2.08 0.00 0.00 0.00 176.54 172.37 1uk5 h VAL 91 N 0.42 1.43 -0.20 4.60 2.07 0.15 -3.15 116.25 121.57 1uk5 h VAL 91 Ca 0.68 -3.08 -0.07 0.00 0.82 0.00 0.00 66.70 65.05 1uk5 h VAL 91 Cb 1.54 2.83 -0.01 0.00 -1.52 0.00 0.00 31.29 34.13 1uk5 h VAL 91 CO -0.48 0.87 -0.19 -0.09 0.02 0.00 0.00 177.57 177.70 1uk5 h ARG 92 N 0.05 0.34 0.15 1.57 9.65 0.86 0.52 114.38 127.52 1uk5 h ARG 92 Ca -0.14 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.63 1uk5 h ARG 92 Cb 1.93 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 30.47 1uk5 h ARG 92 CO 0.16 0.53 -0.07 -0.22 2.80 0.00 0.00 179.97 183.17 1uk5 h LYS 93 N 0.32 -0.20 0.56 0.20 1.63 0.72 -2.50 116.57 117.30 1uk5 h LYS 93 Ca 0.06 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.85 1uk5 h LYS 93 Cb 0.52 0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.19 1uk5 h LYS 93 CO 0.03 0.13 -0.32 0.28 -3.45 0.00 0.00 179.45 176.12 1uk5 h VAL 94 N -0.53 0.34 -0.93 2.00 2.07 -1.47 -2.21 116.25 115.52 1uk5 h VAL 94 Ca -0.02 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.61 1uk5 h VAL 94 Cb 0.41 0.34 -0.13 0.00 -1.52 0.00 0.00 31.29 30.39 1uk5 h VAL 94 CO 0.03 0.00 -0.45 0.00 0.02 0.00 0.00 177.57 177.17 1uk5 n GLN 95 N -5.46 -0.31 -0.13 1.57 6.02 0.16 0.79 117.38 120.02 1uk5 n GLN 95 Ca -0.12 1.42 -0.04 0.00 -0.01 0.00 0.00 57.00 58.24 1uk5 n GLN 95 Cb 0.35 -2.09 0.03 0.00 1.02 0.00 0.00 30.24 29.55 1uk5 n GLN 95 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1uk5 h THR 96 N 0.00 0.60 -0.68 5.09 2.02 -1.24 0.17 112.91 118.88 1uk5 h THR 96 Ca 0.24 -0.01 0.05 0.00 0.77 0.00 0.00 66.41 67.46 1uk5 h THR 96 Cb 0.47 0.57 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 1uk5 h THR 96 CO -0.90 0.01 0.40 0.40 0.37 0.00 0.00 175.52 175.79 1uk5 h ILE 97 N 0.03 1.01 -0.47 3.11 2.04 0.10 0.24 117.51 123.57 1uk5 h ILE 97 Ca 0.21 -0.25 0.12 0.00 1.00 0.00 0.00 64.86 65.93 1uk5 h ILE 97 Cb 0.31 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1uk5 h ILE 97 CO -0.41 0.14 0.33 -0.07 0.00 0.00 0.00 178.15 178.13 1uk5 h LEU 98 N 0.74 0.09 0.00 1.44 -0.00 0.21 0.55 115.31 118.35 1uk5 h LEU 98 Ca 0.29 0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 58.00 1uk5 h LEU 98 Cb 0.14 -0.02 -0.03 0.00 -0.00 0.00 0.00 40.66 40.75 1uk5 h LEU 98 CO -0.16 0.05 -1.04 -0.08 -0.00 0.00 0.00 178.44 177.22 1uk5 h GLU 99 N 0.10 0.00 -0.07 1.13 4.81 0.53 -3.27 114.58 117.81 1uk5 h GLU 99 Ca 0.22 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.34 1uk5 h GLU 99 Cb 0.75 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.14 1uk5 h GLU 99 CO -0.02 0.62 -0.41 1.57 -0.73 0.00 0.00 179.01 180.03 1uk5 h LYS 100 N 0.00 0.41 -0.20 1.92 2.10 0.26 -3.28 116.57 117.77 1uk5 h LYS 100 Ca -0.08 -0.34 0.04 0.00 -2.00 0.00 0.00 60.65 58.27 1uk5 h LYS 100 Cb 1.65 0.07 -0.07 0.00 -0.90 0.00 0.00 32.23 32.98 1uk5 h LYS 100 CO 0.08 0.98 -0.48 1.25 -2.00 0.00 0.00 179.45 179.29 1uk5 h LEU 101 N -0.06 -1.53 -0.30 7.07 5.85 -0.21 -1.53 115.31 124.60 1uk5 h LEU 101 Ca -0.03 0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1uk5 h LEU 101 Cb 1.07 0.62 -0.04 0.00 0.37 0.00 0.00 40.66 42.69 1uk5 h LEU 101 CO 0.08 -0.44 -0.18 -0.62 -0.34 0.00 0.00 178.44 176.95 1uk5 n GLU 102 N -5.43 -0.13 -0.30 1.25 1.02 -1.23 0.13 120.64 115.94 1uk5 n GLU 102 Ca -0.04 1.00 0.13 0.00 -0.02 0.00 0.00 57.16 58.23 1uk5 n GLU 102 Cb 0.37 -1.49 0.29 0.00 -0.02 0.00 0.00 31.44 30.59 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 0.19 -0.34 3.49 1.08 -1.49 1.58 115.11 119.62 1uk5 h GLN 103 Ca 0.05 -0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.18 1uk5 h GLN 103 Cb 0.12 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 1uk5 h GLN 103 CO -0.28 0.13 -0.03 0.87 -0.95 0.00 0.00 178.83 178.57 1uk5 h LYS 104 N 0.20 0.54 -0.98 1.46 1.79 0.20 -1.42 116.57 118.37 1uk5 h LYS 104 Ca 0.55 -0.13 -0.49 0.00 -2.18 0.00 0.00 60.65 58.40 1uk5 h LYS 104 Cb 1.11 -0.07 -0.29 0.00 -1.58 0.00 0.00 32.23 31.39 1uk5 h LYS 104 CO -0.66 0.58 0.63 0.00 -1.08 0.00 0.00 179.45 178.92 1uk5 n ALA 105 N -2.48 5.52 -0.74 3.86 0.00 0.49 -3.89 120.51 123.27 1uk5 n ALA 105 Ca 0.01 -2.85 0.00 0.00 0.00 0.00 0.00 53.44 50.60 1uk5 n ALA 105 Cb 0.27 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1uk5 n ALA 105 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1uk5 n SER 106 N -1.06 0.49 0.00 0.00 2.88 0.16 -2.41 113.62 113.68 1uk5 n SER 106 Ca 0.58 -1.23 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 1uk5 n SER 106 Cb 1.65 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 65.11 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 -0.12 4.05 3.79 0.46 0.00 -1.13 -5.00 105.19 107.25 1uk5 n GLY 107 Ca 0.00 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 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 -5.20 1.48 0.36 1.61 0.04 -1.26 -4.59 135.00 127.44 1uk5 s PRO 108 Ca 0.00 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.45 1uk5 s PRO 108 Cb 0.00 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.67 1uk5 s PRO 108 CO 0.00 -1.99 0.00 0.45 0.04 0.00 0.00 177.00 175.50 1uk5 n SER 109 N -3.64 -2.25 0.02 6.66 2.88 -1.26 -4.95 113.62 111.08 1uk5 n SER 109 Ca 0.07 0.67 -0.12 0.00 -1.33 0.00 0.00 58.87 58.15 1uk5 n SER 109 Cb 0.58 2.21 -0.06 0.00 -0.75 0.00 0.00 64.21 66.19 1uk5 n SER 109 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1uk5 h SER 110 N 0.00 -1.22 0.00 -3.46 0.87 -2.00 -3.54 113.55 104.20 1uk5 h SER 110 Ca 0.00 0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1uk5 h SER 110 Cb 0.00 0.49 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 1uk5 h SER 110 CO 0.00 -0.42 0.00 0.61 -0.53 0.00 0.00 176.83 176.49