#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 -0.38 0.00 1.61 1.04 -1.26 -5.18 113.70 109.53 1uk5 s SER 2 Ca 0.00 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.05 1uk5 s SER 2 Cb 0.00 1.09 0.00 0.00 0.10 0.00 0.00 66.02 67.21 1uk5 s SER 2 CO 0.00 -0.10 0.00 -0.24 0.98 0.00 0.00 173.24 173.88 1uk5 n SER 3 N 3.33 0.00 0.00 7.02 2.88 -1.26 -5.19 113.62 120.40 1uk5 n SER 3 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1uk5 n SER 3 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 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 -0.14 -0.86 3.69 0.46 0.00 -1.26 -5.04 105.19 102.04 1uk5 n GLY 4 Ca 0.00 -1.05 0.03 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.01 -0.09 1.61 1.04 -1.26 -5.19 113.70 109.79 1uk5 s SER 5 Ca 0.00 -0.05 -0.33 0.00 0.48 0.00 0.00 55.95 56.05 1uk5 s SER 5 Cb 0.00 0.05 0.14 0.00 0.10 0.00 0.00 66.02 66.31 1uk5 s SER 5 CO 0.00 -0.10 1.34 -0.55 0.98 0.00 0.00 173.24 174.92 1uk5 s SER 6 N -3.23 -0.04 0.00 7.02 0.15 -1.26 -5.01 113.70 111.33 1uk5 s SER 6 Ca 0.19 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.78 1uk5 s SER 6 Cb 0.05 0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.45 1uk5 s SER 6 CO -0.05 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.84 1uk5 n GLY 7 N -0.40 1.29 2.74 9.45 0.00 -1.26 -5.10 105.19 111.92 1uk5 n GLY 7 Ca -0.07 -1.84 -0.08 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.48 -1.00 4.61 0.00 -1.26 -5.06 120.51 113.32 1uk5 n ALA 8 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 53.44 52.11 1uk5 n ALA 8 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.00 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 1.45 0.29 -2.70 0.00 -0.04 -1.26 -5.08 135.00 127.66 1uk5 n PRO 9 Ca 0.08 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.49 1uk5 n PRO 9 Cb 0.65 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 34.16 1uk5 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uk5 n ALA 10 N -3.00 -2.95 -3.55 0.55 0.00 -1.26 -5.09 120.51 105.21 1uk5 n ALA 10 Ca 0.00 -0.55 -0.12 0.00 0.00 0.00 0.00 53.44 52.77 1uk5 n ALA 10 Cb 0.00 -2.63 -0.11 0.00 0.00 0.00 0.00 19.45 16.71 1uk5 n ALA 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1uk5 s GLU 11 N 0.51 0.39 0.52 0.00 2.12 -1.26 -5.17 118.70 115.81 1uk5 s GLU 11 Ca 0.27 0.67 -0.09 0.00 0.36 0.00 0.00 54.97 56.18 1uk5 s GLU 11 Cb 0.17 0.05 0.12 0.00 0.26 0.00 0.00 34.13 34.74 1uk5 s GLU 11 CO -0.12 -0.12 0.57 -0.35 -0.54 0.00 0.00 175.26 174.70 1uk5 n PRO 12 N 3.76 -1.30 -3.62 4.30 -0.04 -1.26 -4.66 135.00 132.18 1uk5 n PRO 12 Ca -0.20 -0.90 0.01 0.00 -0.04 0.00 0.00 63.50 62.38 1uk5 n PRO 12 Cb 0.56 -0.71 0.01 0.00 -0.04 0.00 0.00 33.50 33.32 1uk5 n PRO 12 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uk5 n ALA 13 N -3.64 -2.89 -3.26 0.55 0.00 -1.26 -4.95 120.51 105.07 1uk5 n ALA 13 Ca -0.10 -0.71 -0.14 0.00 0.00 0.00 0.00 53.44 52.50 1uk5 n ALA 13 Cb 0.27 0.19 -0.08 0.00 0.00 0.00 0.00 19.45 19.84 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 -1.85 -1.00 1.06 0.00 0.00 -1.26 -5.17 121.76 113.55 1uk5 s ALA 14 Ca 0.24 0.48 -0.17 0.00 0.00 0.00 0.00 51.96 52.51 1uk5 s ALA 14 Cb -0.01 0.13 0.23 0.00 0.00 0.00 0.00 23.12 23.48 1uk5 s ALA 14 CO 0.00 -0.33 1.21 -1.25 0.00 0.00 0.00 175.76 175.39 1uk5 s PRO 15 N -1.62 -0.14 -0.25 0.00 0.04 -1.26 -5.06 135.00 126.71 1uk5 s PRO 15 Ca -0.11 -0.19 -0.26 0.00 0.04 0.00 0.00 61.00 60.48 1uk5 s PRO 15 Cb -0.03 -1.73 0.11 0.00 0.04 0.00 0.00 34.50 32.89 1uk5 s PRO 15 CO 0.03 -2.97 0.96 0.15 0.04 0.00 0.00 177.00 175.21 1uk5 s LYS 16 N -5.62 0.60 0.19 4.56 1.02 -1.26 -5.18 119.74 114.06 1uk5 s LYS 16 Ca 0.72 0.58 -0.23 0.00 0.02 0.00 0.00 55.97 57.05 1uk5 s LYS 16 Cb -0.07 0.29 0.05 0.00 -0.52 0.00 0.00 37.83 37.58 1uk5 s LYS 16 CO 0.54 -0.10 0.73 -1.54 -0.92 0.00 0.00 175.35 174.06 1uk5 s SER 17 N -0.03 -0.37 0.00 2.83 1.04 -1.26 -5.09 113.70 110.83 1uk5 s SER 17 Ca 0.01 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.13 1uk5 s SER 17 Cb -0.04 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1uk5 s SER 17 CO -0.03 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 173.72 1uk5 n GLY 18 N -0.41 -1.02 3.79 7.32 0.00 -1.26 -5.15 105.19 108.46 1uk5 n GLY 18 Ca -0.09 0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1uk5 n GLY 18 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1uk5 s GLU 19 N 0.00 4.10 0.00 1.61 1.03 -1.26 -5.02 118.70 119.16 1uk5 s GLU 19 Ca 0.00 0.40 0.00 0.00 0.03 0.00 0.00 54.97 55.40 1uk5 s GLU 19 Cb 0.00 -3.31 0.00 0.00 -0.80 0.00 0.00 34.13 30.02 1uk5 s GLU 19 CO 0.00 0.47 0.00 0.00 -1.33 0.00 0.00 175.26 174.40 1uk5 n ALA 20 N 2.61 0.00 -1.38 -0.84 0.00 -1.26 -5.09 120.51 114.55 1uk5 n ALA 20 Ca -0.11 0.00 -0.51 0.00 0.00 0.00 0.00 53.44 52.81 1uk5 n ALA 20 Cb 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.86 1uk5 n ALA 20 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1uk5 n GLU 21 N -0.15 0.34 -3.64 0.00 -0.00 -1.26 -4.86 120.64 111.06 1uk5 n GLU 21 Ca 0.00 0.07 -0.09 0.00 -0.00 0.00 0.00 57.16 57.14 1uk5 n GLU 21 Cb 0.00 -1.86 -0.07 0.00 -0.00 0.00 0.00 31.44 29.51 1uk5 n GLU 21 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1uk5 s THR 22 N 7.47 0.00 0.77 3.84 2.01 -1.26 -5.17 115.64 123.30 1uk5 s THR 22 Ca 1.20 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 63.09 1uk5 s THR 22 Cb -1.20 -1.00 0.06 0.00 0.01 0.00 0.00 72.50 70.37 1uk5 s THR 22 CO 0.55 0.00 1.09 -2.16 -0.69 0.00 0.00 174.62 173.41 1uk5 s PRO 23 N 1.02 2.28 0.39 4.92 0.04 -1.26 -5.02 135.00 137.37 1uk5 s PRO 23 Ca -0.05 0.70 -0.24 0.00 0.04 0.00 0.00 61.00 61.45 1uk5 s PRO 23 Cb -0.05 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.47 1uk5 s PRO 23 CO -0.10 -1.50 1.06 -1.25 0.04 0.00 0.00 177.00 175.24 1uk5 s PRO 24 N -5.14 4.19 0.00 0.56 0.04 -1.26 -5.02 135.00 128.37 1uk5 s PRO 24 Ca 0.60 1.54 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1uk5 s PRO 24 Cb -0.14 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.81 1uk5 s PRO 24 CO 0.54 -0.13 0.00 0.36 0.04 0.00 0.00 177.00 177.82 1uk5 n LYS 25 N 0.01 0.00 -4.65 4.56 -0.00 -1.26 -5.08 118.16 111.74 1uk5 n LYS 25 Ca 0.05 0.00 -0.34 0.00 -0.00 0.00 0.00 58.31 58.02 1uk5 n LYS 25 Cb 0.49 0.00 -0.12 0.00 -0.00 0.00 0.00 35.03 35.41 1uk5 n LYS 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1uk5 s HIS 26 N 0.79 2.91 0.13 5.58 5.65 -1.26 -5.02 115.29 124.08 1uk5 s HIS 26 Ca 0.00 -0.02 -0.06 0.00 0.25 0.00 0.00 55.06 55.23 1uk5 s HIS 26 Cb 0.00 -1.71 -0.08 0.00 -1.18 0.00 0.00 32.58 29.61 1uk5 s HIS 26 CO 0.00 0.29 1.32 -1.00 -0.65 0.00 0.00 174.74 174.70 1uk5 h PRO 27 N 5.35 0.49 -0.51 2.88 0.13 -1.99 -2.60 132.00 135.75 1uk5 h PRO 27 Ca -0.47 -0.48 0.05 0.00 -0.87 0.00 0.00 66.00 64.23 1uk5 h PRO 27 Cb 1.17 0.12 -0.03 0.00 0.13 0.00 0.00 31.00 32.40 1uk5 h PRO 27 CO 0.53 1.12 0.34 0.78 -0.23 0.00 0.00 178.00 180.53 1uk5 h GLY 28 N 1.07 0.60 0.19 1.56 0.00 -1.98 -0.90 103.07 103.61 1uk5 h GLY 28 Ca -0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1uk5 h GLY 28 CO 0.16 0.16 -0.06 -2.08 0.00 0.00 0.00 176.54 174.72 1uk5 h VAL 29 N 0.50 0.50 -1.22 4.60 2.07 -1.87 -3.25 116.25 117.58 1uk5 h VAL 29 Ca 0.22 -1.15 0.39 0.00 0.82 0.00 0.00 66.70 66.98 1uk5 h VAL 29 Cb 0.22 0.89 -0.12 0.00 -1.52 0.00 0.00 31.29 30.76 1uk5 h VAL 29 CO -0.06 0.15 0.77 -0.07 0.02 0.00 0.00 177.57 178.39 1uk5 h LEU 30 N -0.99 0.31 -1.94 2.57 3.38 -1.21 1.59 115.31 119.02 1uk5 h LEU 30 Ca -0.02 0.13 0.40 0.00 0.09 0.00 0.00 57.88 58.49 1uk5 h LEU 30 Cb 0.38 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.18 1uk5 h LEU 30 CO 0.03 -0.13 1.03 0.50 0.09 0.00 0.00 178.44 179.96 1uk5 h LYS 31 N 0.17 0.00 0.06 1.13 3.64 -1.20 1.05 116.57 121.42 1uk5 h LYS 31 Ca 0.76 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.90 1uk5 h LYS 31 Cb 2.24 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 34.05 1uk5 h LYS 31 CO -0.42 0.00 -1.26 -0.39 -2.27 0.00 0.00 179.45 175.11 1uk5 h VAL 32 N 0.00 1.02 -0.58 2.00 -1.51 0.22 -3.27 116.25 114.13 1uk5 h VAL 32 Ca 0.65 -2.29 0.10 0.00 -1.23 0.00 0.00 66.70 63.93 1uk5 h VAL 32 Cb 2.70 2.56 -0.03 0.00 -2.13 0.00 0.00 31.29 34.39 1uk5 h VAL 32 CO -0.01 0.55 0.39 -0.33 -1.23 0.00 0.00 177.57 176.94 1uk5 h GLU 33 N -0.63 0.34 -0.12 5.19 5.08 0.23 0.91 114.58 125.58 1uk5 h GLU 33 Ca -0.30 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 57.94 1uk5 h GLU 33 Cb 1.52 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.68 1uk5 h GLU 33 CO -0.06 0.22 -0.37 0.00 -1.00 0.00 0.00 179.01 177.81 1uk5 h ALA 34 N 1.71 1.15 0.00 3.43 0.00 0.69 -2.10 119.26 124.15 1uk5 h ALA 34 Ca 0.27 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1uk5 h ALA 34 Cb 0.59 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1uk5 h ALA 34 CO -0.07 0.56 -0.17 0.82 0.00 0.00 0.00 179.25 180.39 1uk5 h ILE 35 N 0.22 0.88 -1.19 0.00 2.04 -0.50 -3.31 117.51 115.64 1uk5 h ILE 35 Ca 0.02 -1.71 0.38 0.00 1.00 0.00 0.00 64.86 64.56 1uk5 h ILE 35 Cb 0.75 1.71 -0.13 0.00 -0.74 0.00 0.00 36.82 38.42 1uk5 h ILE 35 CO 0.06 0.30 0.75 -0.07 0.00 0.00 0.00 178.15 179.19 1uk5 h LEU 36 N -1.00 0.33 -1.17 1.44 3.38 0.62 1.44 115.31 120.35 1uk5 h LEU 36 Ca -0.04 0.14 0.22 0.00 0.09 0.00 0.00 57.88 58.29 1uk5 h LEU 36 Cb 0.61 0.11 -0.10 0.00 0.09 0.00 0.00 40.66 41.37 1uk5 h LEU 36 CO -0.02 -0.13 0.62 1.05 0.09 0.00 0.00 178.44 180.05 1uk5 h GLU 37 N 0.18 0.57 -0.03 1.13 -0.00 -1.47 0.39 114.58 115.37 1uk5 h GLU 37 Ca 0.76 -0.03 -0.03 0.00 -0.00 0.00 0.00 59.36 60.05 1uk5 h GLU 37 Cb 2.19 -0.13 0.00 0.00 -0.00 0.00 0.00 28.75 30.81 1uk5 h GLU 37 CO -0.44 0.38 -0.11 0.87 -0.00 0.00 0.00 179.01 179.71 1uk5 h LYS 38 N 0.59 0.12 -1.12 1.06 1.57 0.18 -3.10 116.57 115.88 1uk5 h LYS 38 Ca 0.58 -0.09 0.32 0.00 -1.87 0.00 0.00 60.65 59.58 1uk5 h LYS 38 Cb 1.14 0.02 -0.11 0.00 0.08 0.00 0.00 32.23 33.36 1uk5 h LYS 38 CO -0.34 0.73 0.71 0.28 -0.57 0.00 0.00 179.45 180.26 1uk5 h VAL 39 N -0.47 0.38 -0.33 0.50 2.07 -0.67 1.81 116.25 119.55 1uk5 h VAL 39 Ca -0.01 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.48 1uk5 h VAL 39 Cb 0.75 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1uk5 h VAL 39 CO 0.02 0.05 0.23 1.56 0.02 0.00 0.00 177.57 179.46 1uk5 h GLN 40 N 0.30 0.13 0.00 1.57 1.08 -1.05 1.78 115.11 118.92 1uk5 h GLN 40 Ca 0.67 -0.01 -0.08 0.00 -1.45 0.00 0.00 58.65 57.78 1uk5 h GLN 40 Cb 1.83 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 29.22 1uk5 h GLN 40 CO -0.37 0.08 -0.40 0.78 -0.95 0.00 0.00 178.83 177.97 1uk5 h GLY 41 N 0.13 0.00 0.48 3.46 0.00 0.27 -0.62 103.07 106.79 1uk5 h GLY 41 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.13 1uk5 h GLY 41 CO -0.02 0.00 -2.08 1.04 0.00 0.00 0.00 176.54 175.48 1uk5 n LEU 42 N -3.40 1.53 -0.12 3.11 7.99 0.62 -3.45 117.00 123.28 1uk5 n LEU 42 Ca 0.01 0.17 -0.12 0.00 -0.01 0.00 0.00 56.01 56.05 1uk5 n LEU 42 Cb 0.58 -0.30 -0.00 0.00 -0.11 0.00 0.00 43.42 43.59 1uk5 n LEU 42 CO 0.38 0.64 0.58 -0.08 -1.51 0.00 0.00 177.39 177.40 1uk5 h GLU 43 N 0.02 0.93 0.00 3.23 4.22 0.25 0.28 114.58 123.51 1uk5 h GLU 43 Ca -0.44 -0.46 -0.06 0.00 0.08 0.00 0.00 59.36 58.48 1uk5 h GLU 43 Cb 2.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.30 1uk5 h GLU 43 CO 0.04 1.12 -0.28 1.96 -2.18 0.00 0.00 179.01 179.67 1uk5 h GLN 44 N 0.77 0.00 0.24 1.92 1.08 -1.28 -1.71 115.11 116.13 1uk5 h GLN 44 Ca 0.07 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.94 1uk5 h GLN 44 Cb 0.93 0.00 0.04 0.00 -0.05 0.00 0.00 27.48 28.39 1uk5 h GLN 44 CO 0.09 0.28 -1.48 0.00 -0.95 0.00 0.00 178.83 176.76 1uk5 h ALA 45 N 1.72 -0.13 0.26 3.87 0.00 -1.51 -2.99 119.26 120.49 1uk5 h ALA 45 Ca -0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.02 1uk5 h ALA 45 Cb 0.78 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1uk5 h ALA 45 CO 0.04 0.73 -0.13 0.28 0.00 0.00 0.00 179.25 180.17 1uk5 h VAL 46 N 0.14 0.78 0.00 0.00 2.07 -0.76 1.41 116.25 119.89 1uk5 h VAL 46 Ca -0.25 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1uk5 h VAL 46 Cb 2.16 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 1uk5 h VAL 46 CO 0.27 0.06 0.10 -0.78 0.02 0.00 0.00 177.57 177.23 1uk5 h ASP 47 N -0.49 0.00 -0.11 0.57 1.82 -1.43 0.55 116.42 117.33 1uk5 h ASP 47 Ca -0.04 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.60 1uk5 h ASP 47 Cb 0.37 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.38 1uk5 h ASP 47 CO 0.06 0.00 0.00 -0.24 -1.61 0.00 0.00 179.24 177.45 1uk5 n SER 48 N -2.91 2.76 -4.83 2.28 2.88 -0.53 -5.01 113.62 108.26 1uk5 n SER 48 Ca -0.03 -2.72 -0.38 0.00 -1.33 0.00 0.00 58.87 54.42 1uk5 n SER 48 Cb 0.16 -0.35 -0.06 0.00 -0.75 0.00 0.00 64.21 63.21 1uk5 n SER 48 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1uk5 s PHE 49 N -2.25 3.69 -0.01 0.66 5.36 0.47 -4.96 117.98 120.94 1uk5 s PHE 49 Ca 0.27 0.92 0.05 0.00 -0.96 0.00 0.00 56.93 57.20 1uk5 s PHE 49 Cb 0.22 -2.26 0.08 0.00 -0.34 0.00 0.00 43.02 40.71 1uk5 s PHE 49 CO 0.06 0.61 1.03 -1.91 -1.46 0.00 0.00 175.22 173.55 1uk5 n GLU 50 N 2.02 0.11 0.00 10.12 2.13 -1.26 -4.82 120.64 128.94 1uk5 n GLU 50 Ca -0.14 -1.26 0.00 0.00 0.66 0.00 0.00 57.16 56.42 1uk5 n GLU 50 Cb 0.53 -0.53 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1uk5 n GLU 50 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1uk5 n GLY 51 N -0.06 1.00 0.28 8.31 0.00 -1.26 -4.92 105.19 108.52 1uk5 n GLY 51 Ca 0.02 -1.42 -0.01 0.00 0.00 0.00 0.00 46.02 44.61 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 0.06 -0.06 1.61 2.85 -1.23 -4.20 118.16 117.18 1uk5 n LYS 52 Ca 0.00 -0.23 0.06 0.00 -1.05 0.00 0.00 58.31 57.09 1uk5 n LYS 52 Cb 0.00 0.22 0.27 0.00 -0.65 0.00 0.00 35.03 34.87 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 -0.05 1.38 -0.03 -1.58 5.02 -1.26 -3.40 118.16 118.24 1uk5 n LYS 53 Ca 0.00 -0.59 -0.04 0.00 -2.02 0.00 0.00 58.31 55.67 1uk5 n LYS 53 Cb 0.05 -1.24 -0.04 0.00 -0.02 0.00 0.00 35.03 33.78 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 -0.11 0.42 -1.12 -0.18 -2.24 -1.26 -4.95 114.28 104.84 1uk5 n THR 54 Ca 0.10 -0.23 -0.35 0.00 -2.27 0.00 0.00 64.05 61.31 1uk5 n THR 54 Cb 0.17 -0.82 0.10 0.00 -2.10 0.00 0.00 70.33 67.68 1uk5 n THR 54 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1uk5 n ASP 55 N -2.37 -0.70 -0.04 3.42 -0.08 -1.22 -4.91 116.55 110.65 1uk5 n ASP 55 Ca -0.11 0.53 -0.15 0.00 -1.51 0.00 0.00 54.79 53.55 1uk5 n ASP 55 Cb 0.68 -1.31 -0.08 0.00 2.34 0.00 0.00 41.12 42.76 1uk5 n ASP 55 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1uk5 h LYS 56 N -0.79 0.54 -0.73 -0.67 3.11 -1.96 -3.16 116.57 112.92 1uk5 h LYS 56 Ca -0.45 -0.40 0.16 0.00 -2.81 0.00 0.00 60.65 57.15 1uk5 h LYS 56 Cb 1.32 0.07 -0.13 0.00 -1.00 0.00 0.00 32.23 32.48 1uk5 h LYS 56 CO 0.42 1.02 -0.08 -0.22 -2.81 0.00 0.00 179.45 177.77 1uk5 h LYS 57 N 0.17 0.05 -0.91 1.90 3.64 -1.93 0.69 116.57 120.18 1uk5 h LYS 57 Ca -0.01 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.45 1uk5 h LYS 57 Cb 1.06 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.79 1uk5 h LYS 57 CO 0.09 0.03 0.56 -0.92 -2.27 0.00 0.00 179.45 176.95 1uk5 h TYR 58 N 0.05 1.02 -0.15 1.91 3.20 -1.77 0.35 116.97 121.59 1uk5 h TYR 58 Ca 0.38 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 62.16 1uk5 h TYR 58 Cb 0.63 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1uk5 h TYR 58 CO -0.49 0.45 -0.42 -0.07 -1.64 0.00 0.00 178.16 176.00 1uk5 h LEU 59 N 0.95 0.37 -0.20 2.82 3.38 0.15 -0.51 115.31 122.26 1uk5 h LEU 59 Ca 0.43 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.17 1uk5 h LEU 59 Cb 0.33 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1uk5 h LEU 59 CO -0.23 0.75 -0.13 0.24 0.09 0.00 0.00 178.44 179.16 1uk5 h MET 60 N 0.29 0.44 -0.08 1.13 2.86 0.20 0.73 114.93 120.50 1uk5 h MET 60 Ca 0.03 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.37 1uk5 h MET 60 Cb 0.86 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 1uk5 h MET 60 CO 0.07 0.76 -0.33 0.82 1.06 0.00 0.00 176.91 179.28 1uk5 h ILE 61 N 0.13 1.27 0.15 -1.22 2.04 -0.31 -1.26 117.51 118.30 1uk5 h ILE 61 Ca 0.04 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 1uk5 h ILE 61 Cb 0.64 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.31 1uk5 h ILE 61 CO 0.04 0.38 -0.07 -0.08 0.00 0.00 0.00 178.15 178.41 1uk5 h GLU 62 N 0.13 -0.19 -0.64 2.37 4.22 -0.92 0.18 114.58 119.73 1uk5 h GLU 62 Ca 0.02 0.01 0.08 0.00 0.08 0.00 0.00 59.36 59.54 1uk5 h GLU 62 Cb 0.66 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.89 1uk5 h GLU 62 CO 0.05 0.24 0.31 1.05 -2.18 0.00 0.00 179.01 178.48 1uk5 h GLU 63 N -0.72 0.54 0.61 1.92 4.11 -0.76 -1.31 114.58 118.96 1uk5 h GLU 63 Ca -0.02 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 59.35 1uk5 h GLU 63 Cb 0.52 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.65 1uk5 h GLU 63 CO 0.03 0.36 -0.29 1.88 0.07 0.00 0.00 179.01 181.06 1uk5 h TYR 64 N 0.56 -0.76 -0.91 2.06 0.05 -1.25 0.39 116.97 117.11 1uk5 h TYR 64 Ca 0.30 -0.02 0.17 0.00 0.05 0.00 0.00 58.73 59.24 1uk5 h TYR 64 Cb 0.28 0.25 -0.17 0.00 1.01 0.00 0.00 36.73 38.10 1uk5 h TYR 64 CO -0.11 -0.47 -0.26 1.28 -1.05 0.00 0.00 178.16 177.55 1uk5 n LEU 65 N -5.09 -0.39 -0.09 3.88 4.77 0.62 0.14 117.00 120.85 1uk5 n LEU 65 Ca -0.10 1.56 -0.11 0.00 -0.03 0.00 0.00 56.01 57.33 1uk5 n LEU 65 Cb 0.32 -0.45 -0.04 0.00 -2.33 0.00 0.00 43.42 40.93 1uk5 n LEU 65 CO 0.24 -1.48 0.81 0.74 -1.33 0.00 0.00 177.39 176.38 1uk5 h THR 66 N 0.00 1.23 -0.96 -5.08 2.02 -1.23 -2.50 112.91 106.38 1uk5 h THR 66 Ca 0.41 -0.76 0.28 0.00 0.77 0.00 0.00 66.41 67.11 1uk5 h THR 66 Cb 0.63 1.22 -0.15 0.00 -1.74 0.00 0.00 68.15 68.12 1uk5 h THR 66 CO -0.92 0.24 0.44 0.11 0.37 0.00 0.00 175.52 175.76 1uk5 h LYS 67 N 0.25 0.29 -0.13 6.66 1.57 0.35 1.61 116.57 127.17 1uk5 h LYS 67 Ca 0.08 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.71 1uk5 h LYS 67 Cb 0.32 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1uk5 h LYS 67 CO 0.00 0.19 -0.48 0.93 -0.57 0.00 0.00 179.45 179.53 1uk5 h GLU 68 N 0.29 0.34 0.77 3.15 4.39 -0.66 -2.54 114.58 120.32 1uk5 h GLU 68 Ca 0.66 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 60.14 1uk5 h GLU 68 Cb 1.44 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 30.10 1uk5 h GLU 68 CO -0.62 0.74 -0.37 -0.07 -1.16 0.00 0.00 179.01 177.53 1uk5 h LEU 69 N 0.27 -0.87 -1.47 1.33 3.38 0.27 0.19 115.31 118.40 1uk5 h LEU 69 Ca 0.02 0.01 0.21 0.00 0.09 0.00 0.00 57.88 58.21 1uk5 h LEU 69 Cb 0.94 0.23 -0.07 0.00 0.09 0.00 0.00 40.66 41.85 1uk5 h LEU 69 CO 0.08 -0.57 0.62 -0.07 0.09 0.00 0.00 178.44 178.58 1uk5 h LEU 70 N -1.13 0.43 -0.90 1.67 -0.00 -0.94 1.51 115.31 115.95 1uk5 h LEU 70 Ca -0.11 0.05 -0.08 0.00 -0.00 0.00 0.00 57.88 57.74 1uk5 h LEU 70 Cb 0.81 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.43 1uk5 h LEU 70 CO 0.17 0.16 -0.39 0.00 -0.00 0.00 0.00 178.44 178.38 1uk5 h ALA 71 N 1.61 0.99 0.00 1.53 0.00 -0.99 -0.46 119.26 121.93 1uk5 h ALA 71 Ca 0.50 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 1uk5 h ALA 71 Cb 1.23 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 1uk5 h ALA 71 CO -0.20 0.49 -0.85 -0.07 0.00 0.00 0.00 179.25 178.62 1uk5 h LEU 72 N 0.00 0.00 0.06 0.00 3.38 0.51 -3.24 115.31 116.01 1uk5 h LEU 72 Ca -0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 1uk5 h LEU 72 Cb 0.92 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.69 1uk5 h LEU 72 CO 0.05 0.85 -1.19 -0.78 0.09 0.00 0.00 178.44 177.46 1uk5 h ASP 73 N 0.00 0.68 0.00 -0.43 3.58 -0.12 -3.06 116.42 117.07 1uk5 h ASP 73 Ca -0.01 -0.63 0.00 0.00 0.42 0.00 0.00 57.03 56.81 1uk5 h ASP 73 Cb 1.64 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 42.47 1uk5 h ASP 73 CO 0.11 1.46 0.13 -1.28 -2.88 0.00 0.00 179.24 176.78 1uk5 h SER 74 N 0.21 0.00 -3.21 2.28 0.87 -1.12 -3.39 113.55 109.19 1uk5 h SER 74 Ca -0.15 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 59.82 1uk5 h SER 74 Cb 1.86 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 63.76 1uk5 h SER 74 CO 0.21 0.00 0.58 -0.69 -0.53 0.00 0.00 176.83 176.40 1uk5 s VAL 75 N -3.79 4.78 -0.29 2.23 1.01 -1.16 -5.02 120.40 118.17 1uk5 s VAL 75 Ca -0.03 1.79 -0.02 0.00 0.00 0.00 0.00 61.98 63.71 1uk5 s VAL 75 Cb 0.08 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 32.29 1uk5 s VAL 75 CO 0.26 -0.08 -0.00 -0.62 0.00 0.00 0.00 175.10 174.65 1uk5 s ASP 76 N 1.23 4.77 0.42 3.32 -1.08 -1.26 -4.96 116.67 119.11 1uk5 s ASP 76 Ca 0.40 -1.10 0.23 0.00 -0.52 0.00 0.00 52.55 51.56 1uk5 s ASP 76 Cb -0.16 -1.72 0.65 0.00 -1.46 0.00 0.00 42.92 40.23 1uk5 s ASP 76 CO 0.09 -0.22 1.71 1.55 0.52 0.00 0.00 175.17 178.82 1uk5 h PRO 77 N 8.04 0.00 0.00 4.34 0.13 -1.94 -3.47 132.00 139.10 1uk5 h PRO 77 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1uk5 h PRO 77 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1uk5 h PRO 77 CO 0.56 0.22 0.00 0.39 -0.23 0.00 0.00 178.00 178.94 1uk5 n GLU 78 N -3.26 0.00 -1.08 0.86 1.02 -1.26 -2.31 120.64 114.61 1uk5 n GLU 78 Ca 0.01 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.11 1uk5 n GLU 78 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.90 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 0.40 3.60 0.62 0.00 -1.26 -5.12 105.19 103.42 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 3.80 -0.05 1.61 1.81 -0.98 -4.99 118.95 120.16 1uk5 s ARG 80 Ca 0.01 -0.40 -0.19 0.00 -1.72 0.00 0.00 55.73 53.43 1uk5 s ARG 80 Cb 0.05 -3.08 -0.31 0.00 -0.45 0.00 0.00 34.95 31.15 1uk5 s ARG 80 CO -0.01 0.31 0.81 0.00 -0.68 0.00 0.00 175.30 175.72 1uk5 h ALA 81 N 6.54 -0.02 -0.51 2.13 0.00 -1.97 -0.71 119.26 124.71 1uk5 h ALA 81 Ca -0.36 -0.86 0.14 0.00 0.00 0.00 0.00 54.91 53.83 1uk5 h ALA 81 Cb 1.18 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1uk5 h ALA 81 CO 0.67 0.59 0.37 0.22 0.00 0.00 0.00 179.25 181.09 1uk5 h ASP 82 N -0.23 0.05 0.03 0.00 1.82 -1.99 0.62 116.42 116.72 1uk5 h ASP 82 Ca -0.22 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.24 1uk5 h ASP 82 Cb 1.80 -0.01 -0.02 0.00 0.68 0.00 0.00 39.33 41.78 1uk5 h ASP 82 CO 0.15 0.03 -0.97 0.58 -1.61 0.00 0.00 179.24 177.42 1uk5 h VAL 83 N 0.05 1.18 -0.50 2.25 2.07 -1.91 -3.19 116.25 116.21 1uk5 h VAL 83 Ca 0.24 -2.28 0.09 0.00 0.82 0.00 0.00 66.70 65.57 1uk5 h VAL 83 Cb 0.90 2.67 -0.07 0.00 -1.52 0.00 0.00 31.29 33.27 1uk5 h VAL 83 CO -0.02 0.50 0.08 0.03 0.02 0.00 0.00 177.57 178.19 1uk5 h ARG 84 N -0.81 0.21 -0.25 1.57 3.08 -0.18 1.18 114.38 119.19 1uk5 h ARG 84 Ca -0.24 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 59.83 1uk5 h ARG 84 Cb 1.35 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.32 1uk5 h ARG 84 CO -0.08 0.14 0.04 -0.56 -1.07 0.00 0.00 179.97 178.43 1uk5 h GLN 85 N 0.21 0.12 -0.39 0.04 3.07 0.06 1.02 115.11 119.25 1uk5 h GLN 85 Ca 0.25 -0.01 -0.04 0.00 0.09 0.00 0.00 58.65 58.94 1uk5 h GLN 85 Cb 0.34 -0.03 -0.02 0.00 0.08 0.00 0.00 27.48 27.86 1uk5 h GLN 85 CO -0.34 0.08 0.08 0.00 0.09 0.00 0.00 178.83 178.74 1uk5 h ALA 86 N 1.19 0.52 -0.62 0.06 0.00 -1.27 -0.97 119.26 118.17 1uk5 h ALA 86 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1uk5 h ALA 86 Cb 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1uk5 h ALA 86 CO -0.16 0.21 0.39 -0.09 0.00 0.00 0.00 179.25 179.59 1uk5 h ARG 87 N 0.49 0.83 -0.06 0.00 2.43 0.20 0.23 114.38 118.50 1uk5 h ARG 87 Ca 0.12 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1uk5 h ARG 87 Cb 0.33 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1uk5 h ARG 87 CO 0.00 0.58 0.04 -0.09 -1.51 0.00 0.00 179.97 178.99 1uk5 h ARG 88 N 0.84 0.08 -0.49 0.20 2.43 0.13 -1.96 114.38 115.61 1uk5 h ARG 88 Ca 0.22 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1uk5 h ARG 88 Cb -0.05 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1uk5 h ARG 88 CO -0.04 0.06 0.19 0.22 -1.51 0.00 0.00 179.97 178.88 1uk5 h ASP 89 N 0.08 0.64 0.22 -3.80 1.82 -0.86 0.28 116.42 114.80 1uk5 h ASP 89 Ca 0.02 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.59 1uk5 h ASP 89 Cb -0.01 -0.16 -0.04 0.00 0.68 0.00 0.00 39.33 39.80 1uk5 h ASP 89 CO -0.00 0.59 -0.48 1.23 -1.61 0.00 0.00 179.24 178.96 1uk5 h GLY 90 N 0.85 -1.19 0.66 -0.78 0.00 0.20 1.54 103.07 104.36 1uk5 h GLY 90 Ca 0.17 0.62 -0.02 0.00 0.00 0.00 0.00 47.33 48.10 1uk5 h GLY 90 CO -0.02 -0.31 -0.03 -0.39 0.00 0.00 0.00 176.54 175.80 1uk5 h VAL 91 N -0.76 1.32 -0.92 4.60 -1.51 -1.29 -2.73 116.25 114.96 1uk5 h VAL 91 Ca -0.02 -1.00 0.19 0.00 -1.23 0.00 0.00 66.70 64.64 1uk5 h VAL 91 Cb 0.73 1.86 -0.07 0.00 -2.13 0.00 0.00 31.29 31.67 1uk5 h VAL 91 CO -0.20 0.28 0.60 -0.09 -1.23 0.00 0.00 177.57 176.92 1uk5 h ARG 92 N -0.24 0.47 -0.15 5.19 1.12 -0.28 0.53 114.38 121.01 1uk5 h ARG 92 Ca 0.01 -0.03 -0.01 0.00 -1.11 0.00 0.00 59.98 58.85 1uk5 h ARG 92 Cb 0.45 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 30.30 1uk5 h ARG 92 CO 0.01 0.31 0.06 -0.22 -3.11 0.00 0.00 179.97 177.02 1uk5 h LYS 93 N 0.49 0.23 0.58 0.20 1.63 0.24 -2.34 116.57 117.61 1uk5 h LYS 93 Ca 0.48 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 60.21 1uk5 h LYS 93 Cb 1.08 -0.04 0.01 0.00 -0.60 0.00 0.00 32.23 32.68 1uk5 h LYS 93 CO -0.21 0.32 -0.28 0.28 -3.45 0.00 0.00 179.45 176.11 1uk5 h VAL 94 N 0.09 0.27 -0.83 2.00 2.07 -0.53 -2.03 116.25 117.29 1uk5 h VAL 94 Ca 0.05 -0.34 0.26 0.00 0.82 0.00 0.00 66.70 67.49 1uk5 h VAL 94 Cb 0.17 0.36 -0.15 0.00 -1.52 0.00 0.00 31.29 30.15 1uk5 h VAL 94 CO -0.00 0.04 0.14 0.00 0.02 0.00 0.00 177.57 177.76 1uk5 n GLN 95 N -5.34 -0.06 0.06 1.57 6.02 0.16 0.17 117.38 119.96 1uk5 n GLN 95 Ca -0.11 1.22 -0.13 0.00 -0.01 0.00 0.00 57.00 57.96 1uk5 n GLN 95 Cb 0.34 -2.00 -0.09 0.00 1.02 0.00 0.00 30.24 29.51 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 1.04 -0.92 5.09 2.02 -1.27 -1.32 112.91 117.55 1uk5 h THR 96 Ca 0.56 -0.74 0.06 0.00 0.77 0.00 0.00 66.41 67.06 1uk5 h THR 96 Cb 1.28 1.50 -0.06 0.00 -1.74 0.00 0.00 68.15 69.13 1uk5 h THR 96 CO -0.74 0.17 0.59 0.40 0.37 0.00 0.00 175.52 176.31 1uk5 h ILE 97 N -0.52 1.09 -0.43 3.11 2.04 0.19 -0.32 117.51 122.67 1uk5 h ILE 97 Ca -0.02 -0.37 0.02 0.00 1.00 0.00 0.00 64.86 65.49 1uk5 h ILE 97 Cb 0.41 -0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.37 1uk5 h ILE 97 CO 0.03 0.20 0.24 -0.07 0.00 0.00 0.00 178.15 178.55 1uk5 h LEU 98 N 1.09 0.39 -1.64 1.44 3.38 0.18 -0.54 115.31 119.60 1uk5 h LEU 98 Ca 0.39 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.35 1uk5 h LEU 98 Cb 0.13 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1uk5 h LEU 98 CO -0.16 0.28 0.02 -0.08 0.09 0.00 0.00 178.44 178.59 1uk5 h GLU 99 N 0.49 0.24 0.68 1.13 4.81 -0.03 -2.60 114.58 119.29 1uk5 h GLU 99 Ca 0.17 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1uk5 h GLU 99 Cb 0.02 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.37 1uk5 h GLU 99 CO -0.09 0.25 -0.33 0.87 -0.73 0.00 0.00 179.01 178.99 1uk5 h LYS 100 N 0.24 -0.88 -0.97 1.92 1.57 0.33 -3.09 116.57 115.68 1uk5 h LYS 100 Ca 0.06 0.06 0.21 0.00 -1.87 0.00 0.00 60.65 59.11 1uk5 h LYS 100 Cb 0.14 0.20 -0.18 0.00 0.08 0.00 0.00 32.23 32.47 1uk5 h LYS 100 CO 0.00 -0.59 -0.18 1.25 -0.57 0.00 0.00 179.45 179.37 1uk5 h LEU 101 N -1.18 -0.80 0.00 2.94 5.85 -0.97 0.80 115.31 121.96 1uk5 h LEU 101 Ca -0.09 0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1uk5 h LEU 101 Cb 0.70 0.57 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1uk5 h LEU 101 CO 0.15 -0.33 0.00 -0.62 -0.34 0.00 0.00 178.44 177.31 1uk5 n GLU 102 N -5.58 0.00 -0.13 1.25 1.02 -1.00 0.11 120.64 116.31 1uk5 n GLU 102 Ca 0.17 0.93 -0.08 0.00 -0.02 0.00 0.00 57.16 58.16 1uk5 n GLU 102 Cb 0.55 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 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 0.53 -0.99 3.49 1.08 -1.03 -1.78 115.11 116.40 1uk5 h GLN 103 Ca 0.00 -0.03 0.28 0.00 -1.45 0.00 0.00 58.65 57.45 1uk5 h GLN 103 Cb 0.00 -0.12 -0.14 0.00 -0.05 0.00 0.00 27.48 27.17 1uk5 h GLN 103 CO 0.00 0.35 0.56 0.87 -0.95 0.00 0.00 178.83 179.66 1uk5 h LYS 104 N 0.55 0.42 -0.65 1.46 1.79 0.15 1.20 116.57 121.49 1uk5 h LYS 104 Ca 0.15 -0.03 -0.05 0.00 -2.18 0.00 0.00 60.65 58.54 1uk5 h LYS 104 Cb -0.06 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.46 1uk5 h LYS 104 CO -0.03 0.28 0.21 0.00 -1.08 0.00 0.00 179.45 178.82 1uk5 h ALA 105 N 1.79 0.85 0.00 3.86 0.00 0.16 -0.58 119.26 125.34 1uk5 h ALA 105 Ca 0.68 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1uk5 h ALA 105 Cb 1.44 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1uk5 h ALA 105 CO -0.55 0.52 0.00 0.43 0.00 0.00 0.00 179.25 179.65 1uk5 n SER 106 N -4.36 0.00 0.00 0.00 7.64 0.38 -3.55 113.62 113.73 1uk5 n SER 106 Ca 0.04 -1.12 0.00 0.00 1.01 0.00 0.00 58.87 58.80 1uk5 n SER 106 Cb 0.21 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 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 0.79 2.86 0.19 0.23 0.00 0.86 -4.88 105.19 105.23 1uk5 n GLY 107 Ca 0.18 -1.92 -0.16 0.00 0.00 0.00 0.00 46.02 44.12 1uk5 n GLY 107 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uk5 h PRO 108 N 0.00 0.60 -5.34 1.61 0.13 -1.79 -3.30 132.00 123.91 1uk5 h PRO 108 Ca 0.00 -0.58 -0.58 0.00 -0.87 0.00 0.00 66.00 63.96 1uk5 h PRO 108 Cb 0.00 0.15 -0.07 0.00 0.13 0.00 0.00 31.00 31.21 1uk5 h PRO 108 CO 0.00 1.20 1.62 -1.13 -0.23 0.00 0.00 178.00 179.45 1uk5 n SER 109 N -3.84 0.53 -4.60 1.44 3.41 -1.26 -4.86 113.62 104.44 1uk5 n SER 109 Ca -0.08 0.32 -0.29 0.00 -0.26 0.00 0.00 58.87 58.56 1uk5 n SER 109 Cb 0.81 -0.94 0.17 0.00 -0.26 0.00 0.00 64.21 63.99 1uk5 n SER 109 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1uk5 s SER 110 N 8.15 2.72 0.00 4.04 0.01 -1.26 -5.09 113.70 122.26 1uk5 s SER 110 Ca 1.29 1.00 0.00 0.00 1.31 0.00 0.00 55.95 59.55 1uk5 s SER 110 Cb -1.29 -1.56 0.00 0.00 0.21 0.00 0.00 66.02 63.38 1uk5 s SER 110 CO 0.53 -3.05 0.00 0.61 0.41 0.00 0.00 173.24 171.75