#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 -0.29 0.25 1.61 0.01 -1.26 -5.12 113.70 108.90 1uk5 s SER 2 Ca 0.00 -0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.05 1uk5 s SER 2 Cb 0.00 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.71 1uk5 s SER 2 CO 0.00 -0.83 0.00 -1.20 0.41 0.00 0.00 173.24 171.62 1uk5 n SER 3 N -0.10 -6.58 -1.93 2.44 7.64 -1.26 -5.08 113.62 108.75 1uk5 n SER 3 Ca -0.17 0.83 -0.01 0.00 1.01 0.00 0.00 58.87 60.53 1uk5 n SER 3 Cb 0.63 -2.75 -0.00 0.00 -1.01 0.00 0.00 64.21 61.08 1uk5 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uk5 n GLY 4 N 0.05 4.14 3.62 0.23 0.00 -1.26 -5.17 105.19 106.80 1uk5 n GLY 4 Ca 0.00 -2.12 -0.03 0.00 0.00 0.00 0.00 46.02 43.87 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 -1.11 -0.08 -0.12 1.61 1.04 -1.26 -5.16 113.70 108.62 1uk5 s SER 5 Ca 0.00 0.02 -0.09 0.00 0.48 0.00 0.00 55.95 56.37 1uk5 s SER 5 Cb 0.00 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 1uk5 s SER 5 CO 0.00 -0.12 0.17 -0.44 0.98 0.00 0.00 173.24 173.83 1uk5 s SER 6 N -1.89 6.40 0.00 7.02 0.01 -1.26 -4.87 113.70 119.10 1uk5 s SER 6 Ca 0.10 0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.83 1uk5 s SER 6 Cb -0.01 -2.10 0.00 0.00 0.21 0.00 0.00 66.02 64.12 1uk5 s SER 6 CO -0.04 0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.57 1uk5 n GLY 7 N 2.30 -2.86 0.00 3.44 0.00 -1.26 -5.05 105.19 101.77 1uk5 n GLY 7 Ca -0.18 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.16 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 0.19 0.00 -1.87 4.61 0.00 -1.26 -5.04 120.51 117.14 1uk5 n ALA 8 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 1uk5 n ALA 8 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 0.00 2.28 -2.68 0.00 -0.04 -1.26 -4.27 135.00 129.04 1uk5 n PRO 9 Ca 0.00 -2.54 -0.04 0.00 -0.04 0.00 0.00 63.50 60.88 1uk5 n PRO 9 Cb 0.00 -3.35 0.10 0.00 -0.04 0.00 0.00 33.50 30.21 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 9.03 -2.87 -3.63 0.55 0.00 -1.26 -5.15 120.51 117.19 1uk5 n ALA 10 Ca 0.49 -0.56 -0.13 0.00 0.00 0.00 0.00 53.44 53.25 1uk5 n ALA 10 Cb 0.43 -2.82 -0.07 0.00 0.00 0.00 0.00 19.45 16.99 1uk5 n ALA 10 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1uk5 s GLU 11 N 0.12 0.74 0.91 0.00 2.02 -1.26 -5.18 118.70 116.05 1uk5 s GLU 11 Ca 0.23 0.81 -0.15 0.00 0.02 0.00 0.00 54.97 55.88 1uk5 s GLU 11 Cb 0.27 0.36 0.22 0.00 0.10 0.00 0.00 34.13 35.08 1uk5 s GLU 11 CO -0.16 -0.10 1.00 -0.35 0.02 0.00 0.00 175.26 175.67 1uk5 n PRO 12 N 2.40 -1.91 -3.25 0.39 -0.04 -1.26 -5.09 135.00 126.24 1uk5 n PRO 12 Ca -0.14 -1.56 -0.22 0.00 -0.04 0.00 0.00 63.50 61.54 1uk5 n PRO 12 Cb 0.55 -1.23 0.05 0.00 -0.04 0.00 0.00 33.50 32.83 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 -4.12 1.16 -2.50 0.55 0.00 -1.26 -5.14 120.51 109.20 1uk5 n ALA 13 Ca -0.17 -2.17 -0.23 0.00 0.00 0.00 0.00 53.44 50.87 1uk5 n ALA 13 Cb 0.48 0.68 -0.12 0.00 0.00 0.00 0.00 19.45 20.49 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 -2.74 1.89 1.03 0.00 0.00 -1.26 -5.15 121.76 115.53 1uk5 s ALA 14 Ca 0.54 -1.36 -0.05 0.00 0.00 0.00 0.00 51.96 51.09 1uk5 s ALA 14 Cb -0.04 -0.21 0.07 0.00 0.00 0.00 0.00 23.12 22.94 1uk5 s ALA 14 CO 0.34 0.29 0.32 -0.35 0.00 0.00 0.00 175.76 176.36 1uk5 n PRO 15 N 0.68 -0.96 -4.63 0.00 -0.04 -1.26 -5.10 135.00 123.69 1uk5 n PRO 15 Ca -0.16 -0.51 -0.29 0.00 -0.04 0.00 0.00 63.50 62.50 1uk5 n PRO 15 Cb 0.55 -0.40 -0.08 0.00 -0.04 0.00 0.00 33.50 33.53 1uk5 n PRO 15 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1uk5 s LYS 16 N -3.72 2.05 0.35 0.54 3.01 -1.26 -5.16 119.74 115.55 1uk5 s LYS 16 Ca 0.20 -2.28 0.07 0.00 -1.01 0.00 0.00 55.97 52.95 1uk5 s LYS 16 Cb -0.01 -1.03 -0.02 0.00 -1.01 0.00 0.00 37.83 35.76 1uk5 s LYS 16 CO 0.14 -0.43 0.36 -1.12 0.51 0.00 0.00 175.35 174.82 1uk5 s SER 17 N -3.73 5.44 -0.36 2.83 0.01 -1.26 -5.07 113.70 111.56 1uk5 s SER 17 Ca 0.16 -0.45 0.13 0.00 1.31 0.00 0.00 55.95 57.10 1uk5 s SER 17 Cb 0.02 -0.96 0.38 0.00 0.21 0.00 0.00 66.02 65.67 1uk5 s SER 17 CO 0.09 -0.44 0.81 0.61 0.41 0.00 0.00 173.24 174.72 1uk5 n GLY 18 N -1.49 2.95 3.51 3.44 0.00 -1.26 -5.09 105.19 107.25 1uk5 n GLY 18 Ca -0.00 -1.51 -0.09 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.46 0.81 -0.27 1.61 2.02 -1.26 -5.14 118.70 114.01 1uk5 s GLU 19 Ca 0.36 -0.26 -0.07 0.00 0.02 0.00 0.00 54.97 55.01 1uk5 s GLU 19 Cb 0.38 0.37 -0.01 0.00 0.10 0.00 0.00 34.13 34.97 1uk5 s GLU 19 CO -0.05 -0.35 0.07 0.00 0.02 0.00 0.00 175.26 174.96 1uk5 s ALA 20 N -2.96 3.11 -0.30 5.21 0.00 -1.26 -5.04 121.76 120.53 1uk5 s ALA 20 Ca 0.04 -1.27 -0.17 0.00 0.00 0.00 0.00 51.96 50.56 1uk5 s ALA 20 Cb -0.01 -2.11 0.20 0.00 0.00 0.00 0.00 23.12 21.20 1uk5 s ALA 20 CO -0.08 -0.68 1.23 -2.00 0.00 0.00 0.00 175.76 174.23 1uk5 s GLU 21 N 1.57 0.08 -0.36 0.00 2.12 -1.26 -5.13 118.70 115.71 1uk5 s GLU 21 Ca 0.05 0.16 0.06 0.00 0.36 0.00 0.00 54.97 55.60 1uk5 s GLU 21 Cb -0.16 0.05 0.18 0.00 0.26 0.00 0.00 34.13 34.45 1uk5 s GLU 21 CO 0.03 -0.02 0.55 0.99 -0.54 0.00 0.00 175.26 176.27 1uk5 s THR 22 N 1.39 -0.83 0.96 -1.70 2.01 -1.26 -5.16 115.64 111.05 1uk5 s THR 22 Ca -0.06 -0.22 -0.14 0.00 0.31 0.00 0.00 61.69 61.58 1uk5 s THR 22 Cb -0.02 -0.46 0.17 0.00 0.01 0.00 0.00 72.50 72.20 1uk5 s THR 22 CO -0.12 -0.15 1.16 -2.16 -0.69 0.00 0.00 174.62 172.67 1uk5 s PRO 23 N 2.06 0.70 -0.02 4.92 0.04 -1.26 -4.99 135.00 136.45 1uk5 s PRO 23 Ca 0.14 0.12 -0.30 0.00 0.04 0.00 0.00 61.00 61.00 1uk5 s PRO 23 Cb -0.08 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 1uk5 s PRO 23 CO -0.13 -2.46 1.20 -1.25 0.04 0.00 0.00 177.00 174.39 1uk5 s PRO 24 N -5.40 4.38 0.00 0.56 0.04 -1.26 -4.97 135.00 128.35 1uk5 s PRO 24 Ca 0.66 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.41 1uk5 s PRO 24 Cb -0.12 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.92 1uk5 s PRO 24 CO 0.54 -0.38 0.00 0.36 0.04 0.00 0.00 177.00 177.55 1uk5 n LYS 25 N 4.79 0.77 -3.30 4.56 2.85 -1.26 -5.13 118.16 121.44 1uk5 n LYS 25 Ca 0.10 0.00 -0.39 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 2.40 3.75 0.14 5.58 5.65 -1.26 -4.98 115.29 126.56 1uk5 s HIS 26 Ca 0.00 1.19 -0.05 0.00 0.25 0.00 0.00 55.06 56.45 1uk5 s HIS 26 Cb 0.00 -2.50 -0.06 0.00 -1.18 0.00 0.00 32.58 28.84 1uk5 s HIS 26 CO 0.00 0.51 1.34 -1.00 -0.65 0.00 0.00 174.74 174.94 1uk5 h PRO 27 N 4.98 0.46 -0.80 2.88 0.13 -2.00 -2.97 132.00 134.67 1uk5 h PRO 27 Ca -0.48 -0.45 0.19 0.00 -0.87 0.00 0.00 66.00 64.39 1uk5 h PRO 27 Cb 1.21 0.11 -0.05 0.00 0.13 0.00 0.00 31.00 32.40 1uk5 h PRO 27 CO 0.65 1.09 0.55 0.78 -0.23 0.00 0.00 178.00 180.84 1uk5 h GLY 28 N 1.14 0.57 0.11 1.56 0.00 -1.93 -0.39 103.07 104.12 1uk5 h GLY 28 Ca -0.06 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 1uk5 h GLY 28 CO 0.15 0.02 -0.04 -2.08 0.00 0.00 0.00 176.54 174.59 1uk5 h VAL 29 N 0.29 0.57 -1.28 4.60 2.07 -1.86 -3.27 116.25 117.37 1uk5 h VAL 29 Ca 0.40 -1.29 0.42 0.00 0.82 0.00 0.00 66.70 67.05 1uk5 h VAL 29 Cb 1.13 1.04 -0.13 0.00 -1.52 0.00 0.00 31.29 31.82 1uk5 h VAL 29 CO -0.11 0.18 0.82 -0.07 0.02 0.00 0.00 177.57 178.41 1uk5 h LEU 30 N -0.99 0.27 -1.89 2.57 3.38 -1.23 1.55 115.31 118.96 1uk5 h LEU 30 Ca -0.01 0.14 0.46 0.00 0.09 0.00 0.00 57.88 58.56 1uk5 h LEU 30 Cb 0.37 0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 1uk5 h LEU 30 CO 0.02 -0.18 1.10 0.50 0.09 0.00 0.00 178.44 179.97 1uk5 h LYS 31 N 0.11 0.03 0.07 1.13 3.64 -1.14 0.98 116.57 121.38 1uk5 h LYS 31 Ca 0.81 -0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.98 1uk5 h LYS 31 Cb 2.47 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 34.28 1uk5 h LYS 31 CO -0.43 0.02 -1.07 -0.39 -2.27 0.00 0.00 179.45 175.31 1uk5 h VAL 32 N 0.03 1.18 -0.94 2.00 -1.51 0.20 -3.31 116.25 113.89 1uk5 h VAL 32 Ca 0.77 -2.34 0.13 0.00 -1.23 0.00 0.00 66.70 64.02 1uk5 h VAL 32 Cb 2.95 2.75 -0.08 0.00 -2.13 0.00 0.00 31.29 34.79 1uk5 h VAL 32 CO -0.07 0.59 0.60 -0.33 -1.23 0.00 0.00 177.57 177.12 1uk5 h GLU 33 N -0.62 0.83 -0.37 5.19 5.08 0.67 0.76 114.58 126.12 1uk5 h GLU 33 Ca -0.25 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.08 1uk5 h GLU 33 Cb 1.49 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.54 1uk5 h GLU 33 CO -0.02 0.55 0.25 0.00 -1.00 0.00 0.00 179.01 178.80 1uk5 h ALA 34 N 1.57 1.83 0.00 3.43 0.00 0.40 0.65 119.26 127.13 1uk5 h ALA 34 Ca 0.47 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.29 1uk5 h ALA 34 Cb 0.57 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1uk5 h ALA 34 CO -0.23 0.13 -0.39 0.82 0.00 0.00 0.00 179.25 179.59 1uk5 h ILE 35 N 0.42 1.11 -1.12 0.00 2.04 -0.45 -3.33 117.51 116.18 1uk5 h ILE 35 Ca 0.15 -1.96 0.33 0.00 1.00 0.00 0.00 64.86 64.37 1uk5 h ILE 35 Cb 0.07 2.22 -0.12 0.00 -0.74 0.00 0.00 36.82 38.26 1uk5 h ILE 35 CO -0.03 0.38 0.70 -0.07 0.00 0.00 0.00 178.15 179.12 1uk5 h LEU 36 N -1.00 0.41 -0.94 1.44 3.38 0.57 1.20 115.31 120.36 1uk5 h LEU 36 Ca -0.09 0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.09 1uk5 h LEU 36 Cb 0.88 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.63 1uk5 h LEU 36 CO -0.06 -0.04 0.59 -0.33 0.09 0.00 0.00 178.44 178.69 1uk5 h GLU 37 N 0.29 0.97 -0.01 1.13 5.08 -0.97 -1.55 114.58 119.52 1uk5 h GLU 37 Ca 0.70 -0.06 -0.21 0.00 -1.00 0.00 0.00 59.36 58.79 1uk5 h GLU 37 Cb 1.86 -0.22 0.02 0.00 0.50 0.00 0.00 28.75 30.91 1uk5 h GLU 37 CO -0.41 0.64 -0.83 0.87 -1.00 0.00 0.00 179.01 178.29 1uk5 h LYS 38 N 1.00 0.58 -0.78 2.33 1.57 0.12 -3.27 116.57 118.12 1uk5 h LYS 38 Ca 0.44 -0.61 0.15 0.00 -1.87 0.00 0.00 60.65 58.76 1uk5 h LYS 38 Cb 0.33 0.17 -0.15 0.00 0.08 0.00 0.00 32.23 32.66 1uk5 h LYS 38 CO -0.22 1.22 -0.26 0.28 -0.57 0.00 0.00 179.45 179.90 1uk5 h VAL 39 N 0.18 0.16 -0.83 0.50 2.07 -0.01 0.74 116.25 119.06 1uk5 h VAL 39 Ca -0.10 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.62 1uk5 h VAL 39 Cb 1.50 0.16 -0.13 0.00 -1.52 0.00 0.00 31.29 31.30 1uk5 h VAL 39 CO 0.16 0.00 0.20 1.56 0.02 0.00 0.00 177.57 179.51 1uk5 h GLN 40 N -0.04 0.22 0.00 1.57 1.08 -1.40 1.66 115.11 118.20 1uk5 h GLN 40 Ca 0.35 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.50 1uk5 h GLN 40 Cb 0.58 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.96 1uk5 h GLN 40 CO -0.82 0.14 -0.14 0.78 -0.95 0.00 0.00 178.83 177.85 1uk5 h GLY 41 N 0.22 0.00 0.88 3.46 0.00 0.34 0.41 103.07 108.38 1uk5 h GLY 41 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.83 1uk5 h GLY 41 CO -0.61 0.00 -1.10 1.04 0.00 0.00 0.00 176.54 175.87 1uk5 n LEU 42 N -3.61 0.75 0.02 3.11 4.77 0.47 -3.88 117.00 118.63 1uk5 n LEU 42 Ca -0.01 0.28 -0.13 0.00 -0.03 0.00 0.00 56.01 56.12 1uk5 n LEU 42 Cb 0.27 -0.06 -0.14 0.00 -2.33 0.00 0.00 43.42 41.16 1uk5 n LEU 42 CO 0.31 -0.16 -0.42 -0.08 -1.33 0.00 0.00 177.39 175.71 1uk5 h GLU 43 N 0.00 0.13 -0.84 3.23 4.22 0.26 -3.32 114.58 118.26 1uk5 h GLU 43 Ca 0.00 -0.22 0.02 0.00 0.08 0.00 0.00 59.36 59.25 1uk5 h GLU 43 Cb 0.99 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.27 1uk5 h GLU 43 CO 0.00 0.88 0.55 -0.56 -2.18 0.00 0.00 179.01 177.70 1uk5 h GLN 44 N 0.03 1.06 -0.78 1.92 3.07 -0.36 -1.05 115.11 119.00 1uk5 h GLN 44 Ca -0.26 -0.06 0.00 0.00 0.09 0.00 0.00 58.65 58.42 1uk5 h GLN 44 Cb 1.99 -0.24 -0.04 0.00 0.08 0.00 0.00 27.48 29.27 1uk5 h GLN 44 CO 0.12 0.70 0.50 0.00 0.09 0.00 0.00 178.83 180.23 1uk5 h ALA 45 N 1.33 1.41 -0.41 0.06 0.00 -1.69 -0.39 119.26 119.57 1uk5 h ALA 45 Ca 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1uk5 h ALA 45 Cb -0.06 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.42 1uk5 h ALA 45 CO -0.09 0.53 0.00 0.28 0.00 0.00 0.00 179.25 179.97 1uk5 n VAL 46 N -4.40 0.00 -0.18 0.00 0.31 -0.47 0.19 118.33 113.78 1uk5 n VAL 46 Ca 0.08 1.37 0.29 0.00 -0.01 0.00 0.00 64.34 66.08 1uk5 n VAL 46 Cb 0.05 -2.36 0.61 0.00 -0.91 0.00 0.00 33.84 31.23 1uk5 n VAL 46 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1uk5 h ASP 47 N 0.00 0.00 -0.86 4.52 3.58 -1.31 1.63 116.42 123.97 1uk5 h ASP 47 Ca 0.00 0.00 -0.56 0.00 0.42 0.00 0.00 57.03 56.89 1uk5 h ASP 47 Cb 0.00 0.00 -0.43 0.00 1.72 0.00 0.00 39.33 40.62 1uk5 h ASP 47 CO 0.00 0.00 -0.77 -0.24 -2.88 0.00 0.00 179.24 175.35 1uk5 n SER 48 N -3.57 4.97 -5.00 2.28 2.88 -0.16 -5.04 113.62 109.97 1uk5 n SER 48 Ca 0.20 -3.75 -0.18 0.00 -1.33 0.00 0.00 58.87 53.82 1uk5 n SER 48 Cb 1.25 -0.37 0.02 0.00 -0.75 0.00 0.00 64.21 64.36 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 -3.60 2.51 -0.26 0.66 5.36 0.55 -4.77 117.98 118.42 1uk5 s PHE 49 Ca 0.51 -0.43 -0.23 0.00 -0.96 0.00 0.00 56.93 55.82 1uk5 s PHE 49 Cb 0.41 -2.39 0.07 0.00 -0.34 0.00 0.00 43.02 40.77 1uk5 s PHE 49 CO 0.01 -0.63 0.70 -1.21 -1.46 0.00 0.00 175.22 172.62 1uk5 s GLU 50 N -4.47 0.80 0.00 10.12 2.02 -1.26 -5.02 118.70 120.90 1uk5 s GLU 50 Ca 0.57 1.00 0.00 0.00 0.02 0.00 0.00 54.97 56.56 1uk5 s GLU 50 Cb -0.09 0.37 0.00 0.00 0.10 0.00 0.00 34.13 34.51 1uk5 s GLU 50 CO 0.35 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.94 1uk5 n GLY 51 N 2.88 0.29 2.12 -1.39 0.00 -1.26 -4.85 105.19 102.99 1uk5 n GLY 51 Ca -0.15 -1.70 -0.11 0.00 0.00 0.00 0.00 46.02 44.06 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 0.36 0.00 1.61 0.00 -1.26 -4.23 118.16 114.65 1uk5 n LYS 52 Ca 0.00 -1.97 0.09 0.00 -0.00 0.00 0.00 58.31 56.43 1uk5 n LYS 52 Cb 0.00 1.75 0.47 0.00 -0.00 0.00 0.00 35.03 37.25 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 -0.39 0.27 -0.10 -1.58 5.02 -0.78 -3.04 118.16 117.56 1uk5 n LYS 53 Ca 0.03 0.11 -0.18 0.00 -2.02 0.00 0.00 58.31 56.24 1uk5 n LYS 53 Cb 0.38 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.81 1uk5 n LYS 53 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1uk5 n THR 54 N -1.28 1.50 -1.47 -0.18 5.66 -1.26 -4.75 114.28 112.50 1uk5 n THR 54 Ca 0.09 -0.01 -0.58 0.00 -3.05 0.00 0.00 64.05 60.50 1uk5 n THR 54 Cb 0.15 -2.12 -0.08 0.00 -1.55 0.00 0.00 70.33 66.73 1uk5 n THR 54 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1uk5 n ASP 55 N -4.45 0.08 0.28 1.09 8.00 -1.17 -4.71 116.55 115.67 1uk5 n ASP 55 Ca -0.29 1.12 0.18 0.00 0.71 0.00 0.00 54.79 56.52 1uk5 n ASP 55 Cb 0.60 -0.89 0.90 0.00 -0.02 0.00 0.00 41.12 41.72 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 3.05 0.00 0.51 -1.24 3.11 -1.91 -1.10 116.57 118.99 1uk5 h LYS 56 Ca -0.49 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.33 1uk5 h LYS 56 Cb 1.38 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.60 1uk5 h LYS 56 CO 0.65 0.00 -0.33 -0.22 -2.81 0.00 0.00 179.45 176.75 1uk5 h LYS 57 N 0.00 -0.77 -0.61 1.90 3.64 -1.90 0.20 116.57 119.02 1uk5 h LYS 57 Ca 0.04 0.05 0.12 0.00 -1.27 0.00 0.00 60.65 59.59 1uk5 h LYS 57 Cb 0.53 0.18 -0.09 0.00 -0.41 0.00 0.00 32.23 32.44 1uk5 h LYS 57 CO -0.00 -0.51 0.11 -0.92 -2.27 0.00 0.00 179.45 175.86 1uk5 h TYR 58 N -0.80 0.17 -0.18 1.91 3.20 -1.40 -0.55 116.97 119.33 1uk5 h TYR 58 Ca -0.06 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.89 1uk5 h TYR 58 Cb 0.66 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.91 1uk5 h TYR 58 CO -0.11 -0.06 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.23 1uk5 h LEU 59 N 0.24 -0.20 0.02 2.82 4.07 -1.44 0.10 115.31 120.92 1uk5 h LEU 59 Ca 0.32 0.06 0.02 0.00 0.08 0.00 0.00 57.88 58.36 1uk5 h LEU 59 Cb 0.49 0.13 -0.05 0.00 1.08 0.00 0.00 40.66 42.30 1uk5 h LEU 59 CO -0.43 -0.08 -0.49 0.24 -1.08 0.00 0.00 178.44 176.61 1uk5 h MET 60 N -0.02 -0.63 0.19 1.13 2.86 0.53 -1.10 114.93 117.90 1uk5 h MET 60 Ca 0.09 0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1uk5 h MET 60 Cb 0.16 0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1uk5 h MET 60 CO -0.20 -0.42 -0.48 0.82 1.06 0.00 0.00 176.91 177.69 1uk5 h ILE 61 N -0.65 0.06 -0.89 -1.22 2.04 -0.94 -1.05 117.51 114.86 1uk5 h ILE 61 Ca 0.02 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.12 1uk5 h ILE 61 Cb 0.71 0.06 -0.17 0.00 -0.74 0.00 0.00 36.82 36.69 1uk5 h ILE 61 CO -0.33 0.00 -0.01 1.21 0.00 0.00 0.00 178.15 179.02 1uk5 n GLU 62 N -5.49 -0.07 0.19 2.37 0.00 0.33 0.10 120.64 118.07 1uk5 n GLU 62 Ca -0.09 1.34 -0.15 0.00 0.00 0.00 0.00 57.16 58.27 1uk5 n GLU 62 Cb 0.41 -2.11 -0.08 0.00 0.00 0.00 0.00 31.44 29.66 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 -0.40 -0.84 5.31 4.11 0.02 -1.35 114.58 121.43 1uk5 h GLU 63 Ca 0.53 0.03 0.15 0.00 0.07 0.00 0.00 59.36 60.13 1uk5 h GLU 63 Cb 1.06 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 30.31 1uk5 h GLU 63 CO -0.85 -0.24 0.43 1.88 0.07 0.00 0.00 179.01 180.30 1uk5 h TYR 64 N -0.46 0.74 0.00 2.06 0.05 0.17 0.17 116.97 119.71 1uk5 h TYR 64 Ca -0.04 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1uk5 h TYR 64 Cb 0.35 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 37.89 1uk5 h TYR 64 CO -0.04 0.17 0.00 1.28 -1.05 0.00 0.00 178.16 178.52 1uk5 n LEU 65 N -4.88 0.04 -0.33 3.88 4.32 0.62 -2.88 117.00 117.78 1uk5 n LEU 65 Ca 0.17 0.79 0.27 0.00 -0.02 0.00 0.00 56.01 57.22 1uk5 n LEU 65 Cb 0.43 -0.31 0.50 0.00 -1.62 0.00 0.00 43.42 42.42 1uk5 n LEU 65 CO 0.21 -0.31 0.97 0.41 -1.22 0.00 0.00 177.39 177.45 1uk5 n THR 66 N -1.43 -0.42 -0.34 -5.08 -1.04 -0.53 0.13 114.28 105.56 1uk5 n THR 66 Ca 0.00 2.07 0.16 0.00 -2.04 0.00 0.00 64.05 64.23 1uk5 n THR 66 Cb 0.00 -3.25 0.31 0.00 -1.82 0.00 0.00 70.33 65.57 1uk5 n THR 66 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1uk5 h LYS 67 N 0.00 0.01 -0.50 -2.82 1.57 -0.51 1.68 116.57 116.00 1uk5 h LYS 67 Ca 0.77 -0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.46 1uk5 h LYS 67 Cb 1.94 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.23 1uk5 h LYS 67 CO -0.82 0.01 -0.04 0.93 -0.57 0.00 0.00 179.45 178.96 1uk5 h GLU 68 N 0.01 0.92 -0.19 3.15 4.39 0.10 -2.11 114.58 120.86 1uk5 h GLU 68 Ca 0.62 -0.31 0.05 0.00 0.34 0.00 0.00 59.36 60.06 1uk5 h GLU 68 Cb 1.31 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.82 1uk5 h GLU 68 CO -0.90 0.96 -0.22 -0.07 -1.16 0.00 0.00 179.01 177.62 1uk5 h LEU 69 N 0.78 -0.70 -1.03 1.33 3.38 0.25 1.08 115.31 120.40 1uk5 h LEU 69 Ca 0.14 0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.29 1uk5 h LEU 69 Cb 0.58 0.32 -0.06 0.00 0.09 0.00 0.00 40.66 41.59 1uk5 h LEU 69 CO 0.03 -0.26 0.65 -0.07 0.09 0.00 0.00 178.44 178.87 1uk5 h LEU 70 N -0.25 1.04 -1.29 1.67 -0.00 -0.84 0.25 115.31 115.89 1uk5 h LEU 70 Ca 0.12 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.94 1uk5 h LEU 70 Cb 0.43 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.86 1uk5 h LEU 70 CO -0.33 0.68 -0.28 0.00 -0.00 0.00 0.00 178.44 178.50 1uk5 h ALA 71 N 1.45 1.15 0.00 1.53 0.00 -0.24 0.94 119.26 124.09 1uk5 h ALA 71 Ca 0.42 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1uk5 h ALA 71 Cb 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1uk5 h ALA 71 CO -0.16 0.35 -0.28 -0.07 0.00 0.00 0.00 179.25 179.10 1uk5 h LEU 72 N 0.00 0.00 0.00 0.00 3.38 0.44 -2.92 115.31 116.21 1uk5 h LEU 72 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1uk5 h LEU 72 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1uk5 h LEU 72 CO 0.04 0.28 -1.26 -0.67 0.09 0.00 0.00 178.44 176.92 1uk5 n ASP 73 N -3.26 0.62 -0.13 -0.43 -0.08 -0.22 -4.08 116.55 108.98 1uk5 n ASP 73 Ca 0.02 0.22 -0.10 0.00 -1.51 0.00 0.00 54.79 53.42 1uk5 n ASP 73 Cb 0.56 0.85 -0.02 0.00 2.34 0.00 0.00 41.12 44.85 1uk5 n ASP 73 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 1uk5 h SER 74 N 0.00 0.63 -3.90 1.67 0.87 -0.66 -3.43 113.55 108.73 1uk5 h SER 74 Ca 0.00 -0.28 -0.55 0.00 -1.23 0.00 0.00 61.79 59.72 1uk5 h SER 74 Cb 0.99 -0.17 0.13 0.00 -0.44 0.00 0.00 62.40 62.91 1uk5 h SER 74 CO 0.00 0.76 0.59 1.33 -0.53 0.00 0.00 176.83 178.98 1uk5 n VAL 75 N -4.51 3.29 -3.90 2.23 0.24 -1.18 -4.99 118.33 109.51 1uk5 n VAL 75 Ca -0.01 -0.50 -0.35 0.00 -2.04 0.00 0.00 64.34 61.44 1uk5 n VAL 75 Cb 0.26 -1.68 -0.14 0.00 -1.47 0.00 0.00 33.84 30.81 1uk5 n VAL 75 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1uk5 s ASP 76 N -0.72 4.44 0.13 -1.34 1.01 -1.26 -4.98 116.67 113.95 1uk5 s ASP 76 Ca 0.67 -0.62 -0.06 0.00 0.71 0.00 0.00 52.55 53.25 1uk5 s ASP 76 Cb -0.44 -1.74 -0.08 0.00 1.01 0.00 0.00 42.92 41.67 1uk5 s ASP 76 CO 0.53 -0.09 1.32 1.55 0.21 0.00 0.00 175.17 178.69 1uk5 h PRO 77 N 8.10 0.50 -4.09 8.23 0.13 -1.90 -3.48 132.00 139.48 1uk5 h PRO 77 Ca -0.37 -0.49 -0.04 0.00 -0.87 0.00 0.00 66.00 64.23 1uk5 h PRO 77 Cb 1.14 0.13 0.04 0.00 0.13 0.00 0.00 31.00 32.43 1uk5 h PRO 77 CO 0.59 1.12 -0.15 0.39 -0.23 0.00 0.00 178.00 179.72 1uk5 n GLU 78 N -3.81 -0.77 -4.38 0.86 1.02 -1.26 -3.61 120.64 108.69 1uk5 n GLU 78 Ca -0.07 0.74 -0.38 0.00 -0.02 0.00 0.00 57.16 57.43 1uk5 n GLU 78 Cb 0.80 -3.45 -0.07 0.00 -0.02 0.00 0.00 31.44 28.70 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 -1.36 -0.34 2.91 0.62 0.00 -1.26 -4.89 105.19 100.87 1uk5 n GLY 79 Ca -0.01 0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -7.16 1.21 0.32 1.61 0.52 -1.24 -4.97 118.95 109.24 1uk5 s ARG 80 Ca 0.57 -1.54 0.09 0.00 -0.52 0.00 0.00 55.73 54.34 1uk5 s ARG 80 Cb -0.33 -2.73 0.84 0.00 0.52 0.00 0.00 34.95 33.26 1uk5 s ARG 80 CO 0.99 -0.94 1.76 0.00 0.02 0.00 0.00 175.30 177.13 1uk5 h ALA 81 N 7.80 1.79 -0.53 2.13 0.00 -1.91 1.57 119.26 130.11 1uk5 h ALA 81 Ca -0.08 0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.02 1uk5 h ALA 81 Cb 1.02 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 1uk5 h ALA 81 CO 0.50 -0.21 0.02 -0.44 0.00 0.00 0.00 179.25 179.12 1uk5 h ASP 82 N 0.65 -0.19 0.00 0.00 5.19 -1.96 1.52 116.42 121.63 1uk5 h ASP 82 Ca 0.60 0.12 -0.01 0.00 -0.62 0.00 0.00 57.03 57.13 1uk5 h ASP 82 Cb 1.09 0.21 -0.00 0.00 0.18 0.00 0.00 39.33 40.81 1uk5 h ASP 82 CO -0.40 -0.06 -0.05 0.58 -3.12 0.00 0.00 179.24 176.18 1uk5 h VAL 83 N 0.14 1.45 -0.22 -1.35 2.07 -0.75 -3.22 116.25 114.36 1uk5 h VAL 83 Ca 0.27 -2.10 0.05 0.00 0.82 0.00 0.00 66.70 65.74 1uk5 h VAL 83 Cb 0.41 2.75 -0.07 0.00 -1.52 0.00 0.00 31.29 32.86 1uk5 h VAL 83 CO -0.43 0.49 -0.47 -0.09 0.02 0.00 0.00 177.57 177.09 1uk5 h ARG 84 N -1.00 -0.46 -0.69 1.57 2.43 0.23 0.24 114.38 116.70 1uk5 h ARG 84 Ca -0.01 0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.29 1uk5 h ARG 84 Cb 0.84 0.10 -0.12 0.00 -0.42 0.00 0.00 29.97 30.37 1uk5 h ARG 84 CO -0.01 -0.31 -0.45 0.37 -1.51 0.00 0.00 179.97 178.06 1uk5 h GLN 85 N -0.48 -0.16 -0.43 0.20 4.15 0.20 0.28 115.11 118.87 1uk5 h GLN 85 Ca 0.08 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.60 1uk5 h GLN 85 Cb 0.63 0.04 -0.09 0.00 0.21 0.00 0.00 27.48 28.27 1uk5 h GLN 85 CO -0.47 -0.11 -0.16 0.00 -1.93 0.00 0.00 178.83 176.17 1uk5 h ALA 86 N 0.70 0.20 -0.70 3.38 0.00 -1.32 0.90 119.26 122.41 1uk5 h ALA 86 Ca 0.20 0.16 0.15 0.00 0.00 0.00 0.00 54.91 55.42 1uk5 h ALA 86 Cb 0.55 0.42 -0.11 0.00 0.00 0.00 0.00 17.79 18.65 1uk5 h ALA 86 CO -0.76 -0.51 0.13 -0.09 0.00 0.00 0.00 179.25 178.02 1uk5 h ARG 87 N -0.07 0.22 -0.01 0.00 2.43 0.15 0.36 114.38 117.46 1uk5 h ARG 87 Ca 0.21 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1uk5 h ARG 87 Cb 0.39 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1uk5 h ARG 87 CO -0.48 0.15 -0.01 0.00 -1.51 0.00 0.00 179.97 178.12 1uk5 h ARG 88 N 0.23 0.03 -0.88 0.20 3.08 0.12 0.70 114.38 117.85 1uk5 h ARG 88 Ca 0.39 -0.02 0.20 0.00 0.07 0.00 0.00 59.98 60.62 1uk5 h ARG 88 Cb 0.65 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.58 1uk5 h ARG 88 CO -0.51 0.50 0.39 0.22 -1.07 0.00 0.00 179.97 179.50 1uk5 h ASP 89 N -0.44 0.36 0.02 7.04 1.82 0.18 0.84 116.42 126.24 1uk5 h ASP 89 Ca 0.00 0.14 -0.00 0.00 -0.39 0.00 0.00 57.03 56.78 1uk5 h ASP 89 Cb 0.50 0.11 0.00 0.00 0.68 0.00 0.00 39.33 40.62 1uk5 h ASP 89 CO 0.00 0.04 -0.01 1.23 -1.61 0.00 0.00 179.24 178.90 1uk5 h GLY 90 N 0.44 -0.03 0.63 -0.78 0.00 -0.24 -2.55 103.07 100.54 1uk5 h GLY 90 Ca 0.53 0.01 0.14 0.00 0.00 0.00 0.00 47.33 48.02 1uk5 h GLY 90 CO -0.49 -0.01 0.53 -2.08 0.00 0.00 0.00 176.54 174.49 1uk5 h VAL 91 N -0.62 0.82 -0.19 4.60 2.07 0.51 0.35 116.25 123.79 1uk5 h VAL 91 Ca -0.00 -0.19 -0.10 0.00 0.82 0.00 0.00 66.70 67.23 1uk5 h VAL 91 Cb 0.59 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1uk5 h VAL 91 CO 0.00 0.10 -0.32 -0.09 0.02 0.00 0.00 177.57 177.28 1uk5 h ARG 92 N 0.55 0.39 0.01 1.57 2.43 0.68 -2.10 114.38 117.91 1uk5 h ARG 92 Ca 0.40 -0.16 -0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1uk5 h ARG 92 Cb 0.77 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1uk5 h ARG 92 CO -0.16 0.67 -0.01 -0.22 -1.51 0.00 0.00 179.97 178.75 1uk5 h LYS 93 N 0.34 -0.02 -0.22 0.20 1.63 0.12 -1.87 116.57 116.74 1uk5 h LYS 93 Ca 0.04 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.88 1uk5 h LYS 93 Cb 0.73 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.34 1uk5 h LYS 93 CO 0.06 0.07 0.03 0.28 -3.45 0.00 0.00 179.45 176.44 1uk5 h VAL 94 N -0.10 0.89 -0.41 2.00 2.07 -1.25 -2.18 116.25 117.27 1uk5 h VAL 94 Ca -0.00 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.54 1uk5 h VAL 94 Cb 0.10 0.76 -0.09 0.00 -1.52 0.00 0.00 31.29 30.54 1uk5 h VAL 94 CO 0.00 0.02 -0.47 1.56 0.02 0.00 0.00 177.57 178.71 1uk5 h GLN 95 N 0.12 -0.34 -0.62 1.57 4.20 -1.13 0.28 115.11 119.18 1uk5 h GLN 95 Ca 0.10 0.02 0.13 0.00 0.06 0.00 0.00 58.65 58.97 1uk5 h GLN 95 Cb 0.11 0.08 -0.11 0.00 0.30 0.00 0.00 27.48 27.85 1uk5 h GLN 95 CO -0.14 -0.23 -0.03 1.15 -0.67 0.00 0.00 178.83 178.91 1uk5 h THR 96 N -0.35 0.46 -0.78 -0.54 2.02 -0.99 0.32 112.91 113.05 1uk5 h THR 96 Ca 0.12 -0.03 0.06 0.00 0.77 0.00 0.00 66.41 67.33 1uk5 h THR 96 Cb 0.59 0.36 -0.06 0.00 -1.74 0.00 0.00 68.15 67.31 1uk5 h THR 96 CO -0.58 0.02 0.47 0.40 0.37 0.00 0.00 175.52 176.19 1uk5 h ILE 97 N 0.09 1.02 -0.00 3.11 2.04 -0.34 0.25 117.51 123.69 1uk5 h ILE 97 Ca 0.32 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1uk5 h ILE 97 Cb 0.52 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1uk5 h ILE 97 CO -0.56 0.16 0.00 -0.07 0.00 0.00 0.00 178.15 177.68 1uk5 h LEU 98 N 0.87 0.00 -0.23 1.44 -0.00 0.29 0.76 115.31 118.43 1uk5 h LEU 98 Ca 0.34 0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 58.02 1uk5 h LEU 98 Cb 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.81 1uk5 h LEU 98 CO -0.17 0.00 -0.91 -0.08 -0.00 0.00 0.00 178.44 177.28 1uk5 h GLU 99 N 0.00 0.17 0.30 1.13 4.81 0.11 -3.19 114.58 117.90 1uk5 h GLU 99 Ca 0.00 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.02 1uk5 h GLU 99 Cb 0.00 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1uk5 h GLU 99 CO -0.00 0.96 -0.14 0.87 -0.73 0.00 0.00 179.01 179.97 1uk5 h LYS 100 N 0.09 -0.38 -0.91 1.92 1.57 0.23 -3.26 116.57 115.83 1uk5 h LYS 100 Ca -0.04 0.03 0.15 0.00 -1.87 0.00 0.00 60.65 58.91 1uk5 h LYS 100 Cb 1.56 0.09 -0.15 0.00 0.08 0.00 0.00 32.23 33.81 1uk5 h LYS 100 CO 0.14 -0.06 -0.34 -0.11 -0.57 0.00 0.00 179.45 178.51 1uk5 n LEU 101 N -5.06 -0.56 0.00 2.94 0.00 -0.19 0.21 117.00 114.34 1uk5 n LEU 101 Ca -0.08 1.58 0.00 0.00 0.00 0.00 0.00 56.01 57.51 1uk5 n LEU 101 Cb 0.25 -0.38 0.00 0.00 0.00 0.00 0.00 43.42 43.30 1uk5 n LEU 101 CO 0.24 -1.43 0.33 1.21 0.00 0.00 0.00 177.39 177.74 1uk5 n GLU 102 N -5.36 0.00 -0.33 1.96 2.13 -1.21 0.11 120.64 117.95 1uk5 n GLU 102 Ca 0.10 0.63 0.26 0.00 0.66 0.00 0.00 57.16 58.80 1uk5 n GLU 102 Cb 0.38 -1.17 0.56 0.00 0.27 0.00 0.00 31.44 31.48 1uk5 n GLU 102 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1uk5 h GLN 103 N 0.00 0.30 -0.09 5.31 4.20 -1.30 1.59 115.11 125.11 1uk5 h GLN 103 Ca 0.00 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 1uk5 h GLN 103 Cb 0.00 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 1uk5 h GLN 103 CO 0.00 0.20 -0.08 0.87 -0.67 0.00 0.00 178.83 179.14 1uk5 h LYS 104 N 0.30 0.13 -0.74 1.46 1.79 0.30 -0.78 116.57 119.03 1uk5 h LYS 104 Ca 0.60 -0.02 -0.40 0.00 -2.18 0.00 0.00 60.65 58.65 1uk5 h LYS 104 Cb 1.69 -0.02 -0.23 0.00 -1.58 0.00 0.00 32.23 32.09 1uk5 h LYS 104 CO -0.25 0.23 0.34 0.00 -1.08 0.00 0.00 179.45 178.69 1uk5 n ALA 105 N -2.50 5.16 -1.44 3.86 0.00 0.53 -4.13 120.51 121.99 1uk5 n ALA 105 Ca -0.01 -3.07 0.00 0.00 0.00 0.00 0.00 53.44 50.35 1uk5 n ALA 105 Cb 0.20 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.11 0.00 0.00 0.00 2.88 -0.33 -1.88 113.62 113.18 1uk5 n SER 106 Ca 0.49 -1.31 0.00 0.00 -1.33 0.00 0.00 58.87 56.72 1uk5 n SER 106 Cb 1.33 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 64.73 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 0.00 3.25 3.48 0.46 0.00 -1.01 -4.97 105.19 106.40 1uk5 n GLY 107 Ca 0.00 -1.83 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 1uk5 n GLY 107 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uk5 n PRO 108 N 0.00 2.38 -0.49 1.61 -0.04 -1.26 -4.95 135.00 132.24 1uk5 n PRO 108 Ca 0.00 -2.78 -0.29 0.00 -0.04 0.00 0.00 63.50 60.40 1uk5 n PRO 108 Cb 0.00 -3.53 0.25 0.00 -0.04 0.00 0.00 33.50 30.18 1uk5 n PRO 108 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1uk5 n SER 109 N 10.62 -1.73 -4.11 3.54 3.41 -1.26 -4.83 113.62 119.27 1uk5 n SER 109 Ca 0.48 -0.15 -0.21 0.00 -0.26 0.00 0.00 58.87 58.72 1uk5 n SER 109 Cb 0.45 -1.25 -0.15 0.00 -0.26 0.00 0.00 64.21 63.01 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 -2.37 1.60 0.00 4.04 0.01 -1.26 -4.90 113.70 110.81 1uk5 s SER 110 Ca 0.68 -0.29 0.11 0.00 1.31 0.00 0.00 55.95 57.76 1uk5 s SER 110 Cb -0.25 -0.16 0.66 0.00 0.21 0.00 0.00 66.02 66.48 1uk5 s SER 110 CO 0.65 0.14 1.09 0.61 0.41 0.00 0.00 173.24 176.14