#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 -0.91 -0.12 1.61 0.15 -1.26 -5.12 113.70 108.05 1uk5 s SER 2 Ca 0.00 1.42 -0.33 0.00 0.70 0.00 0.00 55.95 57.74 1uk5 s SER 2 Cb 0.00 1.50 0.13 0.00 -1.71 0.00 0.00 66.02 65.94 1uk5 s SER 2 CO 0.00 -0.22 1.11 -0.55 1.20 0.00 0.00 173.24 174.78 1uk5 s SER 3 N 1.80 -0.20 0.00 5.45 0.15 -1.26 -4.97 113.70 114.66 1uk5 s SER 3 Ca -0.09 -0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.54 1uk5 s SER 3 Cb -0.06 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 1uk5 s SER 3 CO -0.19 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.49 1uk5 n GLY 4 N -0.16 2.63 0.27 9.45 0.00 -1.26 -5.01 105.19 111.10 1uk5 n GLY 4 Ca -0.03 -0.33 -0.08 0.00 0.00 0.00 0.00 46.02 45.58 1uk5 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1uk5 h SER 5 N 0.02 -1.24 -2.10 1.61 0.02 -2.07 -3.46 113.55 106.32 1uk5 h SER 5 Ca 0.00 0.18 0.24 0.00 -0.84 0.00 0.00 61.79 61.36 1uk5 h SER 5 Cb 0.00 0.53 -0.07 0.00 0.14 0.00 0.00 62.40 63.00 1uk5 h SER 5 CO 0.00 -0.19 -0.38 -1.54 -1.14 0.00 0.00 176.83 173.58 1uk5 n SER 6 N -4.36 -5.27 -3.54 3.07 3.41 -1.26 -5.03 113.62 100.63 1uk5 n SER 6 Ca -0.00 0.42 -0.01 0.00 -0.26 0.00 0.00 58.87 59.02 1uk5 n SER 6 Cb 0.18 -3.03 0.01 0.00 -0.26 0.00 0.00 64.21 61.12 1uk5 n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1uk5 s GLY 7 N -4.97 -0.01 0.43 5.00 0.00 -1.26 -5.10 107.32 101.42 1uk5 s GLY 7 Ca 0.00 -0.14 0.05 0.00 0.00 0.00 0.00 44.72 44.63 1uk5 s GLY 7 CO 0.00 3.33 0.61 0.00 0.00 0.00 0.00 173.10 177.03 1uk5 s ALA 8 N -2.16 4.22 0.56 3.20 0.00 -1.26 -5.09 121.76 121.23 1uk5 s ALA 8 Ca 0.24 -1.47 -0.17 0.00 0.00 0.00 0.00 51.96 50.56 1uk5 s ALA 8 Cb -0.01 -1.81 -0.05 0.00 0.00 0.00 0.00 23.12 21.25 1uk5 s ALA 8 CO 0.03 -0.34 1.05 -1.25 0.00 0.00 0.00 175.76 175.24 1uk5 s PRO 9 N -4.43 3.48 0.02 0.00 0.04 -1.26 -5.05 135.00 127.81 1uk5 s PRO 9 Ca 0.52 1.21 -0.29 0.00 0.04 0.00 0.00 61.00 62.48 1uk5 s PRO 9 Cb -0.10 -2.06 0.10 0.00 0.04 0.00 0.00 34.50 32.49 1uk5 s PRO 9 CO 0.34 -0.68 1.23 0.00 0.04 0.00 0.00 177.00 177.93 1uk5 s ALA 10 N -2.38 -2.16 0.46 8.56 0.00 -1.26 -5.16 121.76 119.81 1uk5 s ALA 10 Ca 0.64 0.39 -0.22 0.00 0.00 0.00 0.00 51.96 52.77 1uk5 s ALA 10 Cb -0.15 0.54 -0.08 0.00 0.00 0.00 0.00 23.12 23.43 1uk5 s ALA 10 CO 0.33 -1.08 1.07 -1.21 0.00 0.00 0.00 175.76 174.88 1uk5 s GLU 11 N -2.41 3.88 1.08 0.00 8.01 -1.26 -5.04 118.70 122.96 1uk5 s GLU 11 Ca 0.18 1.51 -0.18 0.00 0.01 0.00 0.00 54.97 56.48 1uk5 s GLU 11 Cb 0.02 -2.30 0.26 0.00 -4.31 0.00 0.00 34.13 27.80 1uk5 s GLU 11 CO -0.02 -0.38 1.19 -0.35 0.01 0.00 0.00 175.26 175.71 1uk5 n PRO 12 N -0.59 -2.18 0.00 0.39 -0.04 -1.26 -5.09 135.00 126.23 1uk5 n PRO 12 Ca 0.08 -1.87 0.00 0.00 -0.04 0.00 0.00 63.50 61.66 1uk5 n PRO 12 Cb 0.51 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 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 -4.33 0.00 -3.58 0.55 0.00 -1.26 -5.19 120.51 106.70 1uk5 n ALA 13 Ca -0.21 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.16 1uk5 n ALA 13 Cb 0.57 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 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 -2.00 -1.97 1.11 0.00 0.00 -1.26 -5.01 121.76 112.63 1uk5 s ALA 14 Ca 0.00 1.55 -0.16 0.00 0.00 0.00 0.00 51.96 53.34 1uk5 s ALA 14 Cb 0.00 -0.56 0.23 0.00 0.00 0.00 0.00 23.12 22.79 1uk5 s ALA 14 CO 0.00 -0.41 1.07 -0.35 0.00 0.00 0.00 175.76 176.07 1uk5 n PRO 15 N 0.40 -2.00 -3.59 0.00 -0.04 -1.26 -5.07 135.00 123.45 1uk5 n PRO 15 Ca -0.07 -1.67 -0.28 0.00 -0.04 0.00 0.00 63.50 61.44 1uk5 n PRO 15 Cb 0.59 -1.32 -0.16 0.00 -0.04 0.00 0.00 33.50 32.57 1uk5 n PRO 15 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1uk5 s LYS 16 N -5.37 0.22 0.02 0.54 2.20 -1.26 -5.11 119.74 110.98 1uk5 s LYS 16 Ca 0.64 -0.43 -0.29 0.00 -0.36 0.00 0.00 55.97 55.53 1uk5 s LYS 16 Cb -0.04 -1.48 0.11 0.00 -1.51 0.00 0.00 37.83 34.90 1uk5 s LYS 16 CO 0.47 -0.89 1.22 -1.54 -0.36 0.00 0.00 175.35 174.25 1uk5 s SER 17 N 2.06 -0.06 -0.45 1.43 1.04 -1.26 -5.09 113.70 111.37 1uk5 s SER 17 Ca 0.06 -0.22 0.07 0.00 0.48 0.00 0.00 55.95 56.33 1uk5 s SER 17 Cb -0.16 0.23 0.33 0.00 0.10 0.00 0.00 66.02 66.51 1uk5 s SER 17 CO -0.26 -0.43 1.11 0.61 0.98 0.00 0.00 173.24 175.25 1uk5 n GLY 18 N -0.57 0.82 1.50 7.32 0.00 -1.26 -5.13 105.19 107.86 1uk5 n GLY 18 Ca -0.06 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 45.97 1uk5 n GLY 18 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uk5 n GLU 19 N 0.30 -3.57 -3.65 1.61 4.71 -1.26 -5.06 120.64 113.72 1uk5 n GLU 19 Ca 0.07 2.86 -0.02 0.00 -0.01 0.00 0.00 57.16 60.05 1uk5 n GLU 19 Cb 0.71 -3.88 -0.05 0.00 -1.01 0.00 0.00 31.44 27.20 1uk5 n GLU 19 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1uk5 s ALA 20 N -4.80 -2.17 0.41 0.62 0.00 -1.26 -5.15 121.76 109.41 1uk5 s ALA 20 Ca 0.00 1.79 -0.22 0.00 0.00 0.00 0.00 51.96 53.53 1uk5 s ALA 20 Cb 0.00 -1.65 -0.14 0.00 0.00 0.00 0.00 23.12 21.33 1uk5 s ALA 20 CO 0.00 -0.17 0.36 0.39 0.00 0.00 0.00 175.76 176.34 1uk5 n GLU 21 N 1.00 0.31 -3.53 0.00 1.02 -1.26 -4.99 120.64 113.19 1uk5 n GLU 21 Ca -0.05 0.11 -0.17 0.00 -0.02 0.00 0.00 57.16 57.04 1uk5 n GLU 21 Cb 0.58 -1.28 -0.06 0.00 -0.02 0.00 0.00 31.44 30.66 1uk5 n GLU 21 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1uk5 s THR 22 N -1.54 0.00 0.89 2.62 -1.32 -1.26 -5.18 115.64 109.86 1uk5 s THR 22 Ca 0.62 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.98 1uk5 s THR 22 Cb -0.63 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 69.49 1uk5 s THR 22 CO 0.60 0.00 1.13 -2.16 -2.21 0.00 0.00 174.62 171.98 1uk5 s PRO 23 N -1.13 1.30 -0.04 7.08 0.04 -1.26 -4.99 135.00 136.00 1uk5 s PRO 23 Ca -0.10 0.35 -0.30 0.00 0.04 0.00 0.00 61.00 60.99 1uk5 s PRO 23 Cb -0.00 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.65 1uk5 s PRO 23 CO 0.09 -2.10 1.21 -1.25 0.04 0.00 0.00 177.00 174.99 1uk5 s PRO 24 N -5.26 4.36 0.00 0.56 0.04 -1.26 -4.98 135.00 128.46 1uk5 s PRO 24 Ca 0.63 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.38 1uk5 s PRO 24 Cb -0.15 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.86 1uk5 s PRO 24 CO 0.53 -0.43 0.00 0.36 0.04 0.00 0.00 177.00 177.50 1uk5 n LYS 25 N 5.05 0.73 -3.65 4.56 2.85 -1.26 -5.12 118.16 121.32 1uk5 n LYS 25 Ca 0.11 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 57.00 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 4.00 3.63 0.14 5.58 5.65 -1.26 -4.99 115.29 128.04 1uk5 s HIS 26 Ca 0.00 0.74 -0.04 0.00 0.25 0.00 0.00 55.06 56.02 1uk5 s HIS 26 Cb 0.00 -2.17 -0.05 0.00 -1.18 0.00 0.00 32.58 29.18 1uk5 s HIS 26 CO 0.00 0.60 1.35 -1.00 -0.65 0.00 0.00 174.74 175.04 1uk5 h PRO 27 N 5.19 0.43 -0.84 2.88 0.13 -1.99 -2.51 132.00 135.28 1uk5 h PRO 27 Ca -0.51 -0.42 0.19 0.00 -0.87 0.00 0.00 66.00 64.40 1uk5 h PRO 27 Cb 1.21 0.11 -0.06 0.00 0.13 0.00 0.00 31.00 32.39 1uk5 h PRO 27 CO 0.63 1.07 0.57 0.78 -0.23 0.00 0.00 178.00 180.82 1uk5 h GLY 28 N 1.22 0.68 0.00 1.56 0.00 -1.94 0.32 103.07 104.91 1uk5 h GLY 28 Ca -0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 1uk5 h GLY 28 CO 0.15 0.01 -0.26 -2.08 0.00 0.00 0.00 176.54 174.36 1uk5 h VAL 29 N 0.34 0.35 -1.21 4.60 2.07 -1.86 -3.33 116.25 117.21 1uk5 h VAL 29 Ca 0.43 -1.31 0.38 0.00 0.82 0.00 0.00 66.70 67.02 1uk5 h VAL 29 Cb 1.15 0.71 -0.13 0.00 -1.52 0.00 0.00 31.29 31.51 1uk5 h VAL 29 CO -0.13 0.12 0.76 -0.07 0.02 0.00 0.00 177.57 178.27 1uk5 h LEU 30 N -1.00 0.32 -1.70 2.57 3.38 -1.03 1.66 115.31 119.52 1uk5 h LEU 30 Ca -0.03 0.14 0.36 0.00 0.09 0.00 0.00 57.88 58.43 1uk5 h LEU 30 Cb 0.41 0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.19 1uk5 h LEU 30 CO -0.02 -0.13 0.85 0.50 0.09 0.00 0.00 178.44 179.73 1uk5 h LYS 31 N 0.17 0.13 0.04 1.13 3.64 -0.49 1.44 116.57 122.64 1uk5 h LYS 31 Ca 0.76 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 59.90 1uk5 h LYS 31 Cb 2.22 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.99 1uk5 h LYS 31 CO -0.43 0.09 -1.24 -0.39 -2.27 0.00 0.00 179.45 175.21 1uk5 h VAL 32 N 0.14 1.01 -0.55 2.00 -1.51 0.23 -3.32 116.25 114.25 1uk5 h VAL 32 Ca 0.65 -2.27 0.13 0.00 -1.23 0.00 0.00 66.70 63.98 1uk5 h VAL 32 Cb 2.22 2.51 -0.03 0.00 -2.13 0.00 0.00 31.29 33.85 1uk5 h VAL 32 CO -0.17 0.51 0.38 -0.33 -1.23 0.00 0.00 177.57 176.73 1uk5 h GLU 33 N -0.71 0.16 -0.71 5.19 5.08 -0.20 0.78 114.58 124.17 1uk5 h GLU 33 Ca -0.31 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 57.98 1uk5 h GLU 33 Cb 1.46 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.65 1uk5 h GLU 33 CO -0.09 0.10 0.21 0.00 -1.00 0.00 0.00 179.01 178.23 1uk5 h ALA 34 N 1.73 0.93 0.04 3.43 0.00 0.17 -1.06 119.26 124.50 1uk5 h ALA 34 Ca 0.26 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1uk5 h ALA 34 Cb 0.82 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1uk5 h ALA 34 CO -0.04 0.62 -0.30 0.82 0.00 0.00 0.00 179.25 180.36 1uk5 h ILE 35 N 1.05 1.64 -0.91 0.00 2.04 -0.77 -3.22 117.51 117.34 1uk5 h ILE 35 Ca 0.23 -2.27 0.24 0.00 1.00 0.00 0.00 64.86 64.06 1uk5 h ILE 35 Cb 0.33 3.15 -0.14 0.00 -0.74 0.00 0.00 36.82 39.42 1uk5 h ILE 35 CO -0.00 0.61 0.37 -0.07 0.00 0.00 0.00 178.15 179.06 1uk5 h LEU 36 N -0.67 0.24 -0.11 1.44 3.38 0.49 0.41 115.31 120.49 1uk5 h LEU 36 Ca -0.05 0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1uk5 h LEU 36 Cb 1.17 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1uk5 h LEU 36 CO 0.06 -0.08 -0.07 -0.33 0.09 0.00 0.00 178.44 178.11 1uk5 h GLU 37 N 0.31 -0.06 -0.55 1.13 5.08 -1.25 -1.56 114.58 117.68 1uk5 h GLU 37 Ca 0.59 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.96 1uk5 h GLU 37 Cb 1.19 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 1uk5 h GLU 37 CO -0.59 -0.04 0.36 0.87 -1.00 0.00 0.00 179.01 178.60 1uk5 h LYS 38 N -0.07 0.71 -0.67 2.33 1.57 -0.38 -2.16 116.57 117.90 1uk5 h LYS 38 Ca 0.07 -0.04 0.14 0.00 -1.87 0.00 0.00 60.65 58.95 1uk5 h LYS 38 Cb 0.16 -0.16 -0.12 0.00 0.08 0.00 0.00 32.23 32.20 1uk5 h LYS 38 CO -0.15 0.47 -0.02 0.28 -0.57 0.00 0.00 179.45 179.45 1uk5 h VAL 39 N 0.73 0.42 -0.98 0.50 2.07 0.10 0.78 116.25 119.87 1uk5 h VAL 39 Ca 0.20 -0.03 0.19 0.00 0.82 0.00 0.00 66.70 67.88 1uk5 h VAL 39 Cb -0.07 0.32 -0.18 0.00 -1.52 0.00 0.00 31.29 29.84 1uk5 h VAL 39 CO -0.05 0.02 -0.27 0.00 0.02 0.00 0.00 177.57 177.29 1uk5 n GLN 40 N -5.33 -0.11 -0.25 1.57 6.02 -0.65 0.15 117.38 118.79 1uk5 n GLN 40 Ca 0.10 1.53 -0.00 0.00 -0.01 0.00 0.00 57.00 58.62 1uk5 n GLN 40 Cb 0.39 -2.28 0.12 0.00 1.02 0.00 0.00 30.24 29.49 1uk5 n GLN 40 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1uk5 h GLY 41 N 0.00 1.06 2.00 1.08 0.00 -0.90 0.55 103.07 106.86 1uk5 h GLY 41 Ca 0.45 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.44 1uk5 h GLY 41 CO -1.01 0.14 -0.36 1.41 0.00 0.00 0.00 176.54 176.72 1uk5 h LEU 42 N 0.70 0.00 -0.24 3.11 3.38 0.16 -2.14 115.31 120.28 1uk5 h LEU 42 Ca 0.33 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.15 1uk5 h LEU 42 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1uk5 h LEU 42 CO -0.21 0.36 -0.71 -0.08 0.09 0.00 0.00 178.44 177.89 1uk5 h GLU 43 N 0.00 0.00 -0.21 1.13 4.57 0.22 -3.12 114.58 117.17 1uk5 h GLU 43 Ca -0.00 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.11 1uk5 h GLU 43 Cb 0.65 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 1uk5 h GLU 43 CO 0.05 0.71 -0.18 1.96 -1.18 0.00 0.00 179.01 180.37 1uk5 h GLN 44 N 0.00 0.36 -0.25 1.92 1.08 0.66 -0.48 115.11 118.40 1uk5 h GLN 44 Ca -0.01 -0.11 -0.18 0.00 -1.45 0.00 0.00 58.65 56.91 1uk5 h GLN 44 Cb 1.44 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.83 1uk5 h GLN 44 CO 0.09 0.53 -0.54 0.00 -0.95 0.00 0.00 178.83 177.96 1uk5 h ALA 45 N 1.49 0.57 -0.51 3.87 0.00 -1.47 -2.64 119.26 120.56 1uk5 h ALA 45 Ca 0.06 -0.51 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 1uk5 h ALA 45 Cb 0.51 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1uk5 h ALA 45 CO 0.03 0.68 0.04 0.28 0.00 0.00 0.00 179.25 180.28 1uk5 h VAL 46 N 0.57 1.26 0.00 0.00 2.07 -1.38 1.27 116.25 120.04 1uk5 h VAL 46 Ca 0.01 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 1uk5 h VAL 46 Cb 1.13 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1uk5 h VAL 46 CO 0.11 0.36 -0.01 -0.78 0.02 0.00 0.00 177.57 177.28 1uk5 h ASP 47 N 0.75 0.00 -1.23 0.57 3.58 -1.00 -2.99 116.42 116.10 1uk5 h ASP 47 Ca 0.15 0.00 -0.39 0.00 0.42 0.00 0.00 57.03 57.21 1uk5 h ASP 47 Cb 0.47 0.00 -0.36 0.00 1.72 0.00 0.00 39.33 41.16 1uk5 h ASP 47 CO 0.02 0.01 -1.07 -0.24 -2.88 0.00 0.00 179.24 175.08 1uk5 n SER 48 N -3.19 0.64 -4.91 2.28 2.88 -0.58 -5.09 113.62 105.65 1uk5 n SER 48 Ca -0.02 -2.88 -0.21 0.00 -1.33 0.00 0.00 58.87 54.43 1uk5 n SER 48 Cb 0.13 -0.25 -0.03 0.00 -0.75 0.00 0.00 64.21 63.31 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 -2.32 3.29 -0.11 0.66 5.36 0.43 -4.81 117.98 120.48 1uk5 s PHE 49 Ca 0.31 -0.07 -0.02 0.00 -0.96 0.00 0.00 56.93 56.19 1uk5 s PHE 49 Cb 0.40 -1.52 0.04 0.00 -0.34 0.00 0.00 43.02 41.60 1uk5 s PHE 49 CO -0.02 0.46 0.03 -1.21 -1.46 0.00 0.00 175.22 173.01 1uk5 s GLU 50 N -3.93 0.43 0.00 10.12 2.02 -1.26 -4.99 118.70 121.09 1uk5 s GLU 50 Ca 0.34 0.01 0.00 0.00 0.02 0.00 0.00 54.97 55.34 1uk5 s GLU 50 Cb -0.08 -1.26 0.00 0.00 0.10 0.00 0.00 34.13 32.89 1uk5 s GLU 50 CO 0.27 -0.43 0.00 0.41 0.02 0.00 0.00 175.26 175.53 1uk5 n GLY 51 N 5.17 -0.63 0.00 -1.39 0.00 -1.26 -4.81 105.19 102.26 1uk5 n GLY 51 Ca -0.07 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.27 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 -1.47 2.01 -0.05 1.61 4.01 -1.26 -4.27 118.16 118.73 1uk5 n LYS 52 Ca 0.00 0.00 0.05 0.00 -0.51 0.00 0.00 58.31 57.85 1uk5 n LYS 52 Cb 0.00 0.00 0.23 0.00 -0.51 0.00 0.00 35.03 34.75 1uk5 n LYS 52 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1uk5 n LYS 53 N -0.38 1.30 -0.02 1.97 5.02 -1.26 -3.31 118.16 121.48 1uk5 n LYS 53 Ca 0.00 -0.46 -0.03 0.00 -2.02 0.00 0.00 58.31 55.81 1uk5 n LYS 53 Cb 0.00 -1.20 -0.03 0.00 -0.02 0.00 0.00 35.03 33.78 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 -0.21 0.31 -1.31 -0.18 5.66 -1.26 -4.92 114.28 112.37 1uk5 n THR 54 Ca 0.09 -0.18 -0.36 0.00 -3.05 0.00 0.00 64.05 60.55 1uk5 n THR 54 Cb 0.13 -0.84 0.07 0.00 -1.55 0.00 0.00 70.33 68.14 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 -2.27 -0.85 -0.02 1.09 8.00 -1.21 -4.86 116.55 116.44 1uk5 n ASP 55 Ca -0.08 0.63 -0.13 0.00 0.71 0.00 0.00 54.79 55.92 1uk5 n ASP 55 Cb 0.64 -1.25 -0.09 0.00 -0.02 0.00 0.00 41.12 40.40 1uk5 n ASP 55 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1uk5 h LYS 56 N -0.26 0.06 -0.88 -1.24 1.63 -1.96 -2.88 116.57 111.04 1uk5 h LYS 56 Ca -0.46 -0.02 0.23 0.00 -0.85 0.00 0.00 60.65 59.54 1uk5 h LYS 56 Cb 1.35 -0.00 -0.15 0.00 -0.60 0.00 0.00 32.23 32.83 1uk5 h LYS 56 CO 0.44 0.47 0.08 -0.22 -3.45 0.00 0.00 179.45 176.77 1uk5 h LYS 57 N -0.36 0.09 -0.81 1.90 3.64 -1.91 1.00 116.57 120.13 1uk5 h LYS 57 Ca 0.01 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 1uk5 h LYS 57 Cb 0.45 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 1uk5 h LYS 57 CO 0.00 0.06 0.53 -0.92 -2.27 0.00 0.00 179.45 176.85 1uk5 h TYR 58 N 0.10 0.99 -0.75 1.91 5.03 -1.77 -1.60 116.97 120.88 1uk5 h TYR 58 Ca 0.52 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.81 1uk5 h TYR 58 Cb 1.03 -0.33 -0.03 0.00 1.55 0.00 0.00 36.73 38.95 1uk5 h TYR 58 CO -0.41 0.60 0.27 -0.07 -1.32 0.00 0.00 178.16 177.24 1uk5 h LEU 59 N 1.05 1.06 -0.03 2.82 3.38 0.11 -0.13 115.31 123.58 1uk5 h LEU 59 Ca 0.31 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1uk5 h LEU 59 Cb -0.07 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 1uk5 h LEU 59 CO -0.09 0.96 -0.08 0.24 0.09 0.00 0.00 178.44 179.57 1uk5 h MET 60 N 1.11 -0.12 -0.68 1.13 2.86 0.27 0.52 114.93 120.02 1uk5 h MET 60 Ca 0.25 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.85 1uk5 h MET 60 Cb 0.25 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1uk5 h MET 60 CO -0.02 -0.08 0.23 0.82 1.06 0.00 0.00 176.91 178.93 1uk5 h ILE 61 N -0.12 1.24 0.67 -1.22 2.04 -1.11 0.28 117.51 119.29 1uk5 h ILE 61 Ca 0.04 -0.81 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 1uk5 h ILE 61 Cb 0.18 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1uk5 h ILE 61 CO -0.10 0.32 -0.50 -0.08 0.00 0.00 0.00 178.15 177.79 1uk5 h GLU 62 N 0.99 -1.09 -0.48 2.37 4.22 -0.33 0.37 114.58 120.64 1uk5 h GLU 62 Ca 0.22 0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.73 1uk5 h GLU 62 Cb 0.25 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1uk5 h GLU 62 CO -0.01 -0.72 0.27 1.05 -2.18 0.00 0.00 179.01 177.41 1uk5 h GLU 63 N -1.13 0.67 -0.69 1.92 4.11 -0.81 -2.04 114.58 116.62 1uk5 h GLU 63 Ca -0.09 -0.07 0.10 0.00 0.07 0.00 0.00 59.36 59.36 1uk5 h GLU 63 Cb 0.93 -0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.98 1uk5 h GLU 63 CO 0.03 0.52 0.32 1.88 0.07 0.00 0.00 179.01 181.83 1uk5 h TYR 64 N 0.63 0.56 0.57 2.06 0.05 -0.24 0.48 116.97 121.09 1uk5 h TYR 64 Ca 0.17 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.95 1uk5 h TYR 64 Cb 0.04 -0.15 0.01 0.00 1.01 0.00 0.00 36.73 37.64 1uk5 h TYR 64 CO -0.02 0.18 -0.27 -0.07 -1.05 0.00 0.00 178.16 176.93 1uk5 h LEU 65 N 0.53 -0.64 -0.81 3.88 3.38 0.15 -2.92 115.31 118.87 1uk5 h LEU 65 Ca 0.34 0.02 0.19 0.00 0.09 0.00 0.00 57.88 58.52 1uk5 h LEU 65 Cb 0.39 0.17 -0.12 0.00 0.09 0.00 0.00 40.66 41.19 1uk5 h LEU 65 CO -0.29 -0.46 0.26 0.74 0.09 0.00 0.00 178.44 178.78 1uk5 h THR 66 N -0.76 0.48 -1.00 0.22 2.02 -1.12 0.27 112.91 113.02 1uk5 h THR 66 Ca -0.08 -0.11 0.35 0.00 0.77 0.00 0.00 66.41 67.35 1uk5 h THR 66 Cb 0.58 0.13 -0.18 0.00 -1.74 0.00 0.00 68.15 66.95 1uk5 h THR 66 CO 0.13 0.06 0.32 0.11 0.37 0.00 0.00 175.52 176.51 1uk5 h LYS 67 N 0.32 0.02 -0.25 6.66 1.57 0.15 1.53 116.57 126.56 1uk5 h LYS 67 Ca 0.48 -0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.17 1uk5 h LYS 67 Cb 0.87 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 1uk5 h LYS 67 CO -0.53 0.01 -0.20 0.93 -0.57 0.00 0.00 179.45 179.09 1uk5 h GLU 68 N 0.02 0.58 -0.62 3.15 4.39 -0.38 -3.12 114.58 118.59 1uk5 h GLU 68 Ca 0.74 -0.29 0.13 0.00 0.34 0.00 0.00 59.36 60.28 1uk5 h GLU 68 Cb 1.80 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 30.34 1uk5 h GLU 68 CO -0.83 0.87 -0.09 -0.07 -1.16 0.00 0.00 179.01 177.73 1uk5 h LEU 69 N 0.29 -0.46 -1.70 1.33 3.38 0.23 2.13 115.31 120.51 1uk5 h LEU 69 Ca 0.05 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1uk5 h LEU 69 Cb 0.74 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1uk5 h LEU 69 CO 0.05 -0.18 0.16 -0.07 0.09 0.00 0.00 178.44 178.50 1uk5 h LEU 70 N 0.04 0.00 0.00 1.67 -0.00 -1.08 1.40 115.31 117.34 1uk5 h LEU 70 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.19 1uk5 h LEU 70 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.16 1uk5 h LEU 70 CO -0.60 0.00 -0.21 0.00 -0.00 0.00 0.00 178.44 177.62 1uk5 h ALA 71 N 1.63 0.89 0.20 1.53 0.00 0.35 -2.98 119.26 120.87 1uk5 h ALA 71 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1uk5 h ALA 71 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1uk5 h ALA 71 CO 0.00 0.00 -0.10 -0.07 0.00 0.00 0.00 179.25 179.08 1uk5 h LEU 72 N 0.00 -0.23 -0.73 0.00 -0.00 0.22 -3.30 115.31 111.27 1uk5 h LEU 72 Ca 0.00 0.01 0.14 0.00 -0.00 0.00 0.00 57.88 58.03 1uk5 h LEU 72 Cb 0.94 0.06 -0.10 0.00 -0.00 0.00 0.00 40.66 41.56 1uk5 h LEU 72 CO 0.00 0.16 0.25 -0.78 -0.00 0.00 0.00 178.44 178.07 1uk5 h ASP 73 N -0.91 0.18 -1.22 -0.43 3.58 -1.66 0.50 116.42 116.47 1uk5 h ASP 73 Ca -0.03 0.12 0.35 0.00 0.42 0.00 0.00 57.03 57.90 1uk5 h ASP 73 Cb 0.20 0.12 -0.05 0.00 1.72 0.00 0.00 39.33 41.33 1uk5 h ASP 73 CO 0.04 0.06 1.10 0.77 -2.88 0.00 0.00 179.24 178.33 1uk5 h SER 74 N 0.38 0.00 -3.29 2.28 4.64 -1.62 -3.38 113.55 112.56 1uk5 h SER 74 Ca 0.41 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.20 1uk5 h SER 74 Cb 0.64 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.74 1uk5 h SER 74 CO -0.43 0.00 0.57 -0.69 -0.87 0.00 0.00 176.83 175.41 1uk5 s VAL 75 N -4.66 3.80 -0.43 0.95 1.01 0.17 -5.00 120.40 116.24 1uk5 s VAL 75 Ca -0.04 1.37 -0.07 0.00 0.00 0.00 0.00 61.98 63.24 1uk5 s VAL 75 Cb 0.19 -3.88 0.10 0.00 0.00 0.00 0.00 36.38 32.79 1uk5 s VAL 75 CO 0.65 0.15 0.27 -1.81 0.00 0.00 0.00 175.10 174.36 1uk5 s ASP 76 N 0.69 5.55 0.39 3.32 1.01 -1.26 -4.92 116.67 121.44 1uk5 s ASP 76 Ca 0.57 -1.76 0.21 0.00 0.71 0.00 0.00 52.55 52.27 1uk5 s ASP 76 Cb -0.31 -1.95 0.58 0.00 1.01 0.00 0.00 42.92 42.25 1uk5 s ASP 76 CO 0.32 -0.59 1.68 1.55 0.21 0.00 0.00 175.17 178.35 1uk5 h PRO 77 N 8.33 0.00 0.00 8.23 0.13 -1.92 -3.47 132.00 143.30 1uk5 h PRO 77 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1uk5 h PRO 77 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1uk5 h PRO 77 CO 0.77 0.30 0.00 0.39 -0.23 0.00 0.00 178.00 179.23 1uk5 n GLU 78 N -3.32 0.00 -1.35 0.86 1.02 -1.26 -2.51 120.64 114.09 1uk5 n GLU 78 Ca 0.01 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.14 1uk5 n GLU 78 Cb 0.54 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.97 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 -0.42 3.70 0.62 0.00 -1.26 -5.15 105.19 102.68 1uk5 n GLY 79 Ca 0.00 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 2.64 -0.18 1.61 0.52 -1.04 -5.04 118.95 117.48 1uk5 s ARG 80 Ca 0.01 -0.78 -0.22 0.00 -0.52 0.00 0.00 55.73 54.21 1uk5 s ARG 80 Cb 0.05 -2.59 -0.22 0.00 0.52 0.00 0.00 34.95 32.71 1uk5 s ARG 80 CO -0.02 0.55 0.41 0.00 0.02 0.00 0.00 175.30 176.26 1uk5 h ALA 81 N 3.51 0.19 -0.72 2.13 0.00 -1.97 -1.03 119.26 121.37 1uk5 h ALA 81 Ca -0.48 -1.02 0.21 0.00 0.00 0.00 0.00 54.91 53.63 1uk5 h ALA 81 Cb 1.17 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 19.44 1uk5 h ALA 81 CO 0.61 0.55 0.62 -0.44 0.00 0.00 0.00 179.25 180.59 1uk5 h ASP 82 N -0.88 0.00 0.00 0.00 3.32 -1.99 0.36 116.42 117.22 1uk5 h ASP 82 Ca -0.26 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.66 1uk5 h ASP 82 Cb 1.30 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.83 1uk5 h ASP 82 CO -0.11 0.00 -0.99 0.52 -1.72 0.00 0.00 179.24 176.94 1uk5 n VAL 83 N -3.95 1.48 -0.39 -1.35 0.31 -1.25 -3.11 118.33 110.07 1uk5 n VAL 83 Ca 0.15 0.07 0.32 0.00 -0.01 0.00 0.00 64.34 64.86 1uk5 n VAL 83 Cb 0.88 -2.19 0.61 0.00 -0.91 0.00 0.00 33.84 32.23 1uk5 n VAL 83 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1uk5 h ARG 84 N -1.00 0.19 0.31 5.55 3.08 -0.13 -0.04 114.38 122.33 1uk5 h ARG 84 Ca -0.21 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 59.82 1uk5 h ARG 84 Cb 0.97 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1uk5 h ARG 84 CO -0.12 0.12 -0.15 0.37 -1.07 0.00 0.00 179.97 179.12 1uk5 h GLN 85 N 0.19 -0.40 -0.96 0.04 4.15 -0.49 -2.88 115.11 114.77 1uk5 h GLN 85 Ca 0.71 0.03 0.27 0.00 0.77 0.00 0.00 58.65 60.42 1uk5 h GLN 85 Cb 2.17 0.09 -0.18 0.00 0.21 0.00 0.00 27.48 29.77 1uk5 h GLN 85 CO -0.30 -0.24 0.03 0.00 -1.93 0.00 0.00 178.83 176.39 1uk5 n ALA 86 N -2.74 0.50 -0.16 3.38 0.00 -0.18 0.12 120.51 121.44 1uk5 n ALA 86 Ca -0.05 1.02 0.00 0.00 0.00 0.00 0.00 53.44 54.41 1uk5 n ALA 86 Cb 0.18 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1uk5 n ALA 86 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1uk5 n ARG 87 N -5.42 0.00 -0.19 0.00 0.63 -0.31 0.19 116.66 111.56 1uk5 n ARG 87 Ca 0.23 0.48 -0.03 0.00 -0.92 0.00 0.00 57.85 57.61 1uk5 n ARG 87 Cb 0.75 -1.42 0.03 0.00 0.45 0.00 0.00 32.46 32.27 1uk5 n ARG 87 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1uk5 h ARG 88 N 0.00 -0.10 -0.96 -0.14 2.43 -0.88 0.79 114.38 115.52 1uk5 h ARG 88 Ca 0.00 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 1uk5 h ARG 88 Cb 0.00 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.51 1uk5 h ARG 88 CO 0.00 -0.06 0.62 0.22 -1.51 0.00 0.00 179.97 179.23 1uk5 h ASP 89 N -0.10 1.00 0.37 -3.80 1.82 1.00 0.11 116.42 116.81 1uk5 h ASP 89 Ca 0.26 0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.89 1uk5 h ASP 89 Cb 0.51 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.32 1uk5 h ASP 89 CO -0.65 0.65 -0.18 1.23 -1.61 0.00 0.00 179.24 178.68 1uk5 h GLY 90 N 1.14 -0.52 -0.48 -0.78 0.00 0.68 -2.27 103.07 100.84 1uk5 h GLY 90 Ca 0.41 0.19 0.21 0.00 0.00 0.00 0.00 47.33 48.14 1uk5 h GLY 90 CO -0.16 -0.19 0.10 -0.39 0.00 0.00 0.00 176.54 175.90 1uk5 h VAL 91 N -0.61 0.29 -0.15 4.60 -1.51 0.43 1.00 116.25 120.30 1uk5 h VAL 91 Ca -0.05 -0.05 0.04 0.00 -1.23 0.00 0.00 66.70 65.41 1uk5 h VAL 91 Cb 0.38 0.14 -0.07 0.00 -2.13 0.00 0.00 31.29 29.61 1uk5 h VAL 91 CO 0.08 0.02 -0.45 0.03 -1.23 0.00 0.00 177.57 176.03 1uk5 h ARG 92 N 0.14 -0.48 -0.89 5.19 2.47 -0.75 0.11 114.38 120.17 1uk5 h ARG 92 Ca 0.50 0.03 0.15 0.00 -1.26 0.00 0.00 59.98 59.40 1uk5 h ARG 92 Cb 0.95 0.11 -0.15 0.00 -1.65 0.00 0.00 29.97 29.23 1uk5 h ARG 92 CO -0.70 -0.32 -0.30 1.17 0.56 0.00 0.00 179.97 180.38 1uk5 n LYS 93 N -5.44 -0.16 0.20 0.04 3.00 0.33 0.85 118.16 116.99 1uk5 n LYS 93 Ca -0.04 1.38 -0.15 0.00 -0.00 0.00 0.00 58.31 59.50 1uk5 n LYS 93 Cb 0.37 -2.06 -0.08 0.00 0.00 0.00 0.00 35.03 33.26 1uk5 n LYS 93 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1uk5 h VAL 94 N 0.00 0.67 -0.92 3.15 2.07 -1.00 -2.52 116.25 117.69 1uk5 h VAL 94 Ca 0.36 -0.11 0.10 0.00 0.82 0.00 0.00 66.70 67.86 1uk5 h VAL 94 Cb 0.58 0.73 -0.12 0.00 -1.52 0.00 0.00 31.29 30.96 1uk5 h VAL 94 CO -0.90 0.02 -0.54 1.56 0.02 0.00 0.00 177.57 177.73 1uk5 h GLN 95 N -0.52 -0.05 -0.73 1.57 4.20 0.30 0.72 115.11 120.60 1uk5 h GLN 95 Ca -0.05 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.82 1uk5 h GLN 95 Cb 0.39 0.01 -0.11 0.00 0.30 0.00 0.00 27.48 28.08 1uk5 h GLN 95 CO 0.08 -0.03 0.19 1.15 -0.67 0.00 0.00 178.83 179.55 1uk5 h THR 96 N -0.05 0.55 -0.69 -0.54 2.02 -0.69 0.57 112.91 114.08 1uk5 h THR 96 Ca 0.19 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.28 1uk5 h THR 96 Cb 0.47 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 1uk5 h THR 96 CO -0.91 0.05 0.46 0.40 0.37 0.00 0.00 175.52 175.90 1uk5 h ILE 97 N 0.29 1.16 0.43 3.11 2.04 0.68 0.72 117.51 125.95 1uk5 h ILE 97 Ca 0.41 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 1uk5 h ILE 97 Cb 0.67 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1uk5 h ILE 97 CO -0.48 0.17 -0.21 -0.07 0.00 0.00 0.00 178.15 177.56 1uk5 h LEU 98 N 0.92 -0.49 -2.59 1.44 -0.00 0.37 -1.18 115.31 113.78 1uk5 h LEU 98 Ca 0.26 -0.10 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 1uk5 h LEU 98 Cb -0.08 0.13 0.00 0.00 -0.00 0.00 0.00 40.66 40.71 1uk5 h LEU 98 CO -0.06 -0.16 0.07 -0.08 -0.00 0.00 0.00 178.44 178.21 1uk5 h GLU 99 N -0.85 0.00 0.00 1.13 4.81 -0.36 -1.21 114.58 118.10 1uk5 h GLU 99 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1uk5 h GLU 99 Cb 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1uk5 h GLU 99 CO 0.10 0.00 0.00 1.17 -0.73 0.00 0.00 179.01 179.55 1uk5 n LYS 100 N -2.93 0.00 -0.33 1.92 4.81 0.21 -2.16 118.16 119.68 1uk5 n LYS 100 Ca -0.03 0.36 0.13 0.00 -0.87 0.00 0.00 58.31 57.90 1uk5 n LYS 100 Cb 0.13 -0.95 0.27 0.00 0.02 0.00 0.00 35.03 34.51 1uk5 n LYS 100 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1uk5 h LEU 101 N 0.00 -0.42 -0.67 3.14 5.85 -1.07 1.99 115.31 124.13 1uk5 h LEU 101 Ca 0.00 0.26 0.07 0.00 0.84 0.00 0.00 57.88 59.05 1uk5 h LEU 101 Cb 0.00 0.45 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 1uk5 h LEU 101 CO 0.00 -0.31 0.35 -0.33 -0.34 0.00 0.00 178.44 177.80 1uk5 h GLU 102 N 0.04 0.60 -0.48 1.25 4.39 -1.35 0.38 114.58 119.41 1uk5 h GLU 102 Ca 0.57 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.23 1uk5 h GLU 102 Cb 1.15 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 1uk5 h GLU 102 CO -0.86 0.40 0.00 1.04 -1.16 0.00 0.00 179.01 178.43 1uk5 n GLN 103 N -4.84 2.14 -0.12 2.33 1.13 0.47 -3.78 117.38 114.71 1uk5 n GLN 103 Ca 0.09 -1.76 -0.24 0.00 -1.94 0.00 0.00 57.00 53.15 1uk5 n GLN 103 Cb 0.22 -1.39 -0.09 0.00 0.11 0.00 0.00 30.24 29.08 1uk5 n GLN 103 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1uk5 n LYS 104 N 0.94 0.54 0.14 -1.09 -0.00 0.56 -2.74 118.16 116.51 1uk5 n LYS 104 Ca 0.17 0.21 -0.14 0.00 -0.00 0.00 0.00 58.31 58.55 1uk5 n LYS 104 Cb 0.42 -1.41 -0.07 0.00 -0.00 0.00 0.00 35.03 33.97 1uk5 n LYS 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uk5 h ALA 105 N -0.67 -0.31 -0.09 0.58 0.00 -0.54 -2.02 119.26 116.22 1uk5 h ALA 105 Ca -0.61 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1uk5 h ALA 105 Cb 1.62 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1uk5 h ALA 105 CO -0.31 -0.68 0.00 0.45 0.00 0.00 0.00 179.25 178.71 1uk5 n SER 106 N -5.25 1.69 -2.79 0.00 2.88 -1.25 -4.57 113.62 104.34 1uk5 n SER 106 Ca -0.09 -1.62 -0.05 0.00 -1.33 0.00 0.00 58.87 55.79 1uk5 n SER 106 Cb 0.17 -0.05 0.04 0.00 -0.75 0.00 0.00 64.21 63.62 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 1.18 -2.87 0.19 0.46 0.00 -0.76 -4.96 105.19 98.41 1uk5 n GLY 107 Ca 0.18 -1.39 -0.18 0.00 0.00 0.00 0.00 46.02 44.62 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 0.64 -6.37 1.61 0.13 -1.81 -3.44 132.00 122.76 1uk5 h PRO 108 Ca -0.07 -0.62 -0.55 0.00 -0.87 0.00 0.00 66.00 63.90 1uk5 h PRO 108 Cb 0.22 0.16 -0.02 0.00 0.13 0.00 0.00 31.00 31.49 1uk5 h PRO 108 CO 0.04 1.22 0.55 -1.54 -0.23 0.00 0.00 178.00 178.05 1uk5 s SER 109 N -7.04 7.18 0.16 1.44 1.04 -1.26 -4.87 113.70 110.35 1uk5 s SER 109 Ca -0.11 1.76 0.00 0.00 0.48 0.00 0.00 55.95 58.08 1uk5 s SER 109 Cb 0.06 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1uk5 s SER 109 CO 0.88 -0.45 0.00 -1.20 0.98 0.00 0.00 173.24 173.46 1uk5 n SER 110 N 4.53 0.50 0.00 7.02 7.64 -1.26 -4.73 113.62 127.31 1uk5 n SER 110 Ca 0.09 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.22 1uk5 n SER 110 Cb 0.48 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 1uk5 n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64