#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 -0.14 0.00 1.61 0.01 -1.26 -5.15 113.70 108.78 1uk5 s SER 2 Ca 0.00 0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.88 1uk5 s SER 2 Cb 0.00 1.33 0.00 0.00 0.21 0.00 0.00 66.02 67.56 1uk5 s SER 2 CO 0.00 -0.27 0.00 -0.24 0.41 0.00 0.00 173.24 173.14 1uk5 n SER 3 N 5.38 0.00 -1.26 2.44 2.88 -1.26 -5.07 113.62 116.73 1uk5 n SER 3 Ca -0.05 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.43 1uk5 n SER 3 Cb 0.50 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.93 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 -0.17 0.64 0.00 0.46 0.00 -1.26 -5.15 105.19 99.72 1uk5 n GLY 4 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1uk5 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uk5 n SER 5 N -0.28 0.00 -3.15 1.61 2.88 -1.26 -5.05 113.62 108.36 1uk5 n SER 5 Ca -0.23 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.37 1uk5 n SER 5 Cb 0.68 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.13 1uk5 n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1uk5 s SER 6 N -4.34 -0.16 0.15 -3.46 0.01 -1.26 -5.16 113.70 99.49 1uk5 s SER 6 Ca 0.00 0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.34 1uk5 s SER 6 Cb 0.00 1.13 0.00 0.00 0.21 0.00 0.00 66.02 67.36 1uk5 s SER 6 CO 0.00 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.23 1uk5 n GLY 7 N 5.41 -2.12 0.00 3.44 0.00 -1.26 -5.05 105.19 105.60 1uk5 n GLY 7 Ca -0.05 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.67 0.00 -0.94 4.61 0.00 -1.26 -5.01 120.51 115.24 1uk5 n ALA 8 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.18 1uk5 n ALA 8 Cb 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.62 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 2.52 0.00 0.00 -0.04 -1.26 -3.78 135.00 132.44 1uk5 n PRO 9 Ca 0.00 -1.57 0.00 0.00 -0.04 0.00 0.00 63.50 61.89 1uk5 n PRO 9 Cb 0.00 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.01 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 3.67 0.00 -2.91 0.55 0.00 -1.26 -5.17 120.51 115.39 1uk5 n ALA 10 Ca 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.88 1uk5 n ALA 10 Cb 0.28 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.62 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 0.00 0.41 0.00 0.00 2.02 -1.25 -5.16 118.70 114.73 1uk5 s GLU 11 Ca 0.00 -0.62 0.00 0.00 0.02 0.00 0.00 54.97 54.37 1uk5 s GLU 11 Cb 0.00 0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.39 1uk5 s GLU 11 CO 0.00 -0.08 0.00 -0.35 0.02 0.00 0.00 175.26 174.85 1uk5 n PRO 12 N 1.33 0.48 -3.66 0.39 -0.04 -1.26 -5.10 135.00 127.15 1uk5 n PRO 12 Ca -0.22 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.17 1uk5 n PRO 12 Cb 0.56 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.94 1uk5 n PRO 12 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uk5 s ALA 13 N -3.50 -1.51 0.00 0.55 0.00 -1.26 -4.84 121.76 111.20 1uk5 s ALA 13 Ca 0.00 1.90 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1uk5 s ALA 13 Cb 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 23.12 21.71 1uk5 s ALA 13 CO 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 175.76 175.09 1uk5 n ALA 14 N 5.05 0.00 -2.41 0.00 0.00 -1.26 -5.13 120.51 116.76 1uk5 n ALA 14 Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.87 1uk5 n ALA 14 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 1uk5 n ALA 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1uk5 s PRO 15 N 0.00 4.21 0.73 0.00 0.04 -1.26 -4.93 135.00 133.78 1uk5 s PRO 15 Ca 0.00 1.65 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 1uk5 s PRO 15 Cb 0.00 -3.78 0.10 0.00 0.04 0.00 0.00 34.50 30.86 1uk5 s PRO 15 CO 0.00 -0.74 1.02 0.15 0.04 0.00 0.00 177.00 177.47 1uk5 s LYS 16 N 3.57 1.82 -0.29 4.56 1.02 -1.26 -5.11 119.74 124.05 1uk5 s LYS 16 Ca 0.55 -0.66 -0.29 0.00 0.02 0.00 0.00 55.97 55.59 1uk5 s LYS 16 Cb -0.22 -2.22 0.19 0.00 -0.52 0.00 0.00 37.83 35.06 1uk5 s LYS 16 CO 0.16 -1.42 1.38 0.45 -0.92 0.00 0.00 175.35 174.99 1uk5 s SER 17 N -4.64 -0.02 0.00 2.83 0.15 -1.26 -5.13 113.70 105.63 1uk5 s SER 17 Ca 0.64 0.02 0.00 0.00 0.70 0.00 0.00 55.95 57.31 1uk5 s SER 17 Cb -0.08 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.25 1uk5 s SER 17 CO 0.45 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.48 1uk5 n GLY 18 N 0.50 -1.55 2.30 9.45 0.00 -1.26 -5.14 105.19 109.48 1uk5 n GLY 18 Ca 0.00 0.55 -0.02 0.00 0.00 0.00 0.00 46.02 46.56 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 -0.54 -4.49 -3.50 1.61 -0.58 -1.26 -5.09 120.64 106.79 1uk5 n GLU 19 Ca 0.00 3.35 0.01 0.00 -0.42 0.00 0.00 57.16 60.10 1uk5 n GLU 19 Cb 0.00 -4.42 0.01 0.00 -0.57 0.00 0.00 31.44 26.46 1uk5 n GLU 19 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1uk5 n ALA 20 N 1.60 -2.65 -1.21 0.62 0.00 -1.26 -5.15 120.51 112.47 1uk5 n ALA 20 Ca -0.13 -0.70 -0.38 0.00 0.00 0.00 0.00 53.44 52.23 1uk5 n ALA 20 Cb 0.21 0.23 0.02 0.00 0.00 0.00 0.00 19.45 19.91 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 -0.69 0.04 -3.77 0.00 0.28 -1.26 -4.95 120.64 110.30 1uk5 n GLU 21 Ca 0.02 0.02 -0.30 0.00 -0.16 0.00 0.00 57.16 56.74 1uk5 n GLU 21 Cb 0.46 -1.08 -0.14 0.00 1.43 0.00 0.00 31.44 32.11 1uk5 n GLU 21 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1uk5 s THR 22 N -1.98 1.57 0.98 3.84 2.01 -1.26 -5.12 115.64 115.68 1uk5 s THR 22 Ca 0.54 -2.51 -0.14 0.00 0.31 0.00 0.00 61.69 59.89 1uk5 s THR 22 Cb -0.42 -2.11 0.18 0.00 0.01 0.00 0.00 72.50 70.16 1uk5 s THR 22 CO 0.69 -0.83 1.17 -2.16 -0.69 0.00 0.00 174.62 172.79 1uk5 s PRO 23 N 0.45 0.59 -0.09 4.92 0.04 -1.26 -4.98 135.00 134.66 1uk5 s PRO 23 Ca 0.16 0.08 -0.30 0.00 0.04 0.00 0.00 61.00 60.99 1uk5 s PRO 23 Cb -0.24 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1uk5 s PRO 23 CO -0.03 -2.53 1.24 -1.25 0.04 0.00 0.00 177.00 174.47 1uk5 s PRO 24 N -5.43 4.30 0.00 0.56 0.04 -1.26 -4.93 135.00 128.28 1uk5 s PRO 24 Ca 0.67 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.40 1uk5 s PRO 24 Cb -0.12 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.78 1uk5 s PRO 24 CO 0.54 -0.56 0.00 0.36 0.04 0.00 0.00 177.00 177.38 1uk5 n LYS 25 N 5.77 0.00 -4.05 4.56 2.85 -1.26 -5.14 118.16 120.89 1uk5 n LYS 25 Ca 0.12 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 57.02 1uk5 n LYS 25 Cb 0.45 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.76 1uk5 n LYS 25 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 1uk5 s HIS 26 N 3.89 3.41 0.14 5.58 5.65 -1.26 -5.00 115.29 127.69 1uk5 s HIS 26 Ca 0.00 0.36 -0.04 0.00 0.25 0.00 0.00 55.06 55.62 1uk5 s HIS 26 Cb 0.00 -1.92 -0.05 0.00 -1.18 0.00 0.00 32.58 29.43 1uk5 s HIS 26 CO 0.00 0.56 1.34 -1.00 -0.65 0.00 0.00 174.74 174.99 1uk5 h PRO 27 N 5.32 0.44 -0.75 2.88 0.13 -2.01 -2.90 132.00 135.11 1uk5 h PRO 27 Ca -0.51 -0.42 0.15 0.00 -0.87 0.00 0.00 66.00 64.35 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 0.59 1.08 0.50 0.78 -0.23 0.00 0.00 178.00 180.72 1uk5 h GLY 28 N 1.19 0.67 0.14 1.56 0.00 -2.00 0.93 103.07 105.56 1uk5 h GLY 28 Ca -0.06 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1uk5 h GLY 28 CO 0.15 0.05 -0.04 -2.08 0.00 0.00 0.00 176.54 174.63 1uk5 h VAL 29 N 0.39 0.76 -1.17 4.60 2.07 -1.88 -3.25 116.25 117.76 1uk5 h VAL 29 Ca 0.37 -1.39 0.34 0.00 0.82 0.00 0.00 66.70 66.84 1uk5 h VAL 29 Cb 0.89 1.38 -0.10 0.00 -1.52 0.00 0.00 31.29 31.94 1uk5 h VAL 29 CO -0.11 0.24 0.77 -0.07 0.02 0.00 0.00 177.57 178.41 1uk5 h LEU 30 N -0.97 0.31 -1.70 2.57 3.38 -1.20 0.95 115.31 118.64 1uk5 h LEU 30 Ca -0.01 0.09 0.39 0.00 0.09 0.00 0.00 57.88 58.44 1uk5 h LEU 30 Cb 0.47 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 41.18 1uk5 h LEU 30 CO 0.02 -0.01 0.92 0.50 0.09 0.00 0.00 178.44 179.95 1uk5 h LYS 31 N 0.23 0.10 0.05 1.13 3.64 -0.87 0.56 116.57 121.41 1uk5 h LYS 31 Ca 0.67 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.91 1uk5 h LYS 31 Cb 2.01 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.80 1uk5 h LYS 31 CO -0.28 0.07 -0.66 -0.39 -2.27 0.00 0.00 179.45 175.91 1uk5 h VAL 32 N 0.11 1.43 -1.01 2.00 -1.51 0.78 -3.31 116.25 114.74 1uk5 h VAL 32 Ca 0.71 -2.36 0.24 0.00 -1.23 0.00 0.00 66.70 64.07 1uk5 h VAL 32 Cb 2.46 3.00 -0.12 0.00 -2.13 0.00 0.00 31.29 34.50 1uk5 h VAL 32 CO -0.18 0.58 0.60 -0.33 -1.23 0.00 0.00 177.57 177.01 1uk5 h GLU 33 N -0.76 0.56 -0.19 5.19 5.08 0.07 1.38 114.58 125.92 1uk5 h GLU 33 Ca -0.15 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1uk5 h GLU 33 Cb 1.32 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1uk5 h GLU 33 CO -0.00 0.37 0.08 0.00 -1.00 0.00 0.00 179.01 178.46 1uk5 h ALA 34 N 1.72 1.79 0.01 3.43 0.00 -0.57 0.15 119.26 125.79 1uk5 h ALA 34 Ca 0.64 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.50 1uk5 h ALA 34 Cb 1.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1uk5 h ALA 34 CO -0.46 0.17 -0.01 0.82 0.00 0.00 0.00 179.25 179.77 1uk5 h ILE 35 N 0.26 0.12 -0.97 0.00 2.04 0.15 -3.28 117.51 115.82 1uk5 h ILE 35 Ca 0.07 -1.07 0.28 0.00 1.00 0.00 0.00 64.86 65.13 1uk5 h ILE 35 Cb 0.05 0.22 -0.04 0.00 -0.74 0.00 0.00 36.82 36.30 1uk5 h ILE 35 CO -0.01 0.04 0.82 -0.07 0.00 0.00 0.00 178.15 178.93 1uk5 h LEU 36 N -1.00 0.00 -0.62 1.44 -0.00 -0.30 2.29 115.31 117.11 1uk5 h LEU 36 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1uk5 h LEU 36 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.73 1uk5 h LEU 36 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 178.44 177.82 1uk5 n GLU 37 N -3.90 0.09 0.00 1.13 1.02 0.50 -0.65 120.64 118.83 1uk5 n GLU 37 Ca 0.21 0.48 0.04 0.00 -0.02 0.00 0.00 57.16 57.86 1uk5 n GLU 37 Cb 1.14 -1.74 -0.03 0.00 -0.02 0.00 0.00 31.44 30.79 1uk5 n GLU 37 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1uk5 n LYS 38 N -1.92 3.66 -0.04 3.49 5.02 0.77 -4.56 118.16 124.58 1uk5 n LYS 38 Ca 0.01 -0.17 -0.22 0.00 -2.02 0.00 0.00 58.31 55.91 1uk5 n LYS 38 Cb 0.10 -0.93 -0.13 0.00 -0.02 0.00 0.00 35.03 34.05 1uk5 n LYS 38 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1uk5 h VAL 39 N 0.30 0.77 -1.04 -0.18 -1.51 -0.38 -3.35 116.25 110.86 1uk5 h VAL 39 Ca 0.00 -2.28 0.29 0.00 -1.23 0.00 0.00 66.70 63.48 1uk5 h VAL 39 Cb 0.22 2.40 -0.13 0.00 -2.13 0.00 0.00 31.29 31.66 1uk5 h VAL 39 CO 0.00 0.65 0.62 1.56 -1.23 0.00 0.00 177.57 179.17 1uk5 h GLN 40 N -0.38 0.41 0.00 5.19 1.08 -1.16 1.62 115.11 121.87 1uk5 h GLN 40 Ca -0.39 -0.02 -0.06 0.00 -1.45 0.00 0.00 58.65 56.73 1uk5 h GLN 40 Cb 1.73 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 29.06 1uk5 h GLN 40 CO -0.03 0.27 -0.26 0.78 -0.95 0.00 0.00 178.83 178.63 1uk5 h GLY 41 N 0.42 0.00 1.44 3.46 0.00 -1.81 -0.68 103.07 105.89 1uk5 h GLY 41 Ca 0.68 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.97 1uk5 h GLY 41 CO -0.48 0.00 -0.69 1.41 0.00 0.00 0.00 176.54 176.78 1uk5 h LEU 42 N 0.00 0.00 0.13 3.11 3.38 0.20 -3.28 115.31 118.86 1uk5 h LEU 42 Ca -0.00 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.66 1uk5 h LEU 42 Cb 0.54 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.32 1uk5 h LEU 42 CO 0.03 0.16 -1.27 -0.08 0.09 0.00 0.00 178.44 177.37 1uk5 h GLU 43 N 0.00 0.63 -0.83 1.13 4.22 0.36 -3.05 114.58 117.04 1uk5 h GLU 43 Ca -0.03 -0.85 0.04 0.00 0.08 0.00 0.00 59.36 58.60 1uk5 h GLU 43 Cb 1.14 0.28 -0.05 0.00 0.50 0.00 0.00 28.75 30.62 1uk5 h GLU 43 CO 0.02 1.39 0.52 -0.56 -2.18 0.00 0.00 179.01 178.20 1uk5 h GLN 44 N 0.27 0.97 -0.75 1.92 3.07 -1.25 -0.87 115.11 118.47 1uk5 h GLN 44 Ca -0.20 -0.06 -0.03 0.00 0.09 0.00 0.00 58.65 58.45 1uk5 h GLN 44 Cb 1.94 -0.22 -0.03 0.00 0.08 0.00 0.00 27.48 29.25 1uk5 h GLN 44 CO 0.24 0.64 0.35 0.00 0.09 0.00 0.00 178.83 180.15 1uk5 h ALA 45 N 1.36 1.19 -0.56 0.06 0.00 -1.61 -1.97 119.26 117.72 1uk5 h ALA 45 Ca 0.34 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1uk5 h ALA 45 Cb 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1uk5 h ALA 45 CO -0.13 0.61 0.00 0.28 0.00 0.00 0.00 179.25 180.01 1uk5 n VAL 46 N -4.31 0.00 -0.61 0.00 0.31 -0.44 0.19 118.33 113.48 1uk5 n VAL 46 Ca 0.07 1.41 0.48 0.00 -0.01 0.00 0.00 64.34 66.29 1uk5 n VAL 46 Cb 0.15 -2.40 0.76 0.00 -0.91 0.00 0.00 33.84 31.44 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 -1.26 4.52 1.82 -1.29 1.69 116.42 121.91 1uk5 h ASP 47 Ca 0.00 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.10 1uk5 h ASP 47 Cb 0.00 0.00 -0.42 0.00 0.68 0.00 0.00 39.33 39.59 1uk5 h ASP 47 CO 0.00 0.00 -0.83 -1.54 -1.61 0.00 0.00 179.24 175.26 1uk5 n SER 48 N -3.83 4.16 -4.77 2.28 3.41 -0.74 -5.06 113.62 109.07 1uk5 n SER 48 Ca 0.40 -3.51 -0.27 0.00 -0.26 0.00 0.00 58.87 55.22 1uk5 n SER 48 Cb 1.90 -0.45 -0.06 0.00 -0.26 0.00 0.00 64.21 65.34 1uk5 n SER 48 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1uk5 s PHE 49 N -3.50 3.11 -0.02 7.33 2.19 0.58 -4.77 117.98 122.90 1uk5 s PHE 49 Ca 0.45 -0.01 0.00 0.00 0.33 0.00 0.00 56.93 57.70 1uk5 s PHE 49 Cb 0.41 -1.52 0.03 0.00 -1.31 0.00 0.00 43.02 40.62 1uk5 s PHE 49 CO -0.11 0.52 0.02 -2.00 1.83 0.00 0.00 175.22 175.48 1uk5 s GLU 50 N -2.88 0.04 0.00 10.12 2.12 -1.26 -4.90 118.70 121.94 1uk5 s GLU 50 Ca 0.30 0.14 0.00 0.00 0.36 0.00 0.00 54.97 55.77 1uk5 s GLU 50 Cb -0.11 -0.27 0.00 0.00 0.26 0.00 0.00 34.13 34.01 1uk5 s GLU 50 CO 0.22 -0.14 0.00 0.41 -0.54 0.00 0.00 175.26 175.21 1uk5 n GLY 51 N 4.03 0.01 0.68 -1.50 0.00 -1.26 -4.89 105.19 102.26 1uk5 n GLY 51 Ca -0.26 -0.74 -0.02 0.00 0.00 0.00 0.00 46.02 45.00 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 0.17 0.00 1.61 2.85 -1.26 -4.46 118.16 117.07 1uk5 n LYS 52 Ca 0.00 -0.50 0.13 0.00 -1.05 0.00 0.00 58.31 56.89 1uk5 n LYS 52 Cb 0.00 0.53 0.45 0.00 -0.65 0.00 0.00 35.03 35.35 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 -0.11 0.41 -0.01 -1.58 5.02 -0.66 -3.43 118.16 117.80 1uk5 n LYS 53 Ca -0.01 -0.19 0.09 0.00 -2.02 0.00 0.00 58.31 56.19 1uk5 n LYS 53 Cb 0.11 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.50 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 -1.13 0.00 -1.63 -0.18 -2.24 -1.26 -4.87 114.28 102.97 1uk5 n THR 54 Ca 0.10 -0.34 -0.34 0.00 -2.27 0.00 0.00 64.05 61.20 1uk5 n THR 54 Cb 0.32 0.28 0.07 0.00 -2.10 0.00 0.00 70.33 68.90 1uk5 n THR 54 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uk5 s ASP 55 N -3.74 4.68 -0.03 3.42 2.15 -1.22 -4.96 116.67 116.98 1uk5 s ASP 55 Ca -0.04 2.19 -0.24 0.00 0.43 0.00 0.00 52.55 54.89 1uk5 s ASP 55 Cb 0.12 -2.57 -0.21 0.00 -0.30 0.00 0.00 42.92 39.96 1uk5 s ASP 55 CO 0.72 -1.92 1.15 0.50 -0.17 0.00 0.00 175.17 175.45 1uk5 h LYS 56 N -0.06 0.17 -0.97 4.34 1.63 -1.94 -3.05 116.57 116.70 1uk5 h LYS 56 Ca -0.47 -0.13 0.30 0.00 -0.85 0.00 0.00 60.65 59.50 1uk5 h LYS 56 Cb 1.27 0.03 -0.15 0.00 -0.60 0.00 0.00 32.23 32.78 1uk5 h LYS 56 CO 0.52 0.78 0.44 -0.22 -3.45 0.00 0.00 179.45 177.52 1uk5 h LYS 57 N -0.40 0.24 -0.45 1.90 1.63 -1.93 0.86 116.57 118.41 1uk5 h LYS 57 Ca -0.01 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1uk5 h LYS 57 Cb 0.80 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.36 1uk5 h LYS 57 CO 0.03 0.16 0.17 -0.92 -3.45 0.00 0.00 179.45 175.44 1uk5 h TYR 58 N 0.25 0.70 -0.44 1.91 3.20 -1.77 -2.16 116.97 118.65 1uk5 h TYR 58 Ca 0.69 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 62.52 1uk5 h TYR 58 Cb 1.54 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 39.58 1uk5 h TYR 58 CO -0.11 0.61 0.30 -0.07 -1.64 0.00 0.00 178.16 177.25 1uk5 h LEU 59 N 0.59 0.45 0.29 2.82 3.38 0.76 0.25 115.31 123.85 1uk5 h LEU 59 Ca 0.15 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1uk5 h LEU 59 Cb 0.22 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1uk5 h LEU 59 CO -0.01 0.32 -0.14 0.24 0.09 0.00 0.00 178.44 178.94 1uk5 h MET 60 N 0.53 -0.37 -0.64 1.13 2.86 -0.37 0.28 114.93 118.34 1uk5 h MET 60 Ca 0.17 0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.75 1uk5 h MET 60 Cb 0.04 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 1uk5 h MET 60 CO -0.04 -0.20 0.05 0.82 1.06 0.00 0.00 176.91 178.59 1uk5 h ILE 61 N -0.45 1.27 0.24 -1.22 2.04 -1.05 0.27 117.51 118.60 1uk5 h ILE 61 Ca -0.04 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.71 1uk5 h ILE 61 Cb 0.34 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1uk5 h ILE 61 CO 0.06 0.41 -0.21 -0.08 0.00 0.00 0.00 178.15 178.34 1uk5 h GLU 62 N 1.02 -0.44 -0.44 2.37 4.22 -0.31 0.27 114.58 121.27 1uk5 h GLU 62 Ca 0.19 0.03 -0.05 0.00 0.08 0.00 0.00 59.36 59.61 1uk5 h GLU 62 Cb 0.51 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1uk5 h GLU 62 CO 0.02 -0.30 0.10 1.05 -2.18 0.00 0.00 179.01 177.71 1uk5 h GLU 63 N -0.46 0.71 -0.11 1.92 4.11 -0.34 -1.77 114.58 118.64 1uk5 h GLU 63 Ca -0.01 -0.18 0.03 0.00 0.07 0.00 0.00 59.36 59.27 1uk5 h GLU 63 Cb 0.42 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1uk5 h GLU 63 CO -0.03 0.72 0.08 1.88 0.07 0.00 0.00 179.01 181.73 1uk5 h TYR 64 N 0.58 0.03 0.17 2.06 0.05 -0.18 -0.30 116.97 119.38 1uk5 h TYR 64 Ca 0.14 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 1uk5 h TYR 64 Cb 0.33 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1uk5 h TYR 64 CO 0.02 0.02 -0.08 -0.07 -1.05 0.00 0.00 178.16 177.00 1uk5 h LEU 65 N 0.03 -0.19 -0.87 3.88 3.38 0.06 -3.29 115.31 118.31 1uk5 h LEU 65 Ca 0.05 0.01 0.23 0.00 0.09 0.00 0.00 57.88 58.25 1uk5 h LEU 65 Cb 0.16 0.05 -0.15 0.00 0.09 0.00 0.00 40.66 40.81 1uk5 h LEU 65 CO -0.00 0.02 0.09 0.74 0.09 0.00 0.00 178.44 179.38 1uk5 h THR 66 N -0.53 0.23 -0.99 0.22 2.02 -1.19 0.76 112.91 113.42 1uk5 h THR 66 Ca -0.02 -0.04 0.35 0.00 0.77 0.00 0.00 66.41 67.47 1uk5 h THR 66 Cb 0.17 0.11 -0.17 0.00 -1.74 0.00 0.00 68.15 66.52 1uk5 h THR 66 CO 0.04 0.02 0.39 0.11 0.37 0.00 0.00 175.52 176.45 1uk5 h LYS 67 N 0.11 0.07 -0.23 6.66 1.57 -1.14 1.38 116.57 124.99 1uk5 h LYS 67 Ca 0.52 -0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 59.18 1uk5 h LYS 67 Cb 1.03 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 1uk5 h LYS 67 CO -0.75 0.05 -0.32 0.93 -0.57 0.00 0.00 179.45 178.79 1uk5 h GLU 68 N 0.07 0.62 -0.25 3.15 4.39 0.47 -2.88 114.58 120.15 1uk5 h GLU 68 Ca 0.74 -0.36 0.05 0.00 0.34 0.00 0.00 59.36 60.14 1uk5 h GLU 68 Cb 1.81 0.03 -0.08 0.00 -0.10 0.00 0.00 28.75 30.41 1uk5 h GLU 68 CO -0.77 0.97 -0.46 -0.07 -1.16 0.00 0.00 179.01 177.52 1uk5 h LEU 69 N 0.32 -1.47 -1.55 1.33 3.38 0.21 0.60 115.31 118.13 1uk5 h LEU 69 Ca 0.03 0.20 0.18 0.00 0.09 0.00 0.00 57.88 58.37 1uk5 h LEU 69 Cb 0.90 0.61 -0.06 0.00 0.09 0.00 0.00 40.66 42.20 1uk5 h LEU 69 CO 0.07 -0.42 0.55 -0.07 0.09 0.00 0.00 178.44 178.67 1uk5 h LEU 70 N -0.44 0.39 -1.33 1.67 -0.00 -1.18 1.25 115.31 115.67 1uk5 h LEU 70 Ca 0.09 0.03 -0.05 0.00 -0.00 0.00 0.00 57.88 57.95 1uk5 h LEU 70 Cb 0.62 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.23 1uk5 h LEU 70 CO -0.48 0.18 -0.23 0.00 -0.00 0.00 0.00 178.44 177.91 1uk5 h ALA 71 N 1.63 1.11 0.00 1.53 0.00 0.23 -0.88 119.26 122.87 1uk5 h ALA 71 Ca 0.42 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1uk5 h ALA 71 Cb 1.02 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1uk5 h ALA 71 CO -0.14 0.28 -0.02 -0.07 0.00 0.00 0.00 179.25 179.29 1uk5 h LEU 72 N 0.00 0.00 -0.72 0.00 3.38 0.49 -3.22 115.31 115.24 1uk5 h LEU 72 Ca -0.00 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.14 1uk5 h LEU 72 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1uk5 h LEU 72 CO 0.03 0.93 0.00 -0.67 0.09 0.00 0.00 178.44 178.82 1uk5 n ASP 73 N -4.63 0.37 0.00 -0.43 2.03 0.33 -0.70 116.55 113.52 1uk5 n ASP 73 Ca -0.09 0.64 0.12 0.00 0.52 0.00 0.00 54.79 55.98 1uk5 n ASP 73 Cb 0.41 -0.70 0.66 0.00 -0.72 0.00 0.00 41.12 40.77 1uk5 n ASP 73 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1uk5 n SER 74 N -1.97 0.00 -4.74 1.67 2.88 -0.35 -4.67 113.62 106.45 1uk5 n SER 74 Ca 0.00 -0.50 -0.36 0.00 -1.33 0.00 0.00 58.87 56.69 1uk5 n SER 74 Cb 0.09 -0.10 -0.07 0.00 -0.75 0.00 0.00 64.21 63.38 1uk5 n SER 74 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1uk5 s VAL 75 N -2.20 5.32 -0.44 2.46 1.01 0.12 -5.05 120.40 121.62 1uk5 s VAL 75 Ca 0.31 0.48 -0.07 0.00 0.00 0.00 0.00 61.98 62.70 1uk5 s VAL 75 Cb 0.16 -3.60 0.11 0.00 0.00 0.00 0.00 36.38 33.05 1uk5 s VAL 75 CO 0.30 0.41 0.28 -1.81 0.00 0.00 0.00 175.10 174.28 1uk5 s ASP 76 N 0.35 5.53 0.46 3.32 1.01 -1.26 -4.91 116.67 121.16 1uk5 s ASP 76 Ca 0.15 -1.88 0.26 0.00 0.71 0.00 0.00 52.55 51.79 1uk5 s ASP 76 Cb -0.13 -1.94 0.77 0.00 1.01 0.00 0.00 42.92 42.63 1uk5 s ASP 76 CO 0.03 -0.61 1.76 1.55 0.21 0.00 0.00 175.17 178.11 1uk5 h PRO 77 N 8.30 0.00 0.00 8.23 0.13 -1.93 -3.47 132.00 143.26 1uk5 h PRO 77 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 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 0.79 0.11 0.00 0.39 -0.23 0.00 0.00 178.00 179.06 1uk5 n GLU 78 N -3.18 0.00 -1.07 0.86 1.02 -1.26 -1.94 120.64 115.07 1uk5 n GLU 78 Ca 0.02 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.14 1uk5 n GLU 78 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.88 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 -0.23 3.51 0.62 0.00 -1.26 -5.12 105.19 102.71 1uk5 n GLY 79 Ca 0.00 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 1uk5 n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1uk5 s ARG 80 N 0.01 3.71 0.08 1.61 0.52 -0.82 -4.99 118.95 119.08 1uk5 s ARG 80 Ca 0.01 -0.47 -0.35 0.00 -0.52 0.00 0.00 55.73 54.40 1uk5 s ARG 80 Cb 0.04 -3.55 -0.17 0.00 0.52 0.00 0.00 34.95 31.79 1uk5 s ARG 80 CO -0.01 -0.25 1.58 0.00 0.02 0.00 0.00 175.30 176.64 1uk5 h ALA 81 N 8.34 -1.07 -0.83 2.13 0.00 -1.97 1.51 119.26 127.36 1uk5 h ALA 81 Ca -0.35 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.48 1uk5 h ALA 81 Cb 1.17 0.61 -0.13 0.00 0.00 0.00 0.00 17.79 19.44 1uk5 h ALA 81 CO 0.58 -1.13 -0.44 -0.44 0.00 0.00 0.00 179.25 177.82 1uk5 h ASP 82 N -1.00 -1.58 0.34 0.00 3.32 -1.99 0.73 116.42 116.24 1uk5 h ASP 82 Ca -0.07 0.29 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 1uk5 h ASP 82 Cb 0.85 0.76 0.00 0.00 0.22 0.00 0.00 39.33 41.16 1uk5 h ASP 82 CO 0.01 -0.29 -0.16 0.58 -1.72 0.00 0.00 179.24 177.65 1uk5 h VAL 83 N -0.09 0.68 -0.85 -1.35 2.07 -1.82 -1.55 116.25 113.35 1uk5 h VAL 83 Ca 0.25 -0.20 0.16 0.00 0.82 0.00 0.00 66.70 67.73 1uk5 h VAL 83 Cb 0.55 0.79 -0.16 0.00 -1.52 0.00 0.00 31.29 30.95 1uk5 h VAL 83 CO -0.86 0.04 -0.26 0.03 0.02 0.00 0.00 177.57 176.54 1uk5 h ARG 84 N -0.56 -0.02 0.55 1.57 3.08 0.45 0.13 114.38 119.57 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 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1uk5 h ARG 84 CO 0.08 -0.01 -0.33 0.37 -1.07 0.00 0.00 179.97 179.00 1uk5 h GLN 85 N -0.02 -0.80 -0.76 0.04 4.15 0.55 -0.71 115.11 117.56 1uk5 h GLN 85 Ca 0.38 0.05 0.11 0.00 0.77 0.00 0.00 58.65 59.96 1uk5 h GLN 85 Cb 0.61 0.18 -0.12 0.00 0.21 0.00 0.00 27.48 28.36 1uk5 h GLN 85 CO -0.88 -0.53 -0.44 0.00 -1.93 0.00 0.00 178.83 175.05 1uk5 h ALA 86 N -0.44 -0.20 -0.23 3.38 0.00 0.12 1.55 119.26 123.44 1uk5 h ALA 86 Ca -0.07 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1uk5 h ALA 86 Cb 0.68 1.02 -0.07 0.00 0.00 0.00 0.00 17.79 19.42 1uk5 h ALA 86 CO 0.07 -0.78 -0.21 -0.09 0.00 0.00 0.00 179.25 178.24 1uk5 h ARG 87 N -0.13 -0.21 -0.43 0.00 2.43 -0.64 1.53 114.38 116.93 1uk5 h ARG 87 Ca 0.23 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.44 1uk5 h ARG 87 Cb 0.55 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 1uk5 h ARG 87 CO -0.81 -0.14 0.24 -0.09 -1.51 0.00 0.00 179.97 177.66 1uk5 h ARG 88 N -0.22 0.46 -0.27 0.20 2.43 0.94 0.33 114.38 118.25 1uk5 h ARG 88 Ca 0.13 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1uk5 h ARG 88 Cb 0.42 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1uk5 h ARG 88 CO -0.36 0.31 0.12 0.22 -1.51 0.00 0.00 179.97 178.75 1uk5 h ASP 89 N 0.48 0.35 0.23 -3.80 1.82 0.31 0.22 116.42 116.03 1uk5 h ASP 89 Ca 0.17 -0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 56.68 1uk5 h ASP 89 Cb 0.04 -0.09 -0.02 0.00 0.68 0.00 0.00 39.33 39.94 1uk5 h ASP 89 CO -0.10 0.39 -0.31 1.23 -1.61 0.00 0.00 179.24 178.84 1uk5 h GLY 90 N 0.30 -1.08 0.37 -0.78 0.00 0.26 1.50 103.07 103.64 1uk5 h GLY 90 Ca 0.09 0.51 0.10 0.00 0.00 0.00 0.00 47.33 48.03 1uk5 h GLY 90 CO -0.01 -0.34 0.22 -0.39 0.00 0.00 0.00 176.54 176.02 1uk5 h VAL 91 N -0.56 0.76 0.48 4.60 -1.51 -0.94 0.38 116.25 119.46 1uk5 h VAL 91 Ca -0.03 -0.13 -0.01 0.00 -1.23 0.00 0.00 66.70 65.29 1uk5 h VAL 91 Cb 0.50 0.33 -0.01 0.00 -2.13 0.00 0.00 31.29 29.98 1uk5 h VAL 91 CO -0.08 0.07 -0.34 -0.09 -1.23 0.00 0.00 177.57 175.90 1uk5 h ARG 92 N 0.39 -0.77 -0.91 5.19 2.43 -0.14 1.57 114.38 122.14 1uk5 h ARG 92 Ca 0.31 0.05 0.24 0.00 -0.81 0.00 0.00 59.98 59.77 1uk5 h ARG 92 Cb 0.39 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.06 1uk5 h ARG 92 CO -0.31 -0.51 0.63 -0.22 -1.51 0.00 0.00 179.97 178.04 1uk5 h LYS 93 N -0.80 0.15 0.03 0.20 1.63 0.28 -0.45 116.57 117.61 1uk5 h LYS 93 Ca -0.05 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1uk5 h LYS 93 Cb 0.67 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.27 1uk5 h LYS 93 CO 0.02 0.10 -0.01 0.28 -3.45 0.00 0.00 179.45 176.39 1uk5 h VAL 94 N 0.16 0.89 -0.97 2.00 2.07 0.30 -3.33 116.25 117.36 1uk5 h VAL 94 Ca 0.45 -1.59 0.14 0.00 0.82 0.00 0.00 66.70 66.53 1uk5 h VAL 94 Cb 1.52 1.65 -0.15 0.00 -1.52 0.00 0.00 31.29 32.79 1uk5 h VAL 94 CO -0.08 0.29 -0.41 1.56 0.02 0.00 0.00 177.57 178.95 1uk5 h GLN 95 N -0.98 -0.01 -1.07 1.57 4.20 0.36 1.41 115.11 120.58 1uk5 h GLN 95 Ca -0.00 0.00 0.35 0.00 0.06 0.00 0.00 58.65 59.06 1uk5 h GLN 95 Cb 0.51 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.15 1uk5 h GLN 95 CO 0.01 -0.01 0.64 1.15 -0.67 0.00 0.00 178.83 179.95 1uk5 h THR 96 N -0.01 0.26 0.15 -0.54 2.02 -1.27 0.63 112.91 114.15 1uk5 h THR 96 Ca 0.32 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.40 1uk5 h THR 96 Cb 0.57 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1uk5 h THR 96 CO -0.97 0.05 -0.07 0.40 0.37 0.00 0.00 175.52 175.30 1uk5 h ILE 97 N 0.25 0.88 -0.47 3.11 2.04 0.18 0.24 117.51 123.74 1uk5 h ILE 97 Ca 0.75 -0.11 0.08 0.00 1.00 0.00 0.00 64.86 66.58 1uk5 h ILE 97 Cb 1.90 0.95 -0.07 0.00 -0.74 0.00 0.00 36.82 38.86 1uk5 h ILE 97 CO -0.55 0.03 0.09 -0.07 0.00 0.00 0.00 178.15 177.65 1uk5 h LEU 98 N -0.26 -0.01 -1.44 1.44 -0.00 0.57 0.38 115.31 116.00 1uk5 h LEU 98 Ca -0.02 0.08 -0.02 0.00 -0.00 0.00 0.00 57.88 57.92 1uk5 h LEU 98 Cb 0.20 0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 40.96 1uk5 h LEU 98 CO 0.03 0.03 0.13 -0.33 -0.00 0.00 0.00 178.44 178.30 1uk5 h GLU 99 N 0.22 0.50 0.54 1.13 4.39 -0.73 -2.41 114.58 118.23 1uk5 h GLU 99 Ca 0.23 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.84 1uk5 h GLU 99 Cb 0.31 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1uk5 h GLU 99 CO -0.31 0.43 -0.26 0.87 -1.16 0.00 0.00 179.01 178.58 1uk5 h LYS 100 N 0.50 -0.69 -0.97 2.33 1.79 0.21 -3.17 116.57 116.57 1uk5 h LYS 100 Ca 0.12 0.05 0.18 0.00 -2.18 0.00 0.00 60.65 58.82 1uk5 h LYS 100 Cb 0.13 0.16 -0.18 0.00 -1.58 0.00 0.00 32.23 30.76 1uk5 h LYS 100 CO -0.01 -0.41 -0.28 1.25 -1.08 0.00 0.00 179.45 178.92 1uk5 h LEU 101 N -1.11 -1.05 0.00 2.94 6.46 -0.20 0.23 115.31 122.59 1uk5 h LEU 101 Ca -0.07 0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.98 1uk5 h LEU 101 Cb 0.61 0.64 0.00 0.00 -0.73 0.00 0.00 40.66 41.18 1uk5 h LEU 101 CO 0.12 -0.31 0.00 -0.62 -0.62 0.00 0.00 178.44 177.01 1uk5 n GLU 102 N -5.57 0.00 -0.34 1.25 1.02 -0.92 0.20 120.64 116.28 1uk5 n GLU 102 Ca 0.14 0.58 0.24 0.00 -0.02 0.00 0.00 57.16 58.10 1uk5 n GLU 102 Cb 0.46 -1.12 0.52 0.00 -0.02 0.00 0.00 31.44 31.28 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 0.36 -0.13 3.49 4.20 -1.34 1.56 115.11 123.25 1uk5 h GLN 103 Ca 0.00 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 1uk5 h GLN 103 Cb 0.00 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1uk5 h GLN 103 CO 0.00 0.24 -0.10 0.87 -0.67 0.00 0.00 178.83 179.17 1uk5 h LYS 104 N 0.37 0.20 -0.90 1.46 1.79 0.23 -1.89 116.57 117.83 1uk5 h LYS 104 Ca 0.62 -0.04 -0.62 0.00 -2.18 0.00 0.00 60.65 58.43 1uk5 h LYS 104 Cb 1.60 -0.03 -0.34 0.00 -1.58 0.00 0.00 32.23 31.88 1uk5 h LYS 104 CO -0.32 0.31 0.24 0.00 -1.08 0.00 0.00 179.45 178.60 1uk5 n ALA 105 N -2.49 5.82 -1.14 3.86 0.00 0.55 -4.21 120.51 122.89 1uk5 n ALA 105 Ca -0.01 -3.58 0.00 0.00 0.00 0.00 0.00 53.44 49.85 1uk5 n ALA 105 Cb 0.24 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1uk5 n ALA 105 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1uk5 n SER 106 N -0.85 0.00 -0.79 0.00 7.64 -0.69 -1.66 113.62 117.28 1uk5 n SER 106 Ca 0.56 -1.11 0.09 0.00 1.01 0.00 0.00 58.87 59.41 1uk5 n SER 106 Cb 0.79 -0.02 -0.02 0.00 -1.01 0.00 0.00 64.21 63.95 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 0.00 -0.96 3.76 0.23 0.00 -1.22 -4.68 105.19 102.31 1uk5 n GLY 107 Ca 0.00 -0.64 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.30 4.67 0.12 1.61 0.04 -1.26 -4.86 135.00 134.02 1uk5 s PRO 108 Ca 0.00 1.77 0.00 0.00 0.04 0.00 0.00 61.00 62.81 1uk5 s PRO 108 Cb 0.00 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.34 1uk5 s PRO 108 CO 0.00 0.25 0.00 0.45 0.04 0.00 0.00 177.00 177.74 1uk5 n SER 109 N 1.24 -0.90 0.03 6.66 2.88 -1.26 -5.05 113.62 117.21 1uk5 n SER 109 Ca -0.01 0.23 -0.01 0.00 -1.33 0.00 0.00 58.87 57.75 1uk5 n SER 109 Cb 0.45 1.10 -0.00 0.00 -0.75 0.00 0.00 64.21 65.01 1uk5 n SER 109 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uk5 n SER 110 N -2.78 1.03 0.00 -3.46 2.88 -1.26 -5.32 113.62 104.71 1uk5 n SER 110 Ca 0.00 0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 1uk5 n SER 110 Cb 0.00 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 1uk5 n SER 110 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42