#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ysm h ALA 2 N 0.00 0.73 -0.82 3.04 0.00 -2.05 0.27 119.26 120.43 1ysm h ALA 2 Ca 0.00 0.22 0.06 0.00 0.00 0.00 0.00 54.91 55.19 1ysm h ALA 2 Cb 0.00 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1ysm h ALA 2 CO 0.00 -0.41 0.50 0.77 0.00 0.00 0.00 179.25 180.11 1ysm h SER 3 N 0.11 0.79 0.05 0.00 0.02 -2.05 0.13 113.55 112.61 1ysm h SER 3 Ca 0.38 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.35 1ysm h SER 3 Cb 0.66 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1ysm h SER 3 CO -0.62 0.51 -0.03 0.58 -1.14 0.00 0.00 176.83 176.14 1ysm h VAL 4 N 0.93 1.10 -0.48 2.27 2.07 -1.01 -0.13 116.25 121.00 1ysm h VAL 4 Ca 0.36 -0.52 0.08 0.00 0.82 0.00 0.00 66.70 67.44 1ysm h VAL 4 Cb 0.15 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 31.30 1ysm h VAL 4 CO -0.17 0.13 0.09 -0.07 0.02 0.00 0.00 177.57 177.57 1ysm h LEU 5 N -0.30 -0.02 0.07 2.57 3.38 -0.63 0.60 115.31 120.98 1ysm h LEU 5 Ca -0.01 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.07 1ysm h LEU 5 Cb 0.27 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 1ysm h LEU 5 CO 0.01 0.02 -0.25 -0.08 0.09 0.00 0.00 178.44 178.23 1ysm h GLU 6 N 0.22 -0.42 -0.35 1.13 4.81 -0.55 0.11 114.58 119.53 1ysm h GLU 6 Ca 0.24 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.52 1ysm h GLU 6 Cb 0.32 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1ysm h GLU 6 CO -0.32 -0.28 0.18 0.93 -0.73 0.00 0.00 179.01 178.79 1ysm h GLU 7 N -0.43 0.37 -0.43 1.92 4.39 -0.39 0.15 114.58 120.15 1ysm h GLU 7 Ca 0.04 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.73 1ysm h GLU 7 Cb 0.48 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 1ysm h GLU 7 CO -0.17 0.24 0.27 -0.07 -1.16 0.00 0.00 179.01 178.12 1ysm h LEU 8 N 0.38 0.45 -0.55 1.33 3.38 -0.67 0.51 115.31 120.14 1ysm h LEU 8 Ca 0.15 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1ysm h LEU 8 Cb 0.04 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ysm h LEU 8 CO -0.09 0.33 0.31 -0.61 0.09 0.00 0.00 178.44 178.46 1ysm h GLN 9 N 0.55 0.59 -0.34 1.13 4.15 -0.34 0.13 115.11 120.98 1ysm h GLN 9 Ca 0.16 -0.04 0.05 0.00 0.77 0.00 0.00 58.65 59.60 1ysm h GLN 9 Cb -0.03 -0.13 -0.04 0.00 0.21 0.00 0.00 27.48 27.48 1ysm h GLN 9 CO -0.06 0.39 0.07 -0.22 -1.93 0.00 0.00 178.83 177.08 1ysm h LYS 10 N 0.61 0.18 -0.63 1.69 3.64 -0.18 0.82 116.57 122.70 1ysm h LYS 10 Ca 0.23 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1ysm h LYS 10 Cb 0.08 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1ysm h LYS 10 CO -0.13 0.12 0.39 0.22 -2.27 0.00 0.00 179.45 177.79 1ysm h ASP 11 N 0.19 0.74 -0.44 4.20 3.58 -0.06 0.19 116.42 124.82 1ysm h ASP 11 Ca 0.16 -0.03 0.06 0.00 0.42 0.00 0.00 57.03 57.64 1ysm h ASP 11 Cb 0.18 -0.19 -0.05 0.00 1.72 0.00 0.00 39.33 40.99 1ysm h ASP 11 CO -0.21 0.56 0.15 0.25 -2.88 0.00 0.00 179.24 177.11 1ysm h LEU 12 N 0.86 0.15 -0.41 2.28 6.46 0.20 0.57 115.31 125.42 1ysm h LEU 12 Ca 0.23 0.05 0.01 0.00 -0.12 0.00 0.00 57.88 58.05 1ysm h LEU 12 Cb -0.06 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 39.89 1ysm h LEU 12 CO -0.05 0.12 0.27 -0.08 -0.62 0.00 0.00 178.44 178.08 1ysm h GLU 13 N 0.32 0.53 0.01 1.25 4.81 0.11 -1.48 114.58 120.13 1ysm h GLU 13 Ca 0.21 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1ysm h GLU 13 Cb 0.21 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 1ysm h GLU 13 CO -0.22 0.35 -0.17 0.93 -0.73 0.00 0.00 179.01 179.18 1ysm h GLU 14 N 0.54 -0.27 -0.46 1.92 5.08 0.05 0.11 114.58 121.55 1ysm h GLU 14 Ca 0.15 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.58 1ysm h GLU 14 Cb -0.05 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1ysm h GLU 14 CO -0.04 -0.18 0.22 -0.24 -1.00 0.00 0.00 179.01 177.77 1ysm h VAL 15 N -0.28 0.94 0.36 3.13 3.04 -0.76 0.77 116.25 123.46 1ysm h VAL 15 Ca 0.05 -0.15 -0.00 0.00 -1.01 0.00 0.00 66.70 65.59 1ysm h VAL 15 Cb 0.34 0.47 -0.03 0.00 -2.01 0.00 0.00 31.29 30.06 1ysm h VAL 15 CO -0.15 0.08 -0.40 0.11 -1.01 0.00 0.00 177.57 176.20 1ysm h LYS 16 N 0.44 -0.76 -0.11 4.17 1.57 -0.80 0.90 116.57 121.98 1ysm h LYS 16 Ca 0.20 0.05 0.04 0.00 -1.87 0.00 0.00 60.65 59.08 1ysm h LYS 16 Cb 0.13 0.17 -0.06 0.00 0.08 0.00 0.00 32.23 32.55 1ysm h LYS 16 CO -0.15 -0.51 -0.27 0.28 -0.57 0.00 0.00 179.45 178.23 1ysm h VAL 17 N -0.79 0.38 -0.40 0.50 2.07 -0.50 0.36 116.25 117.87 1ysm h VAL 17 Ca -0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.51 1ysm h VAL 17 Cb 0.72 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1ysm h VAL 17 CO -0.09 0.00 0.23 -0.07 0.02 0.00 0.00 177.57 177.66 1ysm h LEU 18 N -0.35 0.36 -0.23 2.57 3.38 -0.76 -0.11 115.31 120.17 1ysm h LEU 18 Ca 0.09 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.11 1ysm h LEU 18 Cb 0.49 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1ysm h LEU 18 CO -0.31 0.26 0.02 0.25 0.09 0.00 0.00 178.44 178.76 1ysm h LEU 19 N 0.46 -0.04 0.32 1.67 6.46 -0.21 0.28 115.31 124.25 1ysm h LEU 19 Ca 0.16 0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 57.95 1ysm h LEU 19 Cb 0.02 0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 1ysm h LEU 19 CO -0.08 0.01 -0.15 -0.33 -0.62 0.00 0.00 178.44 177.27 1ysm h GLU 20 N 0.11 -0.41 0.03 1.25 5.08 -0.69 -3.27 114.58 116.69 1ysm h GLU 20 Ca 0.11 0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1ysm h GLU 20 Cb 0.12 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1ysm h GLU 20 CO -0.16 -0.24 -0.02 0.87 -1.00 0.00 0.00 179.01 178.46 1ysm h LYS 21 N -0.47 -0.04 -1.98 2.33 1.57 -0.85 -3.28 116.57 113.84 1ysm h LYS 21 Ca -0.04 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.49 1ysm h LYS 21 Cb 0.36 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.59 1ysm h LYS 21 CO 0.07 0.24 -0.13 0.43 -0.57 0.00 0.00 179.45 179.49 1ysm n SER 22 N -4.98 5.59 -0.84 0.86 7.64 0.96 -4.75 113.62 118.11 1ysm n SER 22 Ca -0.08 -2.67 0.00 0.00 1.01 0.00 0.00 58.87 57.13 1ysm n SER 22 Cb 0.17 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 1ysm n SER 22 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1ysm n THR 23 N 1.92 0.40 -0.11 0.44 -2.24 -1.24 -3.59 114.28 109.86 1ysm n THR 23 Ca 0.39 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.95 1ysm n THR 23 Cb 0.77 -0.64 -0.11 0.00 -2.10 0.00 0.00 70.33 68.25 1ysm n THR 23 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ysm n ARG 24 N 0.55 0.57 0.00 -0.78 5.12 -1.26 -4.96 116.66 115.90 1ysm n ARG 24 Ca 0.00 0.57 0.00 0.00 -1.93 0.00 0.00 57.85 56.49 1ysm n ARG 24 Cb 0.25 -1.74 0.00 0.00 -1.16 0.00 0.00 32.46 29.81 1ysm n ARG 24 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1ysm n LYS 25 N -4.43 0.00 -0.31 5.56 4.81 -1.25 -4.96 118.16 117.58 1ysm n LYS 25 Ca -0.33 0.00 0.35 0.00 -0.87 0.00 0.00 58.31 57.46 1ysm n LYS 25 Cb 0.69 0.00 0.63 0.00 0.02 0.00 0.00 35.03 36.37 1ysm n LYS 25 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ysm h ARG 26 N 0.00 0.00 -0.96 1.64 2.47 -1.93 -0.12 114.38 115.48 1ysm h ARG 26 Ca 0.00 0.00 0.16 0.00 -1.26 0.00 0.00 59.98 58.88 1ysm h ARG 26 Cb 0.00 0.00 -0.16 0.00 -1.65 0.00 0.00 29.97 28.16 1ysm h ARG 26 CO 0.00 0.00 -0.34 1.28 0.56 0.00 0.00 179.97 181.47 1ysm n LEU 27 N -3.64 -0.56 0.32 3.04 4.32 -1.24 -0.58 117.00 118.68 1ysm n LEU 27 Ca 0.27 1.67 -0.18 0.00 -0.02 0.00 0.00 56.01 57.75 1ysm n LEU 27 Cb 1.47 -0.41 -0.09 0.00 -1.62 0.00 0.00 43.42 42.77 1ysm n LEU 27 CO 0.32 -1.53 0.58 0.03 -1.22 0.00 0.00 177.39 175.58 1ysm h ARG 28 N 0.00 -0.93 0.01 3.23 3.08 -1.39 0.54 114.38 118.92 1ysm h ARG 28 Ca 0.37 0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.50 1ysm h ARG 28 Cb 0.61 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1ysm h ARG 28 CO -0.96 -0.62 -0.11 -0.44 -1.07 0.00 0.00 179.97 176.76 1ysm h ASP 29 N -0.97 -0.33 0.32 7.04 5.19 -1.50 -0.03 116.42 126.15 1ysm h ASP 29 Ca -0.07 0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.38 1ysm h ASP 29 Cb 0.81 0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.46 1ysm h ASP 29 CO 0.02 -0.16 -0.16 0.71 -3.12 0.00 0.00 179.24 176.53 1ysm h THR 30 N -0.20 0.70 -0.12 0.35 1.35 -0.83 0.43 112.91 114.58 1ysm h THR 30 Ca 0.04 -0.25 0.02 0.00 -0.55 0.00 0.00 66.41 65.68 1ysm h THR 30 Cb 0.25 0.83 -0.05 0.00 -1.73 0.00 0.00 68.15 67.45 1ysm h THR 30 CO -0.11 0.05 -0.44 0.25 -0.25 0.00 0.00 175.52 175.02 1ysm h LEU 31 N -0.57 -1.40 0.30 3.87 7.12 -0.67 0.26 115.31 124.22 1ysm h LEU 31 Ca -0.04 0.17 -0.01 0.00 0.13 0.00 0.00 57.88 58.12 1ysm h LEU 31 Cb 0.42 0.55 -0.01 0.00 -0.53 0.00 0.00 40.66 41.09 1ysm h LEU 31 CO 0.07 -0.39 -0.23 0.71 -0.13 0.00 0.00 178.44 178.48 1ysm h THR 32 N -0.46 0.00 0.13 1.05 1.35 -1.00 -0.99 112.91 112.99 1ysm h THR 32 Ca 0.03 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.88 1ysm h THR 32 Cb 0.54 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.97 1ysm h THR 32 CO -0.36 0.00 -0.06 0.28 -0.25 0.00 0.00 175.52 175.13 1ysm h SER 33 N -0.51 -0.15 -0.25 5.36 0.02 -0.83 0.27 113.55 117.45 1ysm h SER 33 Ca -0.04 -0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.76 1ysm h SER 33 Cb 0.43 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 1ysm h SER 33 CO 0.01 -0.07 -0.29 -0.08 -1.14 0.00 0.00 176.83 175.27 1ysm h GLU 34 N -0.22 0.64 -0.48 3.45 4.81 -0.57 0.20 114.58 122.41 1ysm h GLU 34 Ca -0.02 -0.35 0.02 0.00 -0.13 0.00 0.00 59.36 58.88 1ysm h GLU 34 Cb 0.18 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 1ysm h GLU 34 CO 0.03 0.96 0.29 -0.22 -0.73 0.00 0.00 179.01 179.33 1ysm h LYS 35 N 0.35 0.56 -0.31 1.92 3.64 -1.13 0.10 116.57 121.71 1ysm h LYS 35 Ca 0.04 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1ysm h LYS 35 Cb 0.86 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.51 1ysm h LYS 35 CO 0.07 0.37 0.01 0.77 -2.27 0.00 0.00 179.45 178.39 1ysm h SER 36 N 0.57 -0.11 -0.21 4.20 0.02 -0.63 0.59 113.55 117.98 1ysm h SER 36 Ca 0.19 0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.26 1ysm h SER 36 Cb 0.01 0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.62 1ysm h SER 36 CO -0.08 -0.02 -0.10 0.11 -1.14 0.00 0.00 176.83 175.60 1ysm h LYS 37 N 0.10 -0.07 0.06 3.45 1.79 -0.47 0.14 116.57 121.56 1ysm h LYS 37 Ca 0.15 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.65 1ysm h LYS 37 Cb 0.19 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.81 1ysm h LYS 37 CO -0.24 -0.05 -0.34 0.82 -1.08 0.00 0.00 179.45 178.56 1ysm h ILE 38 N -0.07 0.28 -0.28 1.86 2.04 -0.36 0.58 117.51 121.57 1ysm h ILE 38 Ca 0.11 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.01 1ysm h ILE 38 Cb 0.24 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 1ysm h ILE 38 CO -0.26 0.00 0.08 -0.33 0.00 0.00 0.00 178.15 177.64 1ysm h GLU 39 N -0.53 0.19 -0.00 2.37 5.08 -0.64 0.14 114.58 121.19 1ysm h GLU 39 Ca 0.04 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1ysm h GLU 39 Cb 0.59 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 1ysm h GLU 39 CO -0.24 0.13 -0.22 1.15 -1.00 0.00 0.00 179.01 178.83 1ysm h THR 40 N 0.19 0.48 -0.51 1.13 2.02 -0.44 0.25 112.91 116.04 1ysm h THR 40 Ca 0.12 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.21 1ysm h THR 40 Cb 0.11 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 1ysm h THR 40 CO -0.14 0.00 -0.07 -0.33 0.37 0.00 0.00 175.52 175.35 1ysm h GLU 41 N -0.35 0.93 0.10 6.66 4.39 -0.54 0.77 114.58 126.54 1ysm h GLU 41 Ca 0.06 -0.31 0.02 0.00 0.34 0.00 0.00 59.36 59.47 1ysm h GLU 41 Cb 0.43 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 1ysm h GLU 41 CO -0.20 0.96 -0.24 1.25 -1.16 0.00 0.00 179.01 179.62 1ysm h LEU 42 N 0.84 -0.68 -0.50 1.33 5.85 -0.43 0.13 115.31 121.85 1ysm h LEU 42 Ca 0.14 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.97 1ysm h LEU 42 Cb 0.60 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 1ysm h LEU 42 CO 0.04 -0.33 0.30 0.50 -0.34 0.00 0.00 178.44 178.61 1ysm h LYS 43 N -0.43 0.58 0.19 1.25 1.63 -0.66 0.28 116.57 119.41 1ysm h LYS 43 Ca 0.03 -0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.81 1ysm h LYS 43 Cb 0.46 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.93 1ysm h LYS 43 CO -0.15 0.38 -0.33 -0.97 -3.45 0.00 0.00 179.45 174.93 1ysm h ASN 44 N 0.60 -0.94 0.15 4.20 -1.24 -0.65 0.26 115.58 117.96 1ysm h ASN 44 Ca 0.20 0.10 -0.03 0.00 0.71 0.00 0.00 56.30 57.28 1ysm h ASN 44 Cb 0.01 0.34 -0.00 0.00 0.73 0.00 0.00 38.32 39.40 1ysm h ASN 44 CO -0.09 -0.44 -0.15 0.11 -1.29 0.00 0.00 177.43 175.58 1ysm h LYS 45 N -0.60 0.00 0.00 6.67 1.79 -0.30 -1.60 116.57 122.53 1ysm h LYS 45 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1ysm h LYS 45 Cb 0.60 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1ysm h LYS 45 CO -0.15 0.15 0.00 -1.33 -1.08 0.00 0.00 179.45 177.04 1ysm n MET 46 N -4.36 0.00 -2.26 3.15 2.81 0.05 -4.35 117.12 112.15 1ysm n MET 46 Ca -0.03 0.37 -0.41 0.00 -1.81 0.00 0.00 57.70 55.82 1ysm n MET 46 Cb 0.21 -1.12 0.00 0.00 -0.71 0.00 0.00 33.22 31.61 1ysm n MET 46 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ysm n GLN 47 N -1.60 4.20 -1.67 0.03 -0.00 0.06 -4.97 117.38 113.44 1ysm n GLN 47 Ca 0.00 -3.65 -0.46 0.00 -0.00 0.00 0.00 57.00 52.89 1ysm n GLN 47 Cb 0.00 -2.74 -0.04 0.00 -0.00 0.00 0.00 30.24 27.46 1ysm n GLN 47 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1ysm n GLN 48 N 2.54 2.41 -1.97 2.61 6.02 -0.61 -0.01 117.38 128.37 1ysm n GLN 48 Ca 0.48 0.87 -0.20 0.00 -0.01 0.00 0.00 57.00 58.15 1ysm n GLN 48 Cb 0.31 -2.81 -0.05 0.00 1.02 0.00 0.00 30.24 28.71 1ysm n GLN 48 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1ysm n LYS 49 N 7.13 -1.59 0.00 -1.09 5.02 -1.26 -2.97 118.16 123.41 1ysm n LYS 49 Ca 0.22 1.07 0.00 0.00 -2.02 0.00 0.00 58.31 57.58 1ysm n LYS 49 Cb 0.34 -5.58 0.00 0.00 -0.02 0.00 0.00 35.03 29.78 1ysm n LYS 49 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1ysm n SER 50 N -1.60 0.00 -4.00 4.39 7.64 0.99 -4.78 113.62 116.26 1ysm n SER 50 Ca -0.22 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.58 1ysm n SER 50 Cb 0.66 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.76 1ysm n SER 50 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1ysm s GLN 51 N 0.00 0.39 -1.20 1.43 0.74 -1.16 -4.85 119.66 115.02 1ysm s GLN 51 Ca 0.00 -0.76 -0.12 0.00 0.05 0.00 0.00 55.36 54.53 1ysm s GLN 51 Cb 0.00 0.14 -0.06 0.00 1.10 0.00 0.00 33.01 34.18 1ysm s GLN 51 CO 0.00 -0.07 2.33 1.63 -0.55 0.00 0.00 175.29 178.63 1ysm n LYS 52 N 1.21 2.57 -4.36 1.67 4.76 -1.26 -4.84 118.16 117.91 1ysm n LYS 52 Ca -0.21 -1.99 -0.26 0.00 -2.87 0.00 0.00 58.31 52.97 1ysm n LYS 52 Cb 0.57 -2.83 -0.10 0.00 -1.84 0.00 0.00 35.03 30.83 1ysm n LYS 52 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1ysm s LYS 53 N 3.36 1.82 -0.84 1.97 -2.85 -1.26 -5.04 119.74 116.90 1ysm s LYS 53 Ca 0.53 -1.43 -0.21 0.00 -1.00 0.00 0.00 55.97 53.85 1ysm s LYS 53 Cb 0.14 -1.99 -0.14 0.00 -2.06 0.00 0.00 37.83 33.78 1ysm s LYS 53 CO -0.02 0.41 1.95 -0.35 0.10 0.00 0.00 175.35 177.43 1ysm n PRO 54 N 0.01 1.61 -0.26 1.78 -0.04 -1.26 -5.01 135.00 131.84 1ysm n PRO 54 Ca -0.11 -1.93 0.00 0.00 -0.04 0.00 0.00 63.50 61.42 1ysm n PRO 54 Cb 0.56 -2.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.04 1ysm n PRO 54 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55