#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 1.46 -0.42 -5.12 0.00 -2.05 0.17 119.26 113.29 1ysm h ALA 2 Ca 0.00 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.02 1ysm h ALA 2 Cb 0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 17.79 17.50 1ysm h ALA 2 CO 0.00 0.22 -0.25 0.66 0.00 0.00 0.00 179.25 179.87 1ysm h SER 3 N 0.97 -0.86 -0.37 0.00 4.64 -2.05 0.85 113.55 116.74 1ysm h SER 3 Ca 0.48 0.18 -0.14 0.00 -0.47 0.00 0.00 61.79 61.83 1ysm h SER 3 Cb 0.46 0.43 -0.01 0.00 -0.31 0.00 0.00 62.40 62.97 1ysm h SER 3 CO -0.26 -0.27 -0.31 0.58 -0.87 0.00 0.00 176.83 175.69 1ysm h VAL 4 N -0.17 1.27 -0.39 0.95 2.07 -1.46 0.27 116.25 118.78 1ysm h VAL 4 Ca 0.20 -1.48 0.06 0.00 0.82 0.00 0.00 66.70 66.30 1ysm h VAL 4 Cb 0.49 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.50 1ysm h VAL 4 CO -0.53 0.50 0.07 -0.07 0.02 0.00 0.00 177.57 177.56 1ysm h LEU 5 N 0.75 -0.01 -0.11 2.57 3.38 -0.31 0.14 115.31 121.73 1ysm h LEU 5 Ca 0.08 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.15 1ysm h LEU 5 Cb 0.88 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.70 1ysm h LEU 5 CO 0.08 0.03 -0.10 -0.08 0.09 0.00 0.00 178.44 178.47 1ysm h GLU 6 N 0.20 -0.11 -0.19 1.13 4.81 -0.51 0.50 114.58 120.41 1ysm h GLU 6 Ca 0.19 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.48 1ysm h GLU 6 Cb 0.23 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.57 1ysm h GLU 6 CO -0.26 -0.07 -0.42 1.49 -0.73 0.00 0.00 179.01 179.02 1ysm h GLU 7 N -0.12 -0.44 -0.38 1.92 4.22 -0.44 0.58 114.58 119.93 1ysm h GLU 7 Ca 0.07 0.03 0.03 0.00 0.08 0.00 0.00 59.36 59.57 1ysm h GLU 7 Cb 0.22 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 1ysm h GLU 7 CO -0.18 -0.29 0.20 -0.07 -2.18 0.00 0.00 179.01 176.49 1ysm h LEU 8 N -0.45 0.30 -0.14 1.64 3.38 -0.39 0.13 115.31 119.78 1ysm h LEU 8 Ca 0.09 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1ysm h LEU 8 Cb 0.61 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1ysm h LEU 8 CO -0.43 0.22 0.02 -0.61 0.09 0.00 0.00 178.44 177.73 1ysm h GLN 9 N 0.41 0.08 -0.64 1.13 4.15 -0.53 0.16 115.11 119.86 1ysm h GLN 9 Ca 0.16 -0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.61 1ysm h GLN 9 Cb 0.05 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.68 1ysm h GLN 9 CO -0.10 0.05 0.39 -0.22 -1.93 0.00 0.00 178.83 177.02 1ysm h LYS 10 N 0.08 0.74 -0.66 1.69 1.63 -0.38 0.56 116.57 120.23 1ysm h LYS 10 Ca 0.06 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.83 1ysm h LYS 10 Cb 0.06 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.48 1ysm h LYS 10 CO -0.08 0.49 0.43 0.22 -3.45 0.00 0.00 179.45 177.05 1ysm h ASP 11 N 0.76 0.74 -0.02 4.20 3.58 -0.29 0.14 116.42 125.53 1ysm h ASP 11 Ca 0.26 -0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.73 1ysm h ASP 11 Cb 0.04 -0.18 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 1ysm h ASP 11 CO -0.11 0.53 -0.22 0.25 -2.88 0.00 0.00 179.24 176.80 1ysm h LEU 12 N 0.87 -0.67 -0.57 2.28 6.46 -0.00 -0.25 115.31 123.43 1ysm h LEU 12 Ca 0.25 0.10 0.08 0.00 -0.12 0.00 0.00 57.88 58.18 1ysm h LEU 12 Cb -0.07 0.28 -0.06 0.00 -0.73 0.00 0.00 40.66 40.07 1ysm h LEU 12 CO -0.07 -0.29 0.22 -0.08 -0.62 0.00 0.00 178.44 177.61 1ysm h GLU 13 N -0.34 0.40 0.11 1.25 4.81 -0.35 0.39 114.58 120.85 1ysm h GLU 13 Ca 0.07 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1ysm h GLU 13 Cb 0.43 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 1ysm h GLU 13 CO -0.22 0.27 -0.17 1.49 -0.73 0.00 0.00 179.01 179.64 1ysm h GLU 14 N 0.42 -0.33 -0.83 1.92 4.57 -0.11 0.55 114.58 120.77 1ysm h GLU 14 Ca 0.28 0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.49 1ysm h GLU 14 Cb 0.31 0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.93 1ysm h GLU 14 CO -0.27 -0.22 0.55 -0.24 -1.18 0.00 0.00 179.01 177.65 1ysm h VAL 15 N -0.34 1.19 -0.09 0.32 3.04 -0.60 -0.59 116.25 119.19 1ysm h VAL 15 Ca 0.02 -0.38 0.04 0.00 -1.01 0.00 0.00 66.70 65.37 1ysm h VAL 15 Cb 0.36 -0.01 -0.05 0.00 -2.01 0.00 0.00 31.29 29.58 1ysm h VAL 15 CO -0.09 0.20 -0.22 0.11 -1.01 0.00 0.00 177.57 176.56 1ysm h LYS 16 N 1.11 -0.28 -0.20 4.17 1.79 -0.34 0.33 116.57 123.14 1ysm h LYS 16 Ca 0.31 0.02 0.06 0.00 -2.18 0.00 0.00 60.65 58.86 1ysm h LYS 16 Cb -0.10 0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 30.55 1ysm h LYS 16 CO -0.08 -0.19 -0.27 0.28 -1.08 0.00 0.00 179.45 178.11 1ysm h VAL 17 N -0.30 0.35 -0.81 0.50 2.07 -0.47 0.26 116.25 117.87 1ysm h VAL 17 Ca 0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 1ysm h VAL 17 Cb 0.42 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 1ysm h VAL 17 CO -0.26 0.00 0.49 -0.07 0.02 0.00 0.00 177.57 177.75 1ysm h LEU 18 N -0.30 0.96 -0.32 2.57 3.38 -0.70 -1.24 115.31 119.66 1ysm h LEU 18 Ca 0.12 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1ysm h LEU 18 Cb 0.49 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1ysm h LEU 18 CO -0.37 0.74 0.15 0.25 0.09 0.00 0.00 178.44 179.30 1ysm h LEU 19 N 1.10 0.21 -0.06 1.67 5.85 0.36 0.19 115.31 124.63 1ysm h LEU 19 Ca 0.29 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 1ysm h LEU 19 Cb -0.05 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 1ysm h LEU 19 CO -0.06 0.16 0.04 -0.33 -0.34 0.00 0.00 178.44 177.91 1ysm h GLU 20 N 0.32 0.08 0.04 1.25 5.08 -0.69 -3.39 114.58 117.27 1ysm h GLU 20 Ca 0.14 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1ysm h GLU 20 Cb 0.06 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ysm h GLU 20 CO -0.10 0.09 -0.02 0.87 -1.00 0.00 0.00 179.01 178.85 1ysm h LYS 21 N 0.05 -0.05 -3.21 2.33 1.57 -0.77 -3.40 116.57 113.09 1ysm h LYS 21 Ca 0.02 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.14 1ysm h LYS 21 Cb 0.03 0.01 0.02 0.00 0.08 0.00 0.00 32.23 32.37 1ysm h LYS 21 CO -0.00 -0.03 3.69 0.43 -0.57 0.00 0.00 179.45 182.96 1ysm n SER 22 N -3.67 7.72 0.32 0.86 7.64 0.61 -4.73 113.62 122.36 1ysm n SER 22 Ca -0.01 -2.61 0.08 0.00 1.01 0.00 0.00 58.87 57.34 1ysm n SER 22 Cb 0.02 -1.56 0.44 0.00 -1.01 0.00 0.00 64.21 62.10 1ysm n SER 22 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ysm h THR 23 N 3.21 0.00 0.00 0.44 1.35 -1.78 -3.33 112.91 112.80 1ysm h THR 23 Ca 0.81 0.00 -0.57 0.00 -0.55 0.00 0.00 66.41 66.10 1ysm h THR 23 Cb 0.35 0.36 0.02 0.00 -1.73 0.00 0.00 68.15 67.14 1ysm h THR 23 CO 1.80 0.00 2.73 0.54 -0.25 0.00 0.00 175.52 180.34 1ysm n ARG 24 N -2.64 2.18 0.00 4.72 3.00 -1.26 -4.62 116.66 118.04 1ysm n ARG 24 Ca -0.01 -1.88 0.00 0.00 -0.01 0.00 0.00 57.85 55.94 1ysm n ARG 24 Cb 0.63 -2.81 0.00 0.00 0.00 0.00 0.00 32.46 30.28 1ysm n ARG 24 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1ysm n LYS 25 N 5.52 0.00 -0.19 5.56 4.01 -1.26 -4.73 118.16 127.07 1ysm n LYS 25 Ca 0.52 0.00 0.19 0.00 -0.51 0.00 0.00 58.31 58.50 1ysm n LYS 25 Cb 0.29 -0.13 0.34 0.00 -0.51 0.00 0.00 35.03 35.02 1ysm n LYS 25 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1ysm n ARG 26 N 0.00 -0.04 -0.28 1.97 5.12 -1.26 -0.62 116.66 121.56 1ysm n ARG 26 Ca 0.00 0.82 -0.03 0.00 -1.93 0.00 0.00 57.85 56.71 1ysm n ARG 26 Cb 0.00 -1.47 -0.00 0.00 -1.16 0.00 0.00 32.46 29.83 1ysm n ARG 26 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1ysm n LEU 27 N -4.36 -0.54 0.32 0.55 4.32 -1.25 -0.27 117.00 115.77 1ysm n LEU 27 Ca 0.22 1.22 -0.15 0.00 -0.02 0.00 0.00 56.01 57.28 1ysm n LEU 27 Cb 0.75 -0.24 -0.08 0.00 -1.62 0.00 0.00 43.42 42.24 1ysm n LEU 27 CO 0.00 -1.06 0.52 -0.09 -1.22 0.00 0.00 177.39 175.55 1ysm h ARG 28 N 0.00 -0.88 -0.11 3.23 9.65 -1.26 0.10 114.38 125.11 1ysm h ARG 28 Ca 0.20 0.06 0.05 0.00 -1.10 0.00 0.00 59.98 59.18 1ysm h ARG 28 Cb 0.37 0.20 -0.06 0.00 -1.39 0.00 0.00 29.97 29.09 1ysm h ARG 28 CO -0.68 -0.59 -0.29 -0.44 2.80 0.00 0.00 179.97 180.77 1ysm h ASP 29 N -0.91 -0.90 0.02 -3.80 5.19 -1.54 -0.71 116.42 113.76 1ysm h ASP 29 Ca -0.08 0.13 0.01 0.00 -0.62 0.00 0.00 57.03 56.47 1ysm h ASP 29 Cb 0.74 0.38 -0.01 0.00 0.18 0.00 0.00 39.33 40.62 1ysm h ASP 29 CO 0.07 -0.34 -0.06 0.74 -3.12 0.00 0.00 179.24 176.53 1ysm h THR 30 N -0.38 0.84 0.21 0.35 2.02 -0.62 -0.03 112.91 115.31 1ysm h THR 30 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.27 1ysm h THR 30 Cb 0.52 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1ysm h THR 30 CO -0.32 0.00 -0.18 0.25 0.37 0.00 0.00 175.52 175.63 1ysm h LEU 31 N -0.12 -0.48 -0.10 2.58 7.12 -0.48 0.11 115.31 123.94 1ysm h LEU 31 Ca 0.02 0.04 0.04 0.00 0.13 0.00 0.00 57.88 58.12 1ysm h LEU 31 Cb 0.14 0.16 -0.06 0.00 -0.53 0.00 0.00 40.66 40.37 1ysm h LEU 31 CO -0.05 -0.28 -0.32 0.74 -0.13 0.00 0.00 178.44 178.39 1ysm h THR 32 N -0.42 0.29 0.49 1.05 2.02 -0.95 0.80 112.91 116.19 1ysm h THR 32 Ca -0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 1ysm h THR 32 Cb 0.38 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1ysm h THR 32 CO -0.03 0.00 -0.29 0.28 0.37 0.00 0.00 175.52 175.85 1ysm h SER 33 N -0.41 -0.73 -0.32 4.18 0.02 -0.74 -0.30 113.55 115.24 1ysm h SER 33 Ca 0.09 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 1ysm h SER 33 Cb 0.55 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.29 1ysm h SER 33 CO -0.33 -0.47 0.13 -0.08 -1.14 0.00 0.00 176.83 174.93 1ysm h GLU 34 N -0.75 0.48 -0.26 3.45 4.57 -0.64 -0.25 114.58 121.19 1ysm h GLU 34 Ca -0.06 -0.09 0.06 0.00 -1.18 0.00 0.00 59.36 58.09 1ysm h GLU 34 Cb 0.61 -0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 29.06 1ysm h GLU 34 CO 0.06 0.49 -0.15 -0.22 -1.18 0.00 0.00 179.01 178.02 1ysm h LYS 35 N 0.37 -0.12 0.05 1.92 3.64 -0.78 0.13 116.57 121.78 1ysm h LYS 35 Ca 0.11 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1ysm h LYS 35 Cb 0.19 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 1ysm h LYS 35 CO -0.01 -0.08 -0.22 0.77 -2.27 0.00 0.00 179.45 177.64 1ysm h SER 36 N -0.12 -0.64 0.13 4.20 0.02 -0.50 0.29 113.55 116.92 1ysm h SER 36 Ca 0.14 0.08 0.02 0.00 -0.84 0.00 0.00 61.79 61.19 1ysm h SER 36 Cb 0.33 0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.09 1ysm h SER 36 CO -0.33 -0.30 -0.33 0.11 -1.14 0.00 0.00 176.83 174.84 1ysm h LYS 37 N -0.38 -0.54 -0.13 3.45 6.56 -0.67 0.11 116.57 124.97 1ysm h LYS 37 Ca 0.05 0.04 0.05 0.00 -1.06 0.00 0.00 60.65 59.72 1ysm h LYS 37 Cb 0.43 0.12 -0.06 0.00 -0.57 0.00 0.00 32.23 32.15 1ysm h LYS 37 CO -0.17 -0.36 -0.32 0.82 -2.06 0.00 0.00 179.45 177.36 1ysm h ILE 38 N -0.56 0.28 -0.17 1.86 2.04 -0.54 0.77 117.51 121.19 1ysm h ILE 38 Ca 0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.91 1ysm h ILE 38 Cb 0.58 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1ysm h ILE 38 CO -0.19 0.00 0.03 -0.33 0.00 0.00 0.00 178.15 177.66 1ysm h GLU 39 N -0.40 0.09 0.02 2.37 5.08 -0.78 0.54 114.58 121.51 1ysm h GLU 39 Ca 0.09 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.48 1ysm h GLU 39 Cb 0.55 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 1ysm h GLU 39 CO -0.35 0.06 -0.31 1.15 -1.00 0.00 0.00 179.01 178.56 1ysm h THR 40 N 0.10 0.32 0.41 1.13 2.02 -0.20 0.71 112.91 117.40 1ysm h THR 40 Ca 0.08 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 1ysm h THR 40 Cb 0.07 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1ysm h THR 40 CO -0.10 0.00 -0.35 -0.33 0.37 0.00 0.00 175.52 175.10 1ysm h GLU 41 N -0.47 -0.74 -0.35 6.66 5.08 -0.68 0.17 114.58 124.24 1ysm h GLU 41 Ca 0.06 0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.54 1ysm h GLU 41 Cb 0.55 0.17 -0.09 0.00 0.50 0.00 0.00 28.75 29.88 1ysm h GLU 41 CO -0.24 -0.49 -0.27 1.25 -1.00 0.00 0.00 179.01 178.25 1ysm h LEU 42 N -0.77 -0.91 0.50 1.33 5.85 -0.68 -0.41 115.31 120.22 1ysm h LEU 42 Ca -0.04 0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1ysm h LEU 42 Cb 0.67 0.44 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1ysm h LEU 42 CO -0.03 -0.29 -0.24 0.50 -0.34 0.00 0.00 178.44 178.04 1ysm h LYS 43 N -0.23 -0.64 -0.55 1.25 1.63 -0.78 -3.26 116.57 113.99 1ysm h LYS 43 Ca 0.17 0.04 0.11 0.00 -0.85 0.00 0.00 60.65 60.13 1ysm h LYS 43 Cb 0.50 0.15 -0.10 0.00 -0.60 0.00 0.00 32.23 32.18 1ysm h LYS 43 CO -0.49 -0.40 -0.08 -0.97 -3.45 0.00 0.00 179.45 174.06 1ysm h ASN 44 N -0.73 -0.40 0.15 4.20 -1.24 -0.00 0.13 115.58 117.69 1ysm h ASN 44 Ca -0.07 0.15 -0.02 0.00 0.71 0.00 0.00 56.30 57.07 1ysm h ASN 44 Cb 0.54 0.30 -0.00 0.00 0.73 0.00 0.00 38.32 39.89 1ysm h ASN 44 CO 0.11 -0.15 -0.12 0.07 -1.29 0.00 0.00 177.43 176.06 1ysm h LYS 45 N 0.04 0.00 0.00 6.67 2.10 -1.16 -2.94 116.57 121.28 1ysm h LYS 45 Ca 0.27 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.92 1ysm h LYS 45 Cb 0.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 1ysm h LYS 45 CO -0.53 0.12 -0.00 0.52 -2.00 0.00 0.00 179.45 177.56 1ysm h MET 46 N 0.00 0.00 -5.12 0.07 2.86 -1.01 -3.46 114.93 108.27 1ysm h MET 46 Ca -0.00 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.97 1ysm h MET 46 Cb 0.22 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 31.56 1ysm h MET 46 CO 0.02 0.00 -0.83 1.14 1.06 0.00 0.00 176.91 178.30 1ysm s GLN 47 N -1.16 3.12 -1.10 1.72 1.03 0.25 -4.94 119.66 118.58 1ysm s GLN 47 Ca -0.00 -0.78 -0.20 0.00 0.04 0.00 0.00 55.36 54.42 1ysm s GLN 47 Cb 0.00 -2.62 -0.06 0.00 0.03 0.00 0.00 33.01 30.36 1ysm s GLN 47 CO 0.00 -0.09 1.98 1.04 -2.54 0.00 0.00 175.29 175.68 1ysm n GLN 48 N 4.34 2.11 0.00 9.60 3.00 -1.11 -3.34 117.38 131.98 1ysm n GLN 48 Ca -0.20 -2.36 0.00 0.00 -0.01 0.00 0.00 57.00 54.43 1ysm n GLN 48 Cb 0.51 -3.25 0.00 0.00 0.00 0.00 0.00 30.24 27.50 1ysm n GLN 48 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1ysm n LYS 49 N 7.22 0.00 -2.20 -1.09 5.02 -1.26 -4.80 118.16 121.05 1ysm n LYS 49 Ca 0.49 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 56.40 1ysm n LYS 49 Cb 0.42 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.42 1ysm n LYS 49 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ysm s SER 50 N 0.00 6.26 0.23 4.39 0.01 -1.26 -4.99 113.70 118.35 1ysm s SER 50 Ca 0.00 2.42 -0.30 0.00 1.31 0.00 0.00 55.95 59.38 1ysm s SER 50 Cb 0.00 -2.62 -0.10 0.00 0.21 0.00 0.00 66.02 63.51 1ysm s SER 50 CO 0.00 -0.86 1.45 -1.58 0.41 0.00 0.00 173.24 172.66 1ysm s GLN 51 N -2.47 4.27 0.93 12.44 0.74 -1.26 -4.78 119.66 129.52 1ysm s GLN 51 Ca 0.60 2.30 -0.12 0.00 0.05 0.00 0.00 55.36 58.19 1ysm s GLN 51 Cb -0.32 -3.12 0.15 0.00 1.10 0.00 0.00 33.01 30.82 1ysm s GLN 51 CO 0.40 -0.44 1.09 0.15 -0.55 0.00 0.00 175.29 175.94 1ysm s LYS 52 N -0.14 0.96 0.97 1.67 1.02 -1.26 -4.98 119.74 117.98 1ysm s LYS 52 Ca 0.61 0.89 -0.11 0.00 0.02 0.00 0.00 55.97 57.38 1ysm s LYS 52 Cb -0.42 -1.77 0.17 0.00 -0.52 0.00 0.00 37.83 35.30 1ysm s LYS 52 CO 0.41 -2.46 1.12 -1.59 -0.92 0.00 0.00 175.35 171.91 1ysm s LYS 53 N -4.85 0.61 -0.20 1.68 -2.85 -1.26 -4.84 119.74 108.03 1ysm s LYS 53 Ca 0.64 1.37 -0.19 0.00 -1.00 0.00 0.00 55.97 56.80 1ysm s LYS 53 Cb -0.19 -1.69 -0.21 0.00 -2.06 0.00 0.00 37.83 33.67 1ysm s LYS 53 CO 0.58 -2.85 1.53 -2.30 0.10 0.00 0.00 175.35 172.40 1ysm n PRO 54 N -4.37 0.42 0.00 1.78 -0.02 -1.26 -5.21 135.00 126.33 1ysm n PRO 54 Ca 0.10 -1.04 0.10 0.00 -2.02 0.00 0.00 63.50 60.64 1ysm n PRO 54 Cb 0.53 -2.43 0.58 0.00 -0.02 0.00 0.00 33.50 32.16 1ysm n PRO 54 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57