#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mxf s PRO 12 N 0.00 3.73 0.05 0.00 0.04 -1.26 -4.84 135.00 132.71 1mxf s PRO 12 Ca 0.00 1.22 0.06 0.00 0.04 0.00 0.00 61.00 62.32 1mxf s PRO 12 Cb 0.00 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 1mxf s PRO 12 CO 0.00 -0.47 -0.14 0.00 0.04 0.00 0.00 177.00 176.43 1mxf s ALA 13 N -2.26 2.77 0.02 8.56 0.00 -1.26 -0.82 121.76 128.78 1mxf s ALA 13 Ca 0.64 -1.16 0.04 0.00 0.00 0.00 0.00 51.96 51.48 1mxf s ALA 13 Cb -0.14 -0.87 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1mxf s ALA 13 CO 0.26 0.60 -0.12 0.00 0.00 0.00 0.00 175.76 176.50 1mxf s ALA 14 N -1.01 0.99 -0.18 0.00 0.00 0.53 -0.01 121.76 122.09 1mxf s ALA 14 Ca 0.17 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.43 1mxf s ALA 14 Cb -0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 1mxf s ALA 14 CO 0.08 0.19 -0.08 0.08 0.00 0.00 0.00 175.76 176.03 1mxf s VAL 15 N -0.66 3.26 -0.28 0.00 1.01 0.15 -0.32 120.40 123.55 1mxf s VAL 15 Ca 0.01 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1mxf s VAL 15 Cb -0.07 -2.43 0.06 0.00 0.00 0.00 0.00 36.38 33.94 1mxf s VAL 15 CO 0.01 0.47 -0.07 -0.63 0.00 0.00 0.00 175.10 174.88 1mxf s ILE 16 N 0.95 2.39 0.32 2.22 1.09 -0.75 -0.91 121.20 126.51 1mxf s ILE 16 Ca -0.01 -1.63 -0.28 0.00 -1.10 0.00 0.00 60.65 57.63 1mxf s ILE 16 Cb -0.15 -2.43 -0.09 0.00 -1.06 0.00 0.00 42.46 38.73 1mxf s ILE 16 CO -0.00 -0.09 1.08 0.42 -0.10 0.00 0.00 174.94 176.25 1mxf s THR 17 N 1.13 3.55 -1.60 2.92 -4.23 -1.03 -2.16 115.64 114.21 1mxf s THR 17 Ca -0.07 1.44 -0.04 0.00 -1.18 0.00 0.00 61.69 61.85 1mxf s THR 17 Cb -0.20 -3.87 0.01 0.00 1.34 0.00 0.00 72.50 69.78 1mxf s THR 17 CO -0.04 0.25 0.43 0.61 -0.54 0.00 0.00 174.62 175.33 1mxf n GLY 18 N 0.94 -0.52 0.45 3.99 0.00 -1.05 -2.51 105.19 106.49 1mxf n GLY 18 Ca 0.01 0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.16 1mxf n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mxf n GLY 19 N -1.36 0.19 0.18 -0.02 0.00 -0.75 -4.23 105.19 99.21 1mxf n GLY 19 Ca -0.15 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 1mxf n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mxf h ALA 20 N 3.35 0.47 -2.41 4.61 0.00 -1.84 -3.08 119.26 120.34 1mxf h ALA 20 Ca 0.00 -0.63 -0.41 0.00 0.00 0.00 0.00 54.91 53.87 1mxf h ALA 20 Cb 0.35 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 17.96 1mxf h ALA 20 CO 0.01 0.75 -0.56 1.03 0.00 0.00 0.00 179.25 180.49 1mxf s ARG 21 N -3.56 1.59 1.97 0.00 0.52 -1.26 -4.52 118.95 113.69 1mxf s ARG 21 Ca -0.07 -1.90 0.00 0.00 -0.52 0.00 0.00 55.73 53.24 1mxf s ARG 21 Cb 0.10 -0.05 0.00 0.00 0.52 0.00 0.00 34.95 35.51 1mxf s ARG 21 CO 0.86 -0.46 0.00 0.54 0.02 0.00 0.00 175.30 176.26 1mxf n ARG 22 N -0.57 0.00 -0.15 3.54 1.74 -1.26 -1.47 116.66 118.49 1mxf n ARG 22 Ca 0.01 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.07 1mxf n ARG 22 Cb 0.65 0.00 0.06 0.00 -1.02 0.00 0.00 32.46 32.15 1mxf n ARG 22 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1mxf h ILE 23 N 0.00 0.74 -0.75 0.55 2.04 -1.93 -1.43 117.51 116.73 1mxf h ILE 23 Ca 0.00 -0.08 0.06 0.00 1.00 0.00 0.00 64.86 65.84 1mxf h ILE 23 Cb 0.00 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 36.52 1mxf h ILE 23 CO 0.00 0.04 0.49 1.23 0.00 0.00 0.00 178.15 179.92 1mxf h GLY 24 N 0.24 1.01 0.93 5.37 0.00 -1.64 -0.45 103.07 108.53 1mxf h GLY 24 Ca 0.24 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 1mxf h GLY 24 CO -0.30 0.25 0.05 0.84 0.00 0.00 0.00 176.54 177.37 1mxf h HIS 25 N 0.81 0.70 -0.06 5.60 -0.00 -0.25 -1.45 115.15 120.50 1mxf h HIS 25 Ca 0.32 -0.10 -0.07 0.00 -0.00 0.00 0.00 60.37 60.52 1mxf h HIS 25 Cb 0.22 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.43 1mxf h HIS 25 CO -0.00 0.70 -0.27 1.03 -0.00 0.00 0.00 177.93 179.39 1mxf h SER 26 N 0.49 0.09 -0.11 3.26 0.87 -0.36 -1.79 113.55 116.00 1mxf h SER 26 Ca 0.12 -0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.55 1mxf h SER 26 Cb 0.39 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1mxf h SER 26 CO 0.01 0.37 -0.32 0.40 -0.53 0.00 0.00 176.83 176.76 1mxf h ILE 27 N 0.09 1.38 -0.68 2.23 2.04 -0.83 -1.95 117.51 119.79 1mxf h ILE 27 Ca 0.01 -1.63 0.01 0.00 1.00 0.00 0.00 64.86 64.25 1mxf h ILE 27 Cb 0.53 2.13 -0.04 0.00 -0.74 0.00 0.00 36.82 38.71 1mxf h ILE 27 CO 0.04 0.48 0.45 0.00 0.00 0.00 0.00 178.15 179.12 1mxf h ALA 28 N 0.50 0.87 -0.24 1.87 0.00 -1.04 -1.56 119.26 119.66 1mxf h ALA 28 Ca -0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1mxf h ALA 28 Cb 0.94 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1mxf h ALA 28 CO 0.07 0.27 0.01 0.28 0.00 0.00 0.00 179.25 179.88 1mxf h VAL 29 N 0.90 1.25 -0.28 0.00 2.07 -1.34 -2.19 116.25 116.66 1mxf h VAL 29 Ca 0.26 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.93 1mxf h VAL 29 Cb -0.08 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1mxf h VAL 29 CO -0.07 0.27 0.16 -0.09 0.02 0.00 0.00 177.57 177.86 1mxf h ARG 30 N 0.21 0.31 -0.80 1.57 9.65 -1.14 0.38 114.38 124.56 1mxf h ARG 30 Ca 0.07 -0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 58.90 1mxf h ARG 30 Cb 0.39 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.86 1mxf h ARG 30 CO 0.01 0.21 0.36 -0.07 2.80 0.00 0.00 179.97 183.28 1mxf h LEU 31 N 0.32 1.06 -0.64 3.80 3.38 -1.28 -2.37 115.31 119.58 1mxf h LEU 31 Ca 0.11 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1mxf h LEU 31 Cb 0.01 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1mxf h LEU 31 CO -0.06 0.91 0.21 -0.74 0.09 0.00 0.00 178.44 178.85 1mxf h HIS 32 N 1.15 1.02 0.00 1.13 2.76 -0.94 -1.24 115.15 119.02 1mxf h HIS 32 Ca 0.27 -0.10 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1mxf h HIS 32 Cb 0.15 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 28.81 1mxf h HIS 32 CO 0.02 0.82 0.00 1.04 -1.30 0.00 0.00 177.93 178.51 1mxf n GLN 33 N -4.37 0.01 -0.25 5.26 6.02 0.08 -1.61 117.38 122.53 1mxf n GLN 33 Ca 0.04 0.38 0.07 0.00 -0.01 0.00 0.00 57.00 57.49 1mxf n GLN 33 Cb 0.21 -1.50 0.20 0.00 1.02 0.00 0.00 30.24 30.17 1mxf n GLN 33 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1mxf n GLN 34 N -1.45 2.88 0.00 -1.09 6.02 -0.52 -4.95 117.38 118.27 1mxf n GLN 34 Ca 0.01 -2.25 0.00 0.00 -0.01 0.00 0.00 57.00 54.75 1mxf n GLN 34 Cb 0.05 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 29.92 1mxf n GLN 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1mxf n GLY 35 N 0.72 0.60 3.76 1.08 0.00 -0.63 -5.08 105.19 105.64 1mxf n GLY 35 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1mxf n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mxf s PHE 36 N -2.00 3.95 -0.25 1.61 0.08 -0.88 -4.25 117.98 116.23 1mxf s PHE 36 Ca 0.00 1.77 -0.12 0.00 0.12 0.00 0.00 56.93 58.70 1mxf s PHE 36 Cb 0.00 -2.87 -0.05 0.00 -0.57 0.00 0.00 43.02 39.53 1mxf s PHE 36 CO 0.00 0.49 0.24 1.03 -0.10 0.00 0.00 175.22 176.87 1mxf s ARG 37 N -1.16 4.05 0.04 0.44 0.52 0.00 -4.20 118.95 118.64 1mxf s ARG 37 Ca 0.38 -0.16 0.05 0.00 -0.52 0.00 0.00 55.73 55.48 1mxf s ARG 37 Cb -0.25 -3.58 -0.04 0.00 0.52 0.00 0.00 34.95 31.61 1mxf s ARG 37 CO 0.29 -0.06 -0.09 0.14 0.02 0.00 0.00 175.30 175.60 1mxf s VAL 38 N 1.40 3.45 -0.32 3.52 -7.23 -0.70 -0.34 120.40 120.17 1mxf s VAL 38 Ca 0.10 -0.97 -0.10 0.00 -1.81 0.00 0.00 61.98 59.20 1mxf s VAL 38 Cb -0.15 -2.53 -0.00 0.00 0.56 0.00 0.00 36.38 34.26 1mxf s VAL 38 CO 0.07 0.30 0.18 -0.69 -0.31 0.00 0.00 175.10 174.65 1mxf s VAL 39 N -1.05 4.74 -0.52 1.32 1.01 0.56 -2.03 120.40 124.42 1mxf s VAL 39 Ca 0.18 -0.43 -0.18 0.00 0.00 0.00 0.00 61.98 61.55 1mxf s VAL 39 Cb -0.11 -3.45 0.08 0.00 0.00 0.00 0.00 36.38 32.90 1mxf s VAL 39 CO 0.09 0.01 0.57 -0.69 0.00 0.00 0.00 175.10 175.09 1mxf s VAL 40 N 1.63 4.98 0.32 2.92 1.01 0.01 -1.81 120.40 129.46 1mxf s VAL 40 Ca 0.05 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 1mxf s VAL 40 Cb -0.17 -4.30 -0.08 0.00 0.00 0.00 0.00 36.38 31.83 1mxf s VAL 40 CO 0.07 -0.82 0.68 -2.28 0.00 0.00 0.00 175.10 172.75 1mxf s HIS 41 N 2.30 3.42 0.31 5.22 5.04 -0.92 -2.06 115.29 128.59 1mxf s HIS 41 Ca 0.10 1.03 -0.16 0.00 -1.54 0.00 0.00 55.06 54.50 1mxf s HIS 41 Cb -0.22 -2.40 0.02 0.00 0.04 0.00 0.00 32.58 30.01 1mxf s HIS 41 CO 0.09 0.09 0.66 1.52 -2.34 0.00 0.00 174.74 174.76 1mxf s TYR 42 N -2.05 0.15 0.01 3.88 1.13 -0.22 -1.81 117.35 118.45 1mxf s TYR 42 Ca 0.51 -0.63 0.00 0.00 -1.41 0.00 0.00 57.07 55.54 1mxf s TYR 42 Cb -0.10 0.55 0.00 0.00 -1.10 0.00 0.00 41.96 41.30 1mxf s TYR 42 CO 0.23 -1.27 0.00 -2.13 -2.51 0.00 0.00 175.55 169.87 1mxf n ARG 43 N -0.47 0.00 0.00 -3.49 0.63 -1.26 -1.48 116.66 110.59 1mxf n ARG 43 Ca -0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 1mxf n ARG 43 Cb 0.60 -0.47 0.00 0.00 0.45 0.00 0.00 32.46 33.05 1mxf n ARG 43 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1mxf n HIS 44 N -3.01 0.00 -0.77 -0.14 8.25 -1.26 -4.77 115.22 113.51 1mxf n HIS 44 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.32 1mxf n HIS 44 Cb 0.42 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.44 1mxf n HIS 44 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1mxf n SER 45 N -1.62 4.43 -0.22 0.41 7.64 -1.26 -4.53 113.62 118.46 1mxf n SER 45 Ca 0.00 -2.25 -0.02 0.00 1.01 0.00 0.00 58.87 57.61 1mxf n SER 45 Cb 0.37 -1.07 0.09 0.00 -1.01 0.00 0.00 64.21 62.58 1mxf n SER 45 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1mxf h GLU 46 N 4.49 0.66 -0.52 1.43 4.22 -1.96 -0.83 114.58 122.06 1mxf h GLU 46 Ca 0.28 -0.04 -0.10 0.00 0.08 0.00 0.00 59.36 59.58 1mxf h GLU 46 Cb 0.81 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1mxf h GLU 46 CO 0.68 0.44 -0.06 0.78 -2.18 0.00 0.00 179.01 178.67 1mxf h GLY 47 N 0.68 1.04 1.57 1.92 0.00 -2.00 -1.34 103.07 104.93 1mxf h GLY 47 Ca 0.28 -0.81 -0.09 0.00 0.00 0.00 0.00 47.33 46.72 1mxf h GLY 47 CO -0.17 0.74 -0.19 0.00 0.00 0.00 0.00 176.54 176.92 1mxf h ALA 48 N 0.93 1.14 -0.27 3.60 0.00 -1.84 -1.75 119.26 121.08 1mxf h ALA 48 Ca 0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1mxf h ALA 48 Cb 0.60 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1mxf h ALA 48 CO 0.04 0.54 0.08 0.00 0.00 0.00 0.00 179.25 179.90 1mxf h ALA 49 N 1.34 0.35 -0.63 0.00 0.00 -0.85 -2.36 119.26 117.10 1mxf h ALA 49 Ca 0.08 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1mxf h ALA 49 Cb 0.60 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1mxf h ALA 49 CO 0.04 -0.01 0.21 1.96 0.00 0.00 0.00 179.25 181.44 1mxf h GLN 50 N 0.26 0.98 -0.23 0.00 4.20 -1.01 -1.16 115.11 118.15 1mxf h GLN 50 Ca 0.09 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 1mxf h GLN 50 Cb 0.25 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1mxf h GLN 50 CO -0.00 0.85 0.02 0.00 -0.67 0.00 0.00 178.83 179.03 1mxf h ARG 51 N 0.90 0.34 -0.00 1.46 3.08 -1.23 -0.21 114.38 118.72 1mxf h ARG 51 Ca 0.20 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 1mxf h ARG 51 Cb 0.28 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1mxf h ARG 51 CO -0.01 0.35 -0.15 1.25 -1.07 0.00 0.00 179.97 180.35 1mxf h LEU 52 N 0.33 0.13 -0.71 3.04 5.85 -1.05 -2.53 115.31 120.37 1mxf h LEU 52 Ca 0.08 -0.78 0.01 0.00 0.84 0.00 0.00 57.88 58.03 1mxf h LEU 52 Cb 0.20 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 1mxf h LEU 52 CO 0.00 0.90 0.46 0.58 -0.34 0.00 0.00 178.44 180.04 1mxf h VAL 53 N -0.62 1.17 -0.16 1.05 2.07 -1.05 -0.12 116.25 118.59 1mxf h VAL 53 Ca -0.02 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1mxf h VAL 53 Cb 0.92 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1mxf h VAL 53 CO 0.03 0.17 0.08 0.00 0.02 0.00 0.00 177.57 177.87 1mxf h ALA 54 N 1.27 0.21 -0.68 1.67 0.00 -1.13 -0.79 119.26 119.80 1mxf h ALA 54 Ca 0.26 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.16 1mxf h ALA 54 Cb -0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1mxf h ALA 54 CO -0.06 -0.23 0.45 1.49 0.00 0.00 0.00 179.25 180.89 1mxf h GLU 55 N 0.13 0.66 0.02 0.00 4.81 -1.01 -0.51 114.58 118.68 1mxf h GLU 55 Ca 0.06 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.05 1mxf h GLU 55 Cb 0.12 -0.15 0.02 0.00 0.63 0.00 0.00 28.75 29.37 1mxf h GLU 55 CO -0.01 0.44 -0.78 -0.07 -0.73 0.00 0.00 179.01 177.87 1mxf h LEU 56 N 0.68 0.66 -1.63 1.64 3.38 -0.62 -3.18 115.31 116.24 1mxf h LEU 56 Ca 0.30 -0.77 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 1mxf h LEU 56 Cb 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1mxf h LEU 56 CO -0.10 1.34 -0.19 0.78 0.09 0.00 0.00 178.44 180.37 1mxf h ASN 57 N 0.04 0.00 0.62 -0.43 2.35 -0.81 -0.79 115.58 116.56 1mxf h ASN 57 Ca -0.10 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.60 1mxf h ASN 57 Cb 1.48 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.84 1mxf h ASN 57 CO 0.15 0.19 -0.24 0.00 -1.65 0.00 0.00 177.43 175.88 1mxf h ALA 58 N 1.81 1.16 0.00 -0.83 0.00 -1.09 -1.94 119.26 118.37 1mxf h ALA 58 Ca -0.00 -0.22 -0.25 0.00 0.00 0.00 0.00 54.91 54.43 1mxf h ALA 58 Cb 0.47 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1mxf h ALA 58 CO 0.03 0.30 -1.47 0.00 0.00 0.00 0.00 179.25 178.11 1mxf h ALA 59 N 1.76 0.66 -1.32 0.00 0.00 -1.17 -3.45 119.26 115.74 1mxf h ALA 59 Ca -0.00 -1.24 -0.03 0.00 0.00 0.00 0.00 54.91 53.64 1mxf h ALA 59 Cb 0.62 0.30 -0.24 0.00 0.00 0.00 0.00 17.79 18.46 1mxf h ALA 59 CO 0.03 1.41 -0.39 1.03 0.00 0.00 0.00 179.25 181.33 1mxf s ARG 60 N -2.67 0.49 0.24 0.00 0.52 -0.56 -5.13 118.95 111.85 1mxf s ARG 60 Ca -0.03 0.64 -0.30 0.00 -0.52 0.00 0.00 55.73 55.52 1mxf s ARG 60 Cb 0.09 0.11 -0.14 0.00 0.52 0.00 0.00 34.95 35.52 1mxf s ARG 60 CO 0.82 -0.80 1.12 0.00 0.02 0.00 0.00 175.30 176.45 1mxf n ALA 61 N 5.40 -0.23 -2.25 2.13 0.00 -0.78 -1.91 120.51 122.88 1mxf n ALA 61 Ca 0.00 0.42 -0.20 0.00 0.00 0.00 0.00 53.44 53.66 1mxf n ALA 61 Cb 0.51 -2.06 -0.02 0.00 0.00 0.00 0.00 19.45 17.88 1mxf n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mxf n GLY 62 N 1.61 -0.04 0.83 0.00 0.00 -1.26 -4.89 105.19 101.43 1mxf n GLY 62 Ca 0.12 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.19 1mxf n GLY 62 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mxf n SER 63 N -1.77 2.87 -3.72 1.61 3.41 -0.80 -4.96 113.62 110.26 1mxf n SER 63 Ca -0.23 -1.84 -0.12 0.00 -0.26 0.00 0.00 58.87 56.41 1mxf n SER 63 Cb 0.68 -0.15 -0.11 0.00 -0.26 0.00 0.00 64.21 64.38 1mxf n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mxf s ALA 64 N -1.29 -0.93 0.21 7.33 0.00 -1.26 -1.72 121.76 124.09 1mxf s ALA 64 Ca 0.27 1.24 0.05 0.00 0.00 0.00 0.00 51.96 53.52 1mxf s ALA 64 Cb 0.17 -0.74 -0.05 0.00 0.00 0.00 0.00 23.12 22.50 1mxf s ALA 64 CO 0.23 -0.21 -0.08 0.54 0.00 0.00 0.00 175.76 176.24 1mxf s VAL 65 N 0.79 1.37 0.17 0.00 0.11 -0.86 -4.88 120.40 117.10 1mxf s VAL 65 Ca -0.05 -2.11 0.06 0.00 -2.93 0.00 0.00 61.98 56.95 1mxf s VAL 65 Cb -0.06 -2.13 -0.04 0.00 -1.53 0.00 0.00 36.38 32.62 1mxf s VAL 65 CO -0.06 -0.52 0.10 -0.22 -3.33 0.00 0.00 175.10 171.07 1mxf s LEU 66 N -3.29 3.69 -0.28 2.54 2.96 -1.26 -0.81 118.68 122.23 1mxf s LEU 66 Ca 0.23 -0.19 -0.09 0.00 -0.22 0.00 0.00 54.13 53.86 1mxf s LEU 66 Cb 0.03 -2.31 0.12 0.00 0.50 0.00 0.00 46.19 44.53 1mxf s LEU 66 CO 0.06 0.07 0.59 0.00 -1.32 0.00 0.00 176.35 175.76 1mxf s LYS 68 N 2.83 3.22 0.00 0.00 2.20 -1.26 -1.05 119.74 125.68 1mxf s LYS 68 Ca -0.04 -0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.26 1mxf s LYS 68 Cb -0.12 -2.99 0.00 0.00 -1.51 0.00 0.00 37.83 33.21 1mxf s LYS 68 CO -0.18 0.71 0.00 0.41 -0.36 0.00 0.00 175.35 175.94 1mxf n GLY 69 N 1.69 1.32 3.75 5.54 0.00 -0.55 -4.94 105.19 112.00 1mxf n GLY 69 Ca -0.17 0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1mxf n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mxf s ASP 70 N 0.00 7.00 -0.21 1.61 2.15 -1.26 -4.48 116.67 121.48 1mxf s ASP 70 Ca 0.00 1.20 0.15 0.00 0.43 0.00 0.00 52.55 54.33 1mxf s ASP 70 Cb 0.00 -2.39 0.75 0.00 -0.30 0.00 0.00 42.92 40.99 1mxf s ASP 70 CO 0.00 0.04 1.67 0.18 -0.17 0.00 0.00 175.17 176.89 1mxf n LEU 71 N 3.01 5.27 -4.84 -1.34 4.77 -1.26 -4.89 117.00 117.72 1mxf n LEU 71 Ca -0.05 -2.87 -0.32 0.00 -0.03 0.00 0.00 56.01 52.74 1mxf n LEU 71 Cb 0.51 -0.64 -0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1mxf n LEU 71 CO 0.45 0.67 0.70 -0.44 -1.33 0.00 0.00 177.39 177.44 1mxf s SER 72 N -1.01 6.16 0.15 -1.43 0.01 -1.26 -2.08 113.70 114.24 1mxf s SER 72 Ca 0.52 1.60 -0.31 0.00 1.31 0.00 0.00 55.95 59.06 1mxf s SER 72 Cb 0.39 -2.50 -0.11 0.00 0.21 0.00 0.00 66.02 64.01 1mxf s SER 72 CO 0.16 -0.91 1.74 -0.76 0.41 0.00 0.00 173.24 173.88 1mxf s LEU 73 N -4.64 4.38 0.12 2.44 1.43 0.27 -4.62 118.68 118.06 1mxf s LEU 73 Ca 0.59 2.75 -0.26 0.00 -1.03 0.00 0.00 54.13 56.18 1mxf s LEU 73 Cb -0.12 -3.58 0.08 0.00 0.03 0.00 0.00 46.19 42.60 1mxf s LEU 73 CO 0.41 -0.96 1.06 -0.94 0.23 0.00 0.00 176.35 176.15 1mxf s SER 74 N 1.92 -0.11 0.55 2.29 1.04 -1.26 -4.86 113.70 113.27 1mxf s SER 74 Ca 0.76 -0.39 0.35 0.00 0.48 0.00 0.00 55.95 57.16 1mxf s SER 74 Cb -0.46 0.41 1.58 0.00 0.10 0.00 0.00 66.02 67.65 1mxf s SER 74 CO 0.34 -0.77 2.05 0.28 0.98 0.00 0.00 173.24 176.12 1mxf h SER 75 N 2.00 0.00 -0.01 7.02 0.02 -2.04 -2.76 113.55 117.78 1mxf h SER 75 Ca -0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1mxf h SER 75 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1mxf h SER 75 CO 0.28 0.00 -0.36 -1.20 -1.14 0.00 0.00 176.83 174.41 1mxf n SER 76 N -3.00 2.24 0.00 3.07 7.64 -1.26 -4.57 113.62 117.75 1mxf n SER 76 Ca -0.00 -1.62 -0.11 0.00 1.01 0.00 0.00 58.87 58.15 1mxf n SER 76 Cb 0.24 0.36 -0.05 0.00 -1.01 0.00 0.00 64.21 63.75 1mxf n SER 76 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1mxf h LEU 77 N 2.95 0.04 -1.16 -3.43 5.85 -1.74 -0.74 115.31 117.09 1mxf h LEU 77 Ca 0.00 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.83 1mxf h LEU 77 Cb 0.81 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.77 1mxf h LEU 77 CO 0.00 0.04 0.59 0.25 -0.34 0.00 0.00 178.44 178.98 1mxf h LEU 78 N 0.08 0.84 0.03 2.25 5.85 -1.80 -0.99 115.31 121.57 1mxf h LEU 78 Ca 0.04 0.03 -0.27 0.00 0.84 0.00 0.00 57.88 58.52 1mxf h LEU 78 Cb 0.02 -0.15 0.01 0.00 0.37 0.00 0.00 40.66 40.91 1mxf h LEU 78 CO -0.04 0.49 -1.16 0.44 -0.34 0.00 0.00 178.44 177.83 1mxf h ASP 79 N 0.92 0.62 -0.88 1.25 3.32 -1.81 -2.90 116.42 116.95 1mxf h ASP 79 Ca 0.43 -0.58 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 1mxf h ASP 79 Cb 0.41 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1mxf h ASP 79 CO -0.19 1.41 0.53 0.00 -1.72 0.00 0.00 179.24 179.27 1mxf h GLU 82 N 0.50 0.99 -0.08 0.00 4.39 -1.16 -2.87 114.58 116.36 1mxf h GLU 82 Ca 0.06 -0.16 -0.17 0.00 0.34 0.00 0.00 59.36 59.44 1mxf h GLU 82 Cb 0.79 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 1mxf h GLU 82 CO 0.06 0.80 -0.67 -0.44 -1.16 0.00 0.00 179.01 177.60 1mxf h ASP 83 N 0.95 0.39 -0.62 1.42 3.32 -0.95 -1.17 116.42 119.76 1mxf h ASP 83 Ca 0.23 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 1mxf h ASP 83 Cb 0.15 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1mxf h ASP 83 CO -0.03 0.95 0.25 -0.29 -1.72 0.00 0.00 179.24 178.40 1mxf h ILE 84 N 0.24 1.23 0.01 0.35 -0.00 -1.15 0.11 117.51 118.30 1mxf h ILE 84 Ca -0.02 -0.74 -0.17 0.00 -0.00 0.00 0.00 64.86 63.93 1mxf h ILE 84 Cb 1.21 0.46 0.01 0.00 -0.00 0.00 0.00 36.82 38.51 1mxf h ILE 84 CO 0.11 0.29 -0.67 0.40 -0.00 0.00 0.00 178.15 178.28 1mxf h ILE 85 N 0.94 1.41 -0.56 2.19 1.08 -1.48 -3.12 117.51 117.98 1mxf h ILE 85 Ca 0.22 -2.13 0.16 0.00 -0.39 0.00 0.00 64.86 62.71 1mxf h ILE 85 Cb 0.20 2.62 -0.02 0.00 -3.07 0.00 0.00 36.82 36.54 1mxf h ILE 85 CO -0.02 0.62 0.40 -0.78 -0.69 0.00 0.00 178.15 177.69 1mxf h ASP 86 N -0.06 0.04 -0.79 1.72 3.58 -0.84 0.15 116.42 120.21 1mxf h ASP 86 Ca -0.09 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.34 1mxf h ASP 86 Cb 1.39 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 42.39 1mxf h ASP 86 CO 0.13 0.02 0.42 0.00 -2.88 0.00 0.00 179.24 176.93 1mxf h SER 88 N 1.13 0.63 -0.33 0.00 0.87 -1.05 -1.57 113.55 113.23 1mxf h SER 88 Ca 0.28 -0.17 -0.11 0.00 -1.23 0.00 0.00 61.79 60.57 1mxf h SER 88 Cb 0.06 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 1mxf h SER 88 CO -0.04 0.62 -0.17 -0.26 -0.53 0.00 0.00 176.83 176.45 1mxf h PHE 89 N 0.60 0.89 -0.49 2.24 0.04 -1.32 0.22 116.94 119.13 1mxf h PHE 89 Ca 0.15 -0.19 -0.12 0.00 2.80 0.00 0.00 57.97 60.62 1mxf h PHE 89 Cb 0.19 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 1mxf h PHE 89 CO 0.00 0.91 -0.16 0.00 -0.60 0.00 0.00 178.31 178.46 1mxf h ARG 90 N 0.71 0.94 0.05 1.51 2.47 -0.84 0.55 114.38 119.77 1mxf h ARG 90 Ca 0.11 -0.36 -0.28 0.00 -1.26 0.00 0.00 59.98 58.19 1mxf h ARG 90 Cb 0.68 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.92 1mxf h ARG 90 CO 0.05 1.02 -1.45 0.00 0.56 0.00 0.00 179.97 180.15 1mxf h ALA 91 N 0.99 0.46 0.00 0.04 0.00 -1.20 -3.41 119.26 116.14 1mxf h ALA 91 Ca 0.12 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.85 1mxf h ALA 91 Cb 0.70 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1mxf h ALA 91 CO 0.05 1.32 0.00 1.19 0.00 0.00 0.00 179.25 181.81 1mxf n PHE 92 N -3.30 0.00 -0.93 0.00 3.72 0.77 -5.01 117.46 112.71 1mxf n PHE 92 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 1mxf n PHE 92 Cb 1.02 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.56 1mxf n PHE 92 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1mxf n GLY 93 N 0.53 0.47 3.74 1.37 0.00 0.19 -4.95 105.19 106.53 1mxf n GLY 93 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1mxf n GLY 93 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1mxf s ARG 94 N -0.54 1.51 -0.27 1.61 1.70 -1.25 -4.89 118.95 116.83 1mxf s ARG 94 Ca 0.00 -0.79 -0.00 0.00 -0.47 0.00 0.00 55.73 54.47 1mxf s ARG 94 Cb 0.00 0.55 0.15 0.00 -0.57 0.00 0.00 34.95 35.08 1mxf s ARG 94 CO 0.00 -0.69 0.43 0.00 -1.08 0.00 0.00 175.30 173.97 1mxf n ASP 96 N 5.37 0.07 -3.83 0.00 9.92 0.99 -4.94 116.55 124.14 1mxf n ASP 96 Ca -0.01 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 54.09 1mxf n ASP 96 Cb 0.50 1.44 -0.16 0.00 -0.64 0.00 0.00 41.12 42.27 1mxf n ASP 96 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1mxf s VAL 97 N -2.94 0.10 -0.15 2.53 1.01 -0.52 -2.20 120.40 118.24 1mxf s VAL 97 Ca -0.09 0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.99 1mxf s VAL 97 Cb 0.09 -0.18 0.01 0.00 0.00 0.00 0.00 36.38 36.31 1mxf s VAL 97 CO 0.85 0.10 -0.22 -0.22 0.00 0.00 0.00 175.10 175.62 1mxf s LEU 98 N 0.72 2.11 -0.26 3.92 2.96 -1.00 0.30 118.68 127.43 1mxf s LEU 98 Ca -0.07 -0.61 -0.00 0.00 -0.22 0.00 0.00 54.13 53.23 1mxf s LEU 98 Cb -0.10 -1.45 0.04 0.00 0.50 0.00 0.00 46.19 45.19 1mxf s LEU 98 CO -0.02 0.07 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.32 1mxf s VAL 99 N 0.90 2.63 -1.08 1.68 1.01 -0.09 -0.89 120.40 124.56 1mxf s VAL 99 Ca -0.05 -1.31 -0.17 0.00 0.00 0.00 0.00 61.98 60.45 1mxf s VAL 99 Cb -0.15 -2.43 0.13 0.00 0.00 0.00 0.00 36.38 33.93 1mxf s VAL 99 CO -0.04 0.07 1.34 0.20 0.00 0.00 0.00 175.10 176.67 1mxf s ASN 100 N 1.23 6.80 -0.17 3.32 0.01 -0.19 -2.46 114.94 123.47 1mxf s ASN 100 Ca -0.04 -2.37 0.17 0.00 -0.71 0.00 0.00 52.86 49.92 1mxf s ASN 100 Cb -0.18 -2.44 -0.25 0.00 0.41 0.00 0.00 41.25 38.79 1mxf s ASN 100 CO -0.04 -1.01 0.10 -3.20 -1.51 0.00 0.00 177.10 171.44 1mxf n ASN 101 N 6.68 0.26 -4.68 -1.22 5.15 -1.25 -1.90 115.26 118.31 1mxf n ASN 101 Ca 0.32 0.00 -0.45 0.00 -0.60 0.00 0.00 54.58 53.86 1mxf n ASN 101 Cb 0.47 1.07 -0.03 0.00 -0.53 0.00 0.00 39.78 40.76 1mxf n ASN 101 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1mxf n ALA 102 N -2.66 1.46 -3.64 5.20 0.00 -1.04 -4.88 120.51 114.94 1mxf n ALA 102 Ca -0.29 0.42 -0.06 0.00 0.00 0.00 0.00 53.44 53.51 1mxf n ALA 102 Cb 1.07 -2.34 -0.07 0.00 0.00 0.00 0.00 19.45 18.11 1mxf n ALA 102 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1mxf s SER 103 N 0.57 -0.88 0.10 0.00 0.15 -1.26 -4.40 113.70 107.98 1mxf s SER 103 Ca 0.72 1.40 -0.21 0.00 0.70 0.00 0.00 55.95 58.55 1mxf s SER 103 Cb -0.63 1.37 -0.07 0.00 -1.71 0.00 0.00 66.02 64.97 1mxf s SER 103 CO 0.45 -0.22 0.64 0.00 1.20 0.00 0.00 173.24 175.31 1mxf s ALA 104 N 1.60 3.54 -0.18 5.45 0.00 -1.26 -5.02 121.76 125.89 1mxf s ALA 104 Ca -0.10 0.15 -0.04 0.00 0.00 0.00 0.00 51.96 51.97 1mxf s ALA 104 Cb -0.05 -2.75 0.09 0.00 0.00 0.00 0.00 23.12 20.41 1mxf s ALA 104 CO -0.19 0.36 0.25 -0.47 0.00 0.00 0.00 175.76 175.71 1mxf s TYR 105 N -1.10 -0.39 -0.05 0.00 5.04 -1.26 -4.86 117.35 114.74 1mxf s TYR 105 Ca 0.31 0.54 -0.30 0.00 -2.44 0.00 0.00 57.07 55.18 1mxf s TYR 105 Cb -0.21 -0.21 0.11 0.00 0.35 0.00 0.00 41.96 42.00 1mxf s TYR 105 CO 0.21 -0.53 1.02 1.52 -1.34 0.00 0.00 175.55 176.43 1mxf s TYR 106 N 2.38 -0.24 0.62 4.97 -0.85 -1.26 -5.18 117.35 117.79 1mxf s TYR 106 Ca 0.06 0.11 -0.16 0.00 -0.52 0.00 0.00 57.07 56.56 1mxf s TYR 106 Cb -0.14 0.54 -0.02 0.00 0.38 0.00 0.00 41.96 42.71 1mxf s TYR 106 CO -0.11 -0.45 1.08 -1.25 -1.52 0.00 0.00 175.55 173.30 1mxf s PRO 107 N -2.88 3.11 -0.41 -3.49 0.04 -1.26 -4.75 135.00 125.36 1mxf s PRO 107 Ca 0.08 1.31 0.09 0.00 0.04 0.00 0.00 61.00 62.52 1mxf s PRO 107 Cb -0.01 -2.00 0.34 0.00 0.04 0.00 0.00 34.50 32.88 1mxf s PRO 107 CO -0.06 -0.99 0.93 0.25 0.04 0.00 0.00 177.00 177.16 1mxf n THR 108 N -2.13 -0.07 -1.49 1.26 -2.24 0.28 -4.97 114.28 104.93 1mxf n THR 108 Ca 0.10 -3.07 -0.50 0.00 -2.27 0.00 0.00 64.05 58.30 1mxf n THR 108 Cb 0.52 0.60 -0.04 0.00 -2.10 0.00 0.00 70.33 69.31 1mxf n THR 108 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1mxf n PRO 109 N 0.30 0.47 -0.18 -0.78 -0.04 -1.20 -4.59 135.00 128.97 1mxf n PRO 109 Ca 0.15 0.17 -0.09 0.00 -0.04 0.00 0.00 63.50 63.69 1mxf n PRO 109 Cb 0.69 -1.46 0.01 0.00 -0.04 0.00 0.00 33.50 32.70 1mxf n PRO 109 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1mxf h LEU 110 N 2.22 0.90 -9.45 1.53 3.38 -2.01 -3.42 115.31 108.46 1mxf h LEU 110 Ca -0.39 -0.30 -0.67 0.00 0.09 0.00 0.00 57.88 56.62 1mxf h LEU 110 Cb 1.40 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 41.80 1mxf h LEU 110 CO 0.63 0.97 -0.54 -0.76 0.09 0.00 0.00 178.44 178.83 1mxf s LEU 111 N -9.41 4.05 0.55 1.67 2.01 -1.26 -5.26 118.68 111.04 1mxf s LEU 111 Ca -0.12 0.31 -0.22 0.00 0.01 0.00 0.00 54.13 54.12 1mxf s LEU 111 Cb 0.12 -1.97 -0.05 0.00 0.01 0.00 0.00 46.19 44.30 1mxf s LEU 111 CO 0.83 0.37 1.37 -2.16 1.01 0.00 0.00 176.35 177.77 1mxf s PRO 112 N -0.80 3.10 0.00 1.29 0.04 -1.26 -5.16 135.00 132.21 1mxf s PRO 112 Ca 0.13 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.43 1mxf s PRO 112 Cb -0.12 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.18 1mxf s PRO 112 CO 0.03 -1.23 0.00 1.17 0.04 0.00 0.00 177.00 177.01 1mxf n LYS 123 N -1.07 0.00 -1.56 4.56 4.81 -1.26 -5.15 118.16 118.49 1mxf n LYS 123 Ca 0.11 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.13 1mxf n LYS 123 Cb 0.45 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.51 1mxf n LYS 123 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1mxf n PRO 124 N 0.00 1.08 -0.26 1.64 -0.02 -1.26 -4.86 135.00 131.31 1mxf n PRO 124 Ca 0.00 0.39 -0.07 0.00 -2.02 0.00 0.00 63.50 61.80 1mxf n PRO 124 Cb 0.00 -1.86 0.05 0.00 -0.02 0.00 0.00 33.50 31.67 1mxf n PRO 124 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1mxf h ILE 125 N 1.30 1.26 -0.46 4.25 6.09 -2.03 -2.20 117.51 125.71 1mxf h ILE 125 Ca -0.43 -0.89 0.03 0.00 -1.37 0.00 0.00 64.86 62.20 1mxf h ILE 125 Cb 1.36 0.46 -0.03 0.00 0.47 0.00 0.00 36.82 39.07 1mxf h ILE 125 CO 0.55 0.35 0.26 0.44 -3.07 0.00 0.00 178.15 176.68 1mxf h ASP 126 N 1.08 0.40 0.45 2.19 3.32 -2.00 -0.75 116.42 121.11 1mxf h ASP 126 Ca 0.24 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.26 1mxf h ASP 126 Cb 0.29 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1mxf h ASP 126 CO -0.01 0.28 -0.18 0.00 -1.72 0.00 0.00 179.24 177.61 1mxf h ALA 127 N 1.22 1.27 -0.03 3.45 0.00 -1.88 -1.95 119.26 121.35 1mxf h ALA 127 Ca 0.19 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1mxf h ALA 127 Cb 0.05 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.82 1mxf h ALA 127 CO -0.11 0.23 -0.54 1.96 0.00 0.00 0.00 179.25 180.79 1mxf h GLN 128 N 0.00 0.41 0.00 0.00 4.20 -0.56 -2.08 115.11 117.09 1mxf h GLN 128 Ca -0.00 -0.41 -0.06 0.00 0.06 0.00 0.00 58.65 58.24 1mxf h GLN 128 Cb 0.46 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1mxf h GLN 128 CO 0.02 1.07 -0.30 -0.39 -0.67 0.00 0.00 178.83 178.56 1mxf h VAL 129 N -0.08 1.07 -0.14 -0.54 -1.51 -1.03 0.74 116.25 114.76 1mxf h VAL 129 Ca -0.06 -1.06 -0.03 0.00 -1.23 0.00 0.00 66.70 64.31 1mxf h VAL 129 Cb 1.23 1.60 -0.00 0.00 -2.13 0.00 0.00 31.29 31.98 1mxf h VAL 129 CO 0.11 0.29 -0.05 0.00 -1.23 0.00 0.00 177.57 176.69 1mxf h ALA 130 N 1.70 0.19 -0.07 5.19 0.00 -1.29 0.25 119.26 125.23 1mxf h ALA 130 Ca -0.00 -0.25 -0.24 0.00 0.00 0.00 0.00 54.91 54.42 1mxf h ALA 130 Cb 0.57 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.33 1mxf h ALA 130 CO 0.04 -0.04 -0.88 1.49 0.00 0.00 0.00 179.25 179.86 1mxf h GLU 131 N -0.05 0.72 -0.11 0.00 4.81 -1.14 0.10 114.58 118.92 1mxf h GLU 131 Ca 0.03 -0.68 -0.12 0.00 -0.13 0.00 0.00 59.36 58.46 1mxf h GLU 131 Cb 0.49 0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.05 1mxf h GLU 131 CO 0.02 1.28 -0.40 -0.07 -0.73 0.00 0.00 179.01 179.10 1mxf h LEU 132 N 0.42 0.54 -0.41 1.64 3.38 -0.92 -2.58 115.31 117.37 1mxf h LEU 132 Ca -0.09 -0.62 -0.15 0.00 0.09 0.00 0.00 57.88 57.11 1mxf h LEU 132 Cb 1.53 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 1mxf h LEU 132 CO 0.18 1.07 -0.72 -0.26 0.09 0.00 0.00 178.44 178.79 1mxf h PHE 133 N 0.05 0.00 0.63 1.13 -1.00 -1.06 -2.78 116.94 113.91 1mxf h PHE 133 Ca -0.02 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 1mxf h PHE 133 Cb 1.03 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.60 1mxf h PHE 133 CO 0.11 0.72 -0.30 0.78 -1.61 0.00 0.00 178.31 178.01 1mxf h GLY 134 N 2.49 -0.89 0.97 -1.45 0.00 -1.38 0.66 103.07 103.47 1mxf h GLY 134 Ca -0.01 0.33 -0.06 0.00 0.00 0.00 0.00 47.33 47.60 1mxf h GLY 134 CO 0.09 -0.32 0.07 1.48 0.00 0.00 0.00 176.54 177.86 1mxf h SER 135 N -1.19 0.74 1.65 0.19 4.64 -0.99 0.25 113.55 118.83 1mxf h SER 135 Ca -0.09 -0.26 -0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1mxf h SER 135 Cb 0.67 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1mxf h SER 135 CO 0.14 0.82 -0.36 0.78 -0.87 0.00 0.00 176.83 177.34 1mxf h ASN 136 N 0.64 0.00 0.00 4.97 2.35 -1.62 -3.41 115.58 118.51 1mxf h ASN 136 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1mxf h ASN 136 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1mxf h ASN 136 CO 0.01 0.01 0.00 0.00 -1.65 0.00 0.00 177.43 175.80 1mxf n ALA 137 N -2.13 3.00 -0.17 -0.83 0.00 -0.59 -4.51 120.51 115.28 1mxf n ALA 137 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.37 1mxf n ALA 137 Cb 0.54 0.09 0.00 0.00 0.00 0.00 0.00 19.45 20.08 1mxf n ALA 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1mxf h VAL 138 N 0.00 1.26 0.19 0.00 2.07 -0.87 -2.22 116.25 116.68 1mxf h VAL 138 Ca 0.00 -1.04 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1mxf h VAL 138 Cb 0.00 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1mxf h VAL 138 CO 0.00 0.37 -0.09 0.00 0.02 0.00 0.00 177.57 177.86 1mxf h ALA 139 N 0.94 -0.26 -0.91 1.67 0.00 -0.71 0.06 119.26 120.06 1mxf h ALA 139 Ca 0.14 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.15 1mxf h ALA 139 Cb 0.48 0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.27 1mxf h ALA 139 CO 0.02 -0.62 0.49 -1.35 0.00 0.00 0.00 179.25 177.80 1mxf h PRO 140 N -0.31 0.62 -0.65 0.00 0.11 -1.74 0.38 132.00 130.41 1mxf h PRO 140 Ca -0.03 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 1mxf h PRO 140 Cb 0.24 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.18 1mxf h PRO 140 CO 0.04 0.41 0.27 1.25 -0.21 0.00 0.00 178.00 179.77 1mxf h LEU 141 N 0.64 0.89 -0.64 2.35 5.85 -0.75 -0.69 115.31 122.95 1mxf h LEU 141 Ca 0.52 -0.16 -0.14 0.00 0.84 0.00 0.00 57.88 58.94 1mxf h LEU 141 Cb 0.81 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1mxf h LEU 141 CO -0.39 0.81 -0.47 -0.26 -0.34 0.00 0.00 178.44 177.78 1mxf h PHE 142 N 0.91 0.61 -0.36 1.25 0.04 0.98 -2.21 116.94 118.16 1mxf h PHE 142 Ca 0.22 -0.19 -0.05 0.00 2.80 0.00 0.00 57.97 60.75 1mxf h PHE 142 Cb 0.19 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1mxf h PHE 142 CO 0.01 0.88 0.04 -0.07 -0.60 0.00 0.00 178.31 178.57 1mxf h LEU 143 N 0.40 0.59 -0.24 1.54 4.07 -0.07 -1.24 115.31 120.37 1mxf h LEU 143 Ca 0.02 -0.28 -0.03 0.00 0.08 0.00 0.00 57.88 57.68 1mxf h LEU 143 Cb 0.98 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.55 1mxf h LEU 143 CO 0.09 0.72 0.05 0.40 -1.08 0.00 0.00 178.44 178.62 1mxf h ILE 144 N 0.44 1.22 -0.02 1.22 2.04 -1.10 0.19 117.51 121.50 1mxf h ILE 144 Ca 0.11 -0.71 0.03 0.00 1.00 0.00 0.00 64.86 65.29 1mxf h ILE 144 Cb 0.40 1.23 -0.05 0.00 -0.74 0.00 0.00 36.82 37.67 1mxf h ILE 144 CO 0.01 0.23 -0.24 -0.09 0.00 0.00 0.00 178.15 178.06 1mxf h ARG 145 N 0.21 -0.35 -0.93 2.37 2.43 -1.35 0.40 114.38 117.16 1mxf h ARG 145 Ca 0.07 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1mxf h ARG 145 Cb 0.30 0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.88 1mxf h ARG 145 CO 0.00 -0.24 0.57 0.00 -1.51 0.00 0.00 179.97 178.80 1mxf h ALA 146 N 0.49 1.18 -0.42 2.80 0.00 -1.06 0.10 119.26 122.35 1mxf h ALA 146 Ca 0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1mxf h ALA 146 Cb 0.46 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1mxf h ALA 146 CO -0.23 0.62 0.16 0.35 0.00 0.00 0.00 179.25 180.15 1mxf h PHE 147 N 1.27 0.66 -0.09 0.00 3.04 0.15 -2.63 116.94 119.33 1mxf h PHE 147 Ca 0.33 -0.06 -0.15 0.00 3.98 0.00 0.00 57.97 62.08 1mxf h PHE 147 Cb -0.08 -0.19 -0.01 0.00 2.56 0.00 0.00 35.95 38.23 1mxf h PHE 147 CO 0.00 0.58 -0.61 0.00 -2.02 0.00 0.00 178.31 176.27 1mxf h ALA 148 N 1.00 0.79 0.00 2.41 0.00 0.11 -3.18 119.26 120.39 1mxf h ALA 148 Ca 0.14 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 1mxf h ALA 148 Cb 0.22 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1mxf h ALA 148 CO -0.01 0.72 -0.25 0.00 0.00 0.00 0.00 179.25 179.71 1mxf h ARG 149 N 0.24 0.00 -0.46 0.00 3.08 -0.88 -3.13 114.38 113.23 1mxf h ARG 149 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1mxf h ARG 149 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1mxf h ARG 149 CO 0.10 0.25 0.00 0.54 -1.07 0.00 0.00 179.97 179.79 1mxf n ARG 150 N -3.36 2.20 -0.97 0.04 1.74 -1.00 -5.09 116.66 110.21 1mxf n ARG 150 Ca 0.00 -1.85 -0.10 0.00 -0.77 0.00 0.00 57.85 55.13 1mxf n ARG 150 Cb 0.47 -1.43 0.06 0.00 -1.02 0.00 0.00 32.46 30.54 1mxf n ARG 150 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1mxf n GLN 151 N 1.02 -0.11 -0.87 5.56 1.13 -1.19 -5.04 117.38 117.87 1mxf n GLN 151 Ca 0.18 -0.86 0.00 0.00 -1.94 0.00 0.00 57.00 54.38 1mxf n GLN 151 Cb 0.46 -0.39 0.00 0.00 0.11 0.00 0.00 30.24 30.42 1mxf n GLN 151 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1mxf n ASN 161 N -3.16 -1.65 -4.73 1.08 5.15 -1.26 -5.10 115.26 105.59 1mxf n ASN 161 Ca 0.06 -1.14 -0.39 0.00 -0.60 0.00 0.00 54.58 52.51 1mxf n ASN 161 Cb 0.21 -0.46 -0.05 0.00 -0.53 0.00 0.00 39.78 38.95 1mxf n ASN 161 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1mxf s LEU 162 N 0.00 4.33 0.01 1.20 1.43 -1.26 -4.81 118.68 119.57 1mxf s LEU 162 Ca 0.00 1.10 -0.23 0.00 -1.03 0.00 0.00 54.13 53.97 1mxf s LEU 162 Cb 0.00 -2.97 0.05 0.00 0.03 0.00 0.00 46.19 43.31 1mxf s LEU 162 CO 0.00 -0.04 0.52 -0.94 0.23 0.00 0.00 176.35 176.12 1mxf s SER 163 N 0.55 -0.45 0.04 2.29 1.04 -0.93 -1.69 113.70 114.54 1mxf s SER 163 Ca 0.34 0.31 0.08 0.00 0.48 0.00 0.00 55.95 57.15 1mxf s SER 163 Cb -0.17 0.47 -0.03 0.00 0.10 0.00 0.00 66.02 66.39 1mxf s SER 163 CO 0.16 -0.64 -0.21 -0.69 0.98 0.00 0.00 173.24 172.85 1mxf s VAL 164 N -1.88 2.58 -0.12 5.02 1.01 0.20 -2.37 120.40 124.84 1mxf s VAL 164 Ca -0.08 -1.23 -0.02 0.00 0.00 0.00 0.00 61.98 60.65 1mxf s VAL 164 Cb -0.01 -2.05 0.04 0.00 0.00 0.00 0.00 36.38 34.36 1mxf s VAL 164 CO 0.03 0.37 0.03 -0.69 0.00 0.00 0.00 175.10 174.83 1mxf s VAL 165 N -0.87 0.35 0.03 2.92 1.01 -0.07 -1.25 120.40 122.53 1mxf s VAL 165 Ca 0.13 -0.13 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 1mxf s VAL 165 Cb -0.10 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 1mxf s VAL 165 CO 0.04 0.03 0.32 0.20 0.00 0.00 0.00 175.10 175.70 1mxf s ASN 166 N 1.96 6.57 -0.46 3.32 0.01 0.28 -1.03 114.94 125.60 1mxf s ASN 166 Ca 0.03 0.67 -0.18 0.00 -0.71 0.00 0.00 52.86 52.67 1mxf s ASN 166 Cb -0.14 -2.13 0.04 0.00 0.41 0.00 0.00 41.25 39.42 1mxf s ASN 166 CO -0.06 0.23 0.51 -0.76 -1.51 0.00 0.00 177.10 175.51 1mxf s LEU 167 N -1.75 4.97 0.00 0.60 2.01 -0.80 -1.41 118.68 122.30 1mxf s LEU 167 Ca 0.29 -0.81 0.00 0.00 0.01 0.00 0.00 54.13 53.62 1mxf s LEU 167 Cb -0.14 -2.41 0.00 0.00 0.01 0.00 0.00 46.19 43.65 1mxf s LEU 167 CO 0.16 -0.71 0.00 0.00 1.01 0.00 0.00 176.35 176.82 1mxf s ASP 169 N -1.00 2.13 0.00 0.00 -1.08 -1.26 -3.86 116.67 111.60 1mxf s ASP 169 Ca 0.00 -0.57 0.00 0.00 -0.52 0.00 0.00 52.55 51.46 1mxf s ASP 169 Cb 0.00 -0.01 0.00 0.00 -1.46 0.00 0.00 42.92 41.45 1mxf s ASP 169 CO 0.00 -0.36 0.00 0.00 0.52 0.00 0.00 175.17 175.33 1mxf n ALA 170 N 5.29 1.01 -0.14 3.66 0.00 0.30 -4.64 120.51 125.98 1mxf n ALA 170 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1mxf n ALA 170 Cb 0.48 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1mxf n ALA 170 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1mxf n THR 172 N 1.32 0.00 0.16 0.00 -2.24 -1.26 -4.76 114.28 107.50 1mxf n THR 172 Ca 0.00 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1mxf n THR 172 Cb 0.00 -0.14 0.08 0.00 -2.10 0.00 0.00 70.33 68.17 1mxf n THR 172 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1mxf h ASP 173 N 0.00 0.00 -2.67 3.42 3.32 -1.99 -3.31 116.42 115.19 1mxf h ASP 173 Ca 0.00 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 56.43 1mxf h ASP 173 Cb 0.00 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.14 1mxf h ASP 173 CO 0.00 0.19 -0.50 0.18 -1.72 0.00 0.00 179.24 177.39 1mxf n LEU 174 N -3.05 3.60 -3.70 1.55 4.77 -1.26 -5.07 117.00 113.85 1mxf n LEU 174 Ca 0.02 -5.32 -0.51 0.00 -0.03 0.00 0.00 56.01 50.17 1mxf n LEU 174 Cb 0.62 -0.76 -0.07 0.00 -2.33 0.00 0.00 43.42 40.88 1mxf n LEU 174 CO 0.38 1.89 0.68 -2.65 -1.33 0.00 0.00 177.39 176.35 1mxf n PRO 175 N 1.42 0.00 -2.34 3.23 -0.02 -1.25 -4.88 135.00 131.16 1mxf n PRO 175 Ca 0.25 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.31 1mxf n PRO 175 Cb 0.38 -1.20 -0.02 0.00 -0.02 0.00 0.00 33.50 32.63 1mxf n PRO 175 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1mxf s LEU 176 N 1.14 4.25 0.03 2.45 2.96 -1.26 -4.93 118.68 123.31 1mxf s LEU 176 Ca 0.78 1.87 -0.33 0.00 -0.22 0.00 0.00 54.13 56.23 1mxf s LEU 176 Cb -1.10 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 41.92 1mxf s LEU 176 CO 0.55 -0.73 1.81 -2.65 -1.32 0.00 0.00 176.35 174.01 1mxf n PRO 177 N 6.08 2.36 0.00 0.98 -0.02 -1.26 -1.89 135.00 141.25 1mxf n PRO 177 Ca 0.13 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 1mxf n PRO 177 Cb 0.45 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.22 1mxf n PRO 177 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mxf n GLY 178 N 4.14 0.15 2.21 -1.23 0.00 -1.26 -4.95 105.19 104.25 1mxf n GLY 178 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1mxf n GLY 178 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mxf n PHE 179 N -1.98 2.97 0.01 1.61 3.01 -0.79 0.10 117.46 122.40 1mxf n PHE 179 Ca 0.00 -2.55 -0.12 0.00 1.01 0.00 0.00 57.45 55.80 1mxf n PHE 179 Cb 0.00 -0.64 -0.05 0.00 -0.01 0.00 0.00 39.48 38.78 1mxf n PHE 179 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1mxf h VAL 181 N -0.46 1.20 -1.00 0.00 2.07 -1.88 -2.45 116.25 113.73 1mxf h VAL 181 Ca 0.08 -0.45 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1mxf h VAL 181 Cb 0.59 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.60 1mxf h VAL 181 CO -0.36 0.21 0.66 0.22 0.02 0.00 0.00 177.57 178.32 1mxf h TYR 182 N 0.91 1.25 0.00 1.57 3.20 -1.79 -1.04 116.97 121.07 1mxf h TYR 182 Ca 0.24 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.14 1mxf h TYR 182 Cb -0.01 -0.42 0.00 0.00 1.54 0.00 0.00 36.73 37.84 1mxf h TYR 182 CO -0.01 0.78 0.00 2.41 -1.64 0.00 0.00 178.16 179.70 1mxf n THR 183 N -4.39 0.04 0.00 1.81 -1.04 -0.44 -1.33 114.28 108.93 1mxf n THR 183 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1mxf n THR 183 Cb 0.02 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.34 1mxf n THR 183 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mxf n ALA 185 N 0.55 0.00 -0.03 2.41 0.00 -0.39 -1.05 120.51 121.99 1mxf n ALA 185 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 1mxf n ALA 185 Cb 0.05 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.71 1mxf n ALA 185 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1mxf h LYS 186 N 0.00 0.60 -0.59 0.00 1.79 -1.48 -1.42 116.57 115.47 1mxf h LYS 186 Ca 0.00 -0.18 -0.04 0.00 -2.18 0.00 0.00 60.65 58.25 1mxf h LYS 186 Cb 0.00 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.56 1mxf h LYS 186 CO 0.00 0.69 0.20 0.45 -1.08 0.00 0.00 179.45 179.72 1mxf h HIS 187 N 0.55 0.93 -0.95 -1.35 3.86 -1.35 -1.43 115.15 115.41 1mxf h HIS 187 Ca 0.10 -0.09 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1mxf h HIS 187 Cb 0.50 -0.27 -0.05 0.00 1.06 0.00 0.00 27.41 28.66 1mxf h HIS 187 CO 0.02 0.77 0.59 0.00 0.86 0.00 0.00 177.93 180.16 1mxf h ALA 188 N 1.06 1.25 -0.47 2.45 0.00 -1.70 -1.05 119.26 120.81 1mxf h ALA 188 Ca 0.19 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1mxf h ALA 188 Cb 0.26 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1mxf h ALA 188 CO -0.01 0.66 0.13 1.25 0.00 0.00 0.00 179.25 181.28 1mxf h LEU 189 N 1.30 0.64 -0.74 0.00 5.85 -0.80 -0.61 115.31 120.95 1mxf h LEU 189 Ca 0.34 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.90 1mxf h LEU 189 Cb -0.08 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 1mxf h LEU 189 CO -0.07 0.63 0.17 1.23 -0.34 0.00 0.00 178.44 180.06 1mxf h GLY 190 N 0.88 1.21 1.86 3.75 0.00 -0.15 -0.16 103.07 110.46 1mxf h GLY 190 Ca 0.16 -0.76 -0.07 0.00 0.00 0.00 0.00 47.33 46.65 1mxf h GLY 190 CO -0.01 0.71 -0.29 -1.33 0.00 0.00 0.00 176.54 175.62 1mxf h GLY 191 N 1.08 0.17 1.10 4.60 0.00 -0.43 -2.65 103.07 106.95 1mxf h GLY 191 Ca 0.22 -0.13 -0.16 0.00 0.00 0.00 0.00 47.33 47.26 1mxf h GLY 191 CO 0.00 0.12 -0.38 -2.00 0.00 0.00 0.00 176.54 174.28 1mxf h LEU 192 N 0.14 0.96 -0.52 3.11 5.85 -0.28 -0.29 115.31 124.28 1mxf h LEU 192 Ca 0.02 -0.47 0.05 0.00 0.84 0.00 0.00 57.88 58.32 1mxf h LEU 192 Cb 0.59 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 1mxf h LEU 192 CO 0.04 1.24 0.25 0.74 -0.34 0.00 0.00 178.44 180.36 1mxf h THR 193 N 0.69 0.92 0.11 1.05 2.02 -0.70 0.14 112.91 117.14 1mxf h THR 193 Ca 0.05 -0.16 -0.28 0.00 0.77 0.00 0.00 66.41 66.79 1mxf h THR 193 Cb 0.98 0.40 0.02 0.00 -1.74 0.00 0.00 68.15 67.81 1mxf h THR 193 CO 0.09 0.09 -1.20 0.03 0.37 0.00 0.00 175.52 174.90 1mxf h ARG 194 N 0.48 0.48 -0.44 6.66 3.08 -1.50 -1.73 114.38 121.41 1mxf h ARG 194 Ca 0.24 -0.66 -0.04 0.00 0.07 0.00 0.00 59.98 59.59 1mxf h ARG 194 Cb 0.18 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1mxf h ARG 194 CO -0.19 1.28 0.12 0.00 -1.07 0.00 0.00 179.97 180.12 1mxf h ALA 195 N 0.45 0.58 -0.36 0.04 0.00 -0.80 -2.46 119.26 116.71 1mxf h ALA 195 Ca -0.16 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 1mxf h ALA 195 Cb 1.88 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1mxf h ALA 195 CO 0.22 0.24 -0.24 0.00 0.00 0.00 0.00 179.25 179.47 1mxf h ALA 196 N 0.98 0.51 -0.59 0.00 0.00 -0.80 -2.69 119.26 116.66 1mxf h ALA 196 Ca 0.14 -0.38 0.12 0.00 0.00 0.00 0.00 54.91 54.78 1mxf h ALA 196 Cb 0.29 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 17.88 1mxf h ALA 196 CO -0.00 0.50 0.08 0.00 0.00 0.00 0.00 179.25 179.83 1mxf h ALA 197 N 0.77 0.66 -0.39 0.00 0.00 -1.17 -0.31 119.26 118.83 1mxf h ALA 197 Ca 0.07 0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 1mxf h ALA 197 Cb 0.80 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1mxf h ALA 197 CO 0.07 -0.34 -0.36 1.25 0.00 0.00 0.00 179.25 179.86 1mxf h LEU 198 N 0.21 0.99 -0.58 0.00 5.85 -1.35 -2.67 115.31 117.75 1mxf h LEU 198 Ca 0.31 -0.46 -0.07 0.00 0.84 0.00 0.00 57.88 58.50 1mxf h LEU 198 Cb 0.48 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1mxf h LEU 198 CO -0.43 1.24 -0.34 -0.33 -0.34 0.00 0.00 178.44 178.24 1mxf h GLU 199 N 0.75 0.00 -0.02 1.25 5.08 -1.11 -3.24 114.58 117.28 1mxf h GLU 199 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1mxf h GLU 199 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1mxf h GLU 199 CO 0.09 0.34 -0.34 1.28 -1.00 0.00 0.00 179.01 179.38 1mxf n LEU 200 N -3.32 2.06 -0.30 1.33 4.32 -0.16 -4.35 117.00 116.58 1mxf n LEU 200 Ca 0.01 -0.73 0.01 0.00 -0.02 0.00 0.00 56.01 55.28 1mxf n LEU 200 Cb 0.57 -0.02 0.14 0.00 -1.62 0.00 0.00 43.42 42.49 1mxf n LEU 200 CO 0.37 0.37 1.17 0.00 -1.22 0.00 0.00 177.39 178.08 1mxf h ALA 201 N 4.04 1.16 0.00 -1.18 0.00 -1.50 -0.63 119.26 121.15 1mxf h ALA 201 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1mxf h ALA 201 Cb 0.76 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1mxf h ALA 201 CO 0.00 0.22 -0.13 -1.35 0.00 0.00 0.00 179.25 177.99 1mxf h PRO 202 N 0.91 0.00 -0.11 0.00 0.11 -1.81 -0.78 132.00 130.33 1mxf h PRO 202 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 1mxf h PRO 202 Cb 0.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 1mxf h PRO 202 CO -0.19 0.13 0.00 0.54 -0.21 0.00 0.00 178.00 178.27 1mxf n ARG 203 N -3.63 1.65 -2.42 1.05 5.12 -0.32 -4.92 116.66 113.19 1mxf n ARG 203 Ca -0.02 -0.96 -0.18 0.00 -1.93 0.00 0.00 57.85 54.76 1mxf n ARG 203 Cb 0.26 -1.42 -0.00 0.00 -1.16 0.00 0.00 32.46 30.14 1mxf n ARG 203 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1mxf n HIS 204 N 0.18 -0.95 -3.78 -1.55 8.25 -0.30 -4.98 115.22 112.08 1mxf n HIS 204 Ca 0.17 0.07 -0.37 0.00 -0.26 0.00 0.00 57.72 57.33 1mxf n HIS 204 Cb 0.32 -3.55 -0.13 0.00 1.12 0.00 0.00 29.99 27.74 1mxf n HIS 204 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1mxf s ILE 205 N -2.90 3.95 0.06 1.59 1.01 -0.72 -4.31 121.20 119.88 1mxf s ILE 205 Ca 0.04 -0.53 -0.24 0.00 0.00 0.00 0.00 60.65 59.91 1mxf s ILE 205 Cb -0.02 -2.95 -0.06 0.00 0.01 0.00 0.00 42.46 39.44 1mxf s ILE 205 CO 0.05 0.20 0.74 -0.13 0.00 0.00 0.00 174.94 175.80 1mxf s ARG 206 N 1.52 4.48 -0.20 2.79 0.52 -0.68 -4.14 118.95 123.25 1mxf s ARG 206 Ca 0.04 1.04 0.01 0.00 -0.52 0.00 0.00 55.73 56.30 1mxf s ARG 206 Cb -0.16 -3.34 0.04 0.00 0.52 0.00 0.00 34.95 32.01 1mxf s ARG 206 CO 0.02 0.36 -0.11 0.08 0.02 0.00 0.00 175.30 175.66 1mxf s VAL 207 N -0.31 1.70 0.38 3.52 1.01 -1.26 0.62 120.40 126.06 1mxf s VAL 207 Ca 0.37 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.38 1mxf s VAL 207 Cb -0.21 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 1mxf s VAL 207 CO 0.23 0.21 0.16 0.59 0.00 0.00 0.00 175.10 176.28 1mxf n ASN 208 N 4.67 0.96 -3.93 3.32 3.02 -0.38 0.11 115.26 123.03 1mxf n ASN 208 Ca -0.15 -3.06 -0.09 0.00 -0.03 0.00 0.00 54.58 51.24 1mxf n ASN 208 Cb 0.47 1.06 -0.09 0.00 -0.61 0.00 0.00 39.78 40.60 1mxf n ASN 208 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mxf s ALA 209 N -3.08 -0.08 -0.08 5.41 0.00 -0.66 -0.55 121.76 122.72 1mxf s ALA 209 Ca 0.22 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 51.68 1mxf s ALA 209 Cb 0.01 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.38 1mxf s ALA 209 CO 0.16 -0.31 -0.19 0.08 0.00 0.00 0.00 175.76 175.49 1mxf s VAL 210 N -2.56 1.66 -0.35 0.00 1.01 -0.50 0.08 120.40 119.74 1mxf s VAL 210 Ca -0.05 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.17 1mxf s VAL 210 Cb -0.01 -1.45 0.10 0.00 0.00 0.00 0.00 36.38 35.01 1mxf s VAL 210 CO -0.04 0.47 0.06 0.00 0.00 0.00 0.00 175.10 175.59 1mxf s ALA 211 N 0.42 2.92 0.68 5.51 0.00 0.44 0.16 121.76 131.89 1mxf s ALA 211 Ca -0.16 -2.52 -0.11 0.00 0.00 0.00 0.00 51.96 49.17 1mxf s ALA 211 Cb -0.17 -2.01 -0.00 0.00 0.00 0.00 0.00 23.12 20.94 1mxf s ALA 211 CO 0.06 -1.69 1.06 -2.14 0.00 0.00 0.00 175.76 173.05 1mxf s PRO 212 N 0.93 3.02 0.00 0.00 0.02 -1.25 -0.99 135.00 136.74 1mxf s PRO 212 Ca 0.10 0.97 0.00 0.00 0.02 0.00 0.00 61.00 62.09 1mxf s PRO 212 Cb -0.19 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.32 1mxf s PRO 212 CO -0.07 -1.03 0.00 0.41 -0.33 0.00 0.00 177.00 175.97 1mxf n GLY 213 N -1.92 -0.32 3.08 0.52 0.00 -1.11 -0.54 105.19 104.90 1mxf n GLY 213 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1mxf n GLY 213 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mxf s LEU 214 N -2.77 3.46 0.00 0.99 2.96 -1.26 -4.83 118.68 117.23 1mxf s LEU 214 Ca 0.00 -1.39 0.00 0.00 -0.22 0.00 0.00 54.13 52.52 1mxf s LEU 214 Cb 0.00 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 45.13 1mxf s LEU 214 CO 0.00 -0.19 0.00 -0.24 -1.32 0.00 0.00 176.35 174.60 1mxf n SER 215 N 4.44 0.00 -4.63 3.68 2.88 -1.26 -0.12 113.62 118.61 1mxf n SER 215 Ca -0.14 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 56.97 1mxf n SER 215 Cb 0.42 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.85 1mxf n SER 215 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1mxf n LEU 216 N 0.00 3.65 -4.77 2.46 4.77 -1.23 -4.49 117.00 117.39 1mxf n LEU 216 Ca 0.00 0.57 -0.32 0.00 -0.03 0.00 0.00 56.01 56.24 1mxf n LEU 216 Cb 0.00 -1.52 0.08 0.00 -2.33 0.00 0.00 43.42 39.64 1mxf n LEU 216 CO 0.00 -0.25 0.71 -0.76 -1.33 0.00 0.00 177.39 175.77 1mxf s LEU 217 N 6.29 3.14 0.22 2.23 1.43 -1.26 -4.95 118.68 125.79 1mxf s LEU 217 Ca 0.95 1.85 -0.32 0.00 -1.03 0.00 0.00 54.13 55.59 1mxf s LEU 217 Cb -0.42 -4.53 -0.12 0.00 0.03 0.00 0.00 46.19 41.15 1mxf s LEU 217 CO 0.40 -1.87 1.63 -2.65 0.23 0.00 0.00 176.35 174.09 1mxf n PRO 218 N -3.17 2.56 -0.05 1.29 -0.02 -1.26 -4.88 135.00 129.47 1mxf n PRO 218 Ca 0.09 0.92 0.12 0.00 -2.02 0.00 0.00 63.50 62.61 1mxf n PRO 218 Cb 0.53 -2.72 0.52 0.00 -0.02 0.00 0.00 33.50 31.81 1mxf n PRO 218 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1mxf h PRO 219 N 5.84 0.36 -5.94 0.52 0.13 -2.04 -3.46 132.00 127.41 1mxf h PRO 219 Ca -0.45 -0.02 -0.54 0.00 -0.87 0.00 0.00 66.00 64.12 1mxf h PRO 219 Cb 1.22 -0.08 -0.08 0.00 0.13 0.00 0.00 31.00 32.19 1mxf h PRO 219 CO 0.88 0.24 1.48 0.00 -0.23 0.00 0.00 178.00 180.37 1mxf s ALA 220 N -5.35 2.58 -0.06 -0.56 0.00 -1.26 -5.06 121.76 112.05 1mxf s ALA 220 Ca -0.07 -2.25 0.06 0.00 0.00 0.00 0.00 51.96 49.69 1mxf s ALA 220 Cb 0.19 -4.57 -0.01 0.00 0.00 0.00 0.00 23.12 18.73 1mxf s ALA 220 CO 0.74 -3.89 -0.24 -1.25 0.00 0.00 0.00 175.76 171.12 1mxf s PRO 222 N 5.30 2.64 0.30 0.00 0.04 -1.26 -5.16 135.00 136.85 1mxf s PRO 222 Ca 0.54 -0.89 0.00 0.00 0.04 0.00 0.00 61.00 60.69 1mxf s PRO 222 Cb -0.00 -2.20 0.70 0.00 0.04 0.00 0.00 34.50 33.04 1mxf s PRO 222 CO -0.03 0.36 1.58 1.96 0.04 0.00 0.00 177.00 180.91 1mxf h GLN 223 N 6.13 0.03 -0.26 4.56 4.20 -1.98 0.23 115.11 128.01 1mxf h GLN 223 Ca -0.31 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.40 1mxf h GLN 223 Cb 1.18 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.94 1mxf h GLN 223 CO 0.47 0.02 0.14 1.49 -0.67 0.00 0.00 178.83 180.28 1mxf h GLU 224 N 0.03 0.35 -0.11 1.46 4.22 -2.03 0.12 114.58 118.62 1mxf h GLU 224 Ca 0.57 -0.03 -0.12 0.00 0.08 0.00 0.00 59.36 59.86 1mxf h GLU 224 Cb 1.15 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1mxf h GLU 224 CO -0.89 0.27 -0.39 1.15 -2.18 0.00 0.00 179.01 176.96 1mxf h THR 225 N 0.36 1.38 -0.94 0.32 2.02 -1.03 -2.71 112.91 112.31 1mxf h THR 225 Ca 0.09 -1.71 0.06 0.00 0.77 0.00 0.00 66.41 65.62 1mxf h THR 225 Cb 0.02 2.15 -0.06 0.00 -1.74 0.00 0.00 68.15 68.51 1mxf h THR 225 CO -0.02 0.51 0.61 1.56 0.37 0.00 0.00 175.52 178.56 1mxf h GLN 226 N 0.05 1.08 0.00 6.66 4.20 -0.60 -1.02 115.11 125.48 1mxf h GLN 226 Ca -0.02 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 1mxf h GLN 226 Cb 1.02 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.55 1mxf h GLN 226 CO 0.08 0.71 -0.31 1.49 -0.67 0.00 0.00 178.83 180.13 1mxf h GLU 227 N 1.11 0.00 0.00 1.46 4.57 -0.73 -1.42 114.58 119.57 1mxf h GLU 227 Ca 0.40 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.46 1mxf h GLU 227 Cb 0.14 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1mxf h GLU 227 CO -0.14 0.31 -0.54 0.93 -1.18 0.00 0.00 179.01 178.39 1mxf h GLU 228 N 0.00 0.00 0.02 1.92 5.08 -0.87 -2.69 114.58 118.04 1mxf h GLU 228 Ca -0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1mxf h GLU 228 Cb 0.68 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.94 1mxf h GLU 228 CO 0.04 0.54 -0.43 1.88 -1.00 0.00 0.00 179.01 180.04 1mxf h TYR 229 N 0.00 0.39 -0.92 4.33 -1.99 -0.83 -3.33 116.97 114.61 1mxf h TYR 229 Ca -0.01 -0.23 -0.01 0.00 2.00 0.00 0.00 58.73 60.49 1mxf h TYR 229 Cb 1.21 -0.04 -0.04 0.00 2.00 0.00 0.00 36.73 39.86 1mxf h TYR 229 CO 0.00 1.07 0.55 0.00 -0.00 0.00 0.00 178.16 179.78 1mxf h ARG 230 N -0.40 1.26 0.00 4.88 3.08 -1.30 -2.29 114.38 119.60 1mxf h ARG 230 Ca -0.06 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1mxf h ARG 230 Cb 1.21 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 31.00 1mxf h ARG 230 CO 0.08 0.89 0.10 -0.09 -1.07 0.00 0.00 179.97 179.88 1mxf h ARG 231 N 1.27 0.00 0.00 0.04 2.43 -1.59 -1.66 114.38 114.88 1mxf h ARG 231 Ca 0.33 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 1mxf h ARG 231 Cb -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1mxf h ARG 231 CO -0.06 0.00 -0.15 0.87 -1.51 0.00 0.00 179.97 179.12 1mxf h LYS 232 N 0.00 0.00 -6.38 0.20 1.57 -1.55 -3.45 116.57 106.96 1mxf h LYS 232 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1mxf h LYS 232 Cb 0.20 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.47 1mxf h LYS 232 CO 0.00 0.00 1.07 0.08 -0.57 0.00 0.00 179.45 180.03 1mxf s VAL 233 N -3.22 3.90 0.21 0.50 1.01 -0.63 -4.84 120.40 117.32 1mxf s VAL 233 Ca 0.06 0.98 -0.09 0.00 0.00 0.00 0.00 61.98 62.93 1mxf s VAL 233 Cb 0.06 -4.00 0.14 0.00 0.00 0.00 0.00 36.38 32.58 1mxf s VAL 233 CO 0.68 -0.50 1.75 -0.65 0.00 0.00 0.00 175.10 176.39 1mxf h PRO 234 N 10.38 0.43 -5.20 2.72 0.11 -1.85 0.44 132.00 139.02 1mxf h PRO 234 Ca -0.29 -0.03 -0.67 0.00 0.11 0.00 0.00 66.00 65.12 1mxf h PRO 234 Cb 1.12 -0.10 -0.16 0.00 0.11 0.00 0.00 31.00 31.97 1mxf h PRO 234 CO 1.04 0.28 0.90 -1.17 -0.21 0.00 0.00 178.00 178.84 1mxf s LEU 235 N -10.38 4.79 0.00 2.35 2.96 -0.71 -4.33 118.68 113.37 1mxf s LEU 235 Ca -0.13 -1.88 0.00 0.00 -0.22 0.00 0.00 54.13 51.90 1mxf s LEU 235 Cb 0.17 -2.42 0.00 0.00 0.50 0.00 0.00 46.19 44.44 1mxf s LEU 235 CO 0.75 -1.15 0.00 0.61 -1.32 0.00 0.00 176.35 175.23 1mxf n GLY 236 N 5.67 0.81 4.31 7.98 0.00 -1.26 -4.31 105.19 118.39 1mxf n GLY 236 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 1mxf n GLY 236 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mxf n GLN 237 N -2.13 -2.07 -3.93 1.61 3.00 0.14 -4.92 117.38 109.09 1mxf n GLN 237 Ca 0.00 0.26 -0.10 0.00 -0.01 0.00 0.00 57.00 57.15 1mxf n GLN 237 Cb 0.00 -4.69 -0.11 0.00 0.00 0.00 0.00 30.24 25.43 1mxf n GLN 237 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1mxf s SER 238 N -3.56 0.12 0.71 1.08 0.15 -1.22 -4.14 113.70 106.84 1mxf s SER 238 Ca 0.58 -0.30 -0.11 0.00 0.70 0.00 0.00 55.95 56.82 1mxf s SER 238 Cb -0.33 0.13 0.02 0.00 -1.71 0.00 0.00 66.02 64.13 1mxf s SER 238 CO 0.97 -0.26 1.07 -1.83 1.20 0.00 0.00 173.24 174.39 1mxf s GLU 239 N -1.14 2.80 0.12 5.44 1.03 -1.26 -4.86 118.70 120.82 1mxf s GLU 239 Ca -0.12 0.72 -0.30 0.00 0.03 0.00 0.00 54.97 55.29 1mxf s GLU 239 Cb -0.07 -1.99 -0.06 0.00 -0.80 0.00 0.00 34.13 31.20 1mxf s GLU 239 CO -0.00 -1.14 1.09 0.00 -1.33 0.00 0.00 175.26 173.88 1mxf s ALA 240 N -3.17 3.33 0.63 -0.84 0.00 0.82 -4.94 121.76 117.60 1mxf s ALA 240 Ca 0.58 0.76 -0.12 0.00 0.00 0.00 0.00 51.96 53.18 1mxf s ALA 240 Cb -0.13 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 1mxf s ALA 240 CO 0.54 -0.24 1.04 -1.54 0.00 0.00 0.00 175.76 175.56 1mxf s SER 241 N 0.32 5.88 0.43 0.00 1.04 -1.26 -3.56 113.70 116.55 1mxf s SER 241 Ca 0.52 1.58 0.09 0.00 0.48 0.00 0.00 55.95 58.62 1mxf s SER 241 Cb -0.28 -2.49 0.95 0.00 0.10 0.00 0.00 66.02 64.30 1mxf s SER 241 CO 0.32 -1.10 2.07 0.00 0.98 0.00 0.00 173.24 175.50 1mxf h ALA 242 N -0.20 1.79 -0.51 5.32 0.00 -1.95 -2.19 119.26 121.52 1mxf h ALA 242 Ca -0.45 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 1mxf h ALA 242 Cb 1.20 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1mxf h ALA 242 CO 0.59 0.18 -0.02 0.00 0.00 0.00 0.00 179.25 180.00 1mxf h ALA 243 N 1.78 1.00 -0.24 0.00 0.00 -1.93 -0.43 119.26 119.44 1mxf h ALA 243 Ca 0.14 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1mxf h ALA 243 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1mxf h ALA 243 CO -0.03 0.61 -0.14 1.96 0.00 0.00 0.00 179.25 181.64 1mxf h GLN 244 N 0.81 0.41 -0.11 0.00 4.20 -1.77 0.28 115.11 118.92 1mxf h GLN 244 Ca 0.15 -0.12 -0.22 0.00 0.06 0.00 0.00 58.65 58.52 1mxf h GLN 244 Cb 0.51 -0.04 0.01 0.00 0.30 0.00 0.00 27.48 28.26 1mxf h GLN 244 CO 0.03 0.55 -0.82 0.82 -0.67 0.00 0.00 178.83 178.74 1mxf h ILE 245 N 0.38 1.30 -0.80 2.54 1.08 -1.29 -3.12 117.51 117.60 1mxf h ILE 245 Ca 0.07 -2.07 0.00 0.00 -0.39 0.00 0.00 64.86 62.48 1mxf h ILE 245 Cb 0.48 2.08 -0.04 0.00 -3.07 0.00 0.00 36.82 36.28 1mxf h ILE 245 CO 0.03 0.65 0.51 0.00 -0.69 0.00 0.00 178.15 178.65 1mxf h ALA 246 N 0.61 1.02 -0.62 1.87 0.00 -0.56 -2.55 119.26 119.03 1mxf h ALA 246 Ca -0.06 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 54.90 1mxf h ALA 246 Cb 1.44 -0.32 -0.09 0.00 0.00 0.00 0.00 17.79 18.82 1mxf h ALA 246 CO 0.16 0.45 0.13 -0.44 0.00 0.00 0.00 179.25 179.56 1mxf h ASP 247 N 1.09 0.00 -0.53 0.00 3.32 -0.90 0.15 116.42 119.56 1mxf h ASP 247 Ca 0.29 0.12 -0.07 0.00 0.02 0.00 0.00 57.03 57.39 1mxf h ASP 247 Cb -0.10 0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1mxf h ASP 247 CO -0.06 0.00 0.06 0.00 -1.72 0.00 0.00 179.24 177.53 1mxf h ALA 248 N 1.50 0.70 -0.67 3.45 0.00 -1.42 -1.68 119.26 121.14 1mxf h ALA 248 Ca 0.33 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1mxf h ALA 248 Cb 0.50 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1mxf h ALA 248 CO -0.42 0.46 0.12 0.82 0.00 0.00 0.00 179.25 180.24 1mxf h ILE 249 N 0.77 1.26 -0.96 0.00 2.04 -1.01 -2.15 117.51 117.46 1mxf h ILE 249 Ca 0.16 -1.03 -0.00 0.00 1.00 0.00 0.00 64.86 64.99 1mxf h ILE 249 Cb 0.44 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 1mxf h ILE 249 CO 0.01 0.39 0.59 0.00 0.00 0.00 0.00 178.15 179.15 1mxf h ALA 250 N 1.05 1.23 -0.21 1.87 0.00 -0.48 -1.95 119.26 120.77 1mxf h ALA 250 Ca 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1mxf h ALA 250 Cb 0.43 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1mxf h ALA 250 CO 0.01 0.66 0.08 0.35 0.00 0.00 0.00 179.25 180.35 1mxf h PHE 251 N 1.32 0.33 0.00 0.00 3.57 -0.97 -2.33 116.94 118.86 1mxf h PHE 251 Ca 0.35 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 1mxf h PHE 251 Cb -0.08 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.56 1mxf h PHE 251 CO 0.00 0.38 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.30 1mxf h LEU 252 N 0.18 0.00 0.00 0.59 3.38 -0.85 -2.49 115.31 116.12 1mxf h LEU 252 Ca 0.07 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1mxf h LEU 252 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1mxf h LEU 252 CO -0.00 0.09 -1.06 -0.37 0.09 0.00 0.00 178.44 177.18 1mxf h VAL 253 N 0.00 0.17 -3.95 1.22 -1.51 -1.25 -3.45 116.25 107.48 1mxf h VAL 253 Ca -0.00 -1.33 -0.47 0.00 -1.23 0.00 0.00 66.70 63.67 1mxf h VAL 253 Cb 0.36 1.71 0.16 0.00 -2.13 0.00 0.00 31.29 31.38 1mxf h VAL 253 CO 0.01 0.10 0.21 -0.94 -1.23 0.00 0.00 177.57 175.72 1mxf s SER 254 N -5.56 2.97 0.23 4.19 1.04 -0.89 -4.92 113.70 110.76 1mxf s SER 254 Ca -0.01 1.39 0.23 0.00 0.48 0.00 0.00 55.95 58.05 1mxf s SER 254 Cb 0.09 -2.07 0.94 0.00 0.10 0.00 0.00 66.02 65.08 1mxf s SER 254 CO 0.79 -2.94 1.70 0.29 0.98 0.00 0.00 173.24 174.05 1mxf n LYS 255 N -4.07 0.18 0.00 4.02 5.02 -1.26 -2.45 118.16 119.59 1mxf n LYS 255 Ca 0.06 0.39 0.08 0.00 -2.02 0.00 0.00 58.31 56.82 1mxf n LYS 255 Cb 0.56 -1.83 0.50 0.00 -0.02 0.00 0.00 35.03 34.24 1mxf n LYS 255 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1mxf n ASP 256 N -2.17 0.00 -0.39 4.39 9.92 -1.26 -2.27 116.55 124.77 1mxf n ASP 256 Ca 0.03 -0.88 0.04 0.00 -0.53 0.00 0.00 54.79 53.44 1mxf n ASP 256 Cb 0.24 0.00 0.05 0.00 -0.64 0.00 0.00 41.12 40.77 1mxf n ASP 256 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1mxf n ALA 257 N -0.87 2.13 0.21 2.24 0.00 -1.03 -4.88 120.51 118.32 1mxf n ALA 257 Ca 0.13 -1.64 0.10 0.00 0.00 0.00 0.00 53.44 52.03 1mxf n ALA 257 Cb 0.06 -0.47 0.53 0.00 0.00 0.00 0.00 19.45 19.57 1mxf n ALA 257 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1mxf h GLY 258 N 0.05 0.00 -1.20 0.00 0.00 -1.58 0.13 103.07 100.47 1mxf h GLY 258 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1mxf h GLY 258 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 176.54 179.52 1mxf n TYR 259 N -2.33 0.24 -3.56 5.60 9.36 -1.26 -4.94 117.16 120.27 1mxf n TYR 259 Ca -0.01 -0.23 -0.39 0.00 3.32 0.00 0.00 57.90 60.59 1mxf n TYR 259 Cb 0.29 -0.01 -0.11 0.00 -0.63 0.00 0.00 39.34 38.89 1mxf n TYR 259 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1mxf s ILE 260 N -1.03 5.30 -0.08 2.97 1.01 0.44 -5.05 121.20 124.76 1mxf s ILE 260 Ca 0.20 -0.00 -0.14 0.00 0.00 0.00 0.00 60.65 60.70 1mxf s ILE 260 Cb 0.12 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 39.00 1mxf s ILE 260 CO 0.17 0.13 0.35 0.28 0.00 0.00 0.00 174.94 175.86 1mxf s THR 261 N 1.75 0.03 -0.05 2.92 -1.32 -1.26 -4.71 115.64 112.99 1mxf s THR 261 Ca 0.07 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 1mxf s THR 261 Cb -0.17 -0.58 0.00 0.00 -1.51 0.00 0.00 72.50 70.25 1mxf s THR 261 CO 0.11 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 173.00 1mxf n GLY 262 N 2.06 0.42 3.71 6.08 0.00 0.30 -4.93 105.19 112.82 1mxf n GLY 262 Ca -0.17 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1mxf n GLY 262 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mxf s THR 263 N -1.80 4.13 -0.20 2.61 -4.23 -1.26 -4.73 115.64 110.16 1mxf s THR 263 Ca 0.00 -0.93 -0.05 0.00 -1.18 0.00 0.00 61.69 59.52 1mxf s THR 263 Cb 0.00 -2.97 -0.03 0.00 1.34 0.00 0.00 72.50 70.84 1mxf s THR 263 CO 0.00 0.13 0.01 -0.89 -0.54 0.00 0.00 174.62 173.32 1mxf s THR 264 N -1.32 4.05 -0.35 3.99 2.01 -1.26 -1.65 115.64 121.10 1mxf s THR 264 Ca 0.26 -0.28 -0.12 0.00 0.31 0.00 0.00 61.69 61.86 1mxf s THR 264 Cb -0.12 -2.83 0.00 0.00 0.01 0.00 0.00 72.50 69.56 1mxf s THR 264 CO 0.19 0.43 0.22 -0.22 -0.69 0.00 0.00 174.62 174.56 1mxf s LEU 265 N 0.91 4.57 0.08 4.42 2.96 0.11 -4.95 118.68 126.78 1mxf s LEU 265 Ca 0.01 -0.64 -0.28 0.00 -0.22 0.00 0.00 54.13 53.01 1mxf s LEU 265 Cb -0.14 -2.09 -0.06 0.00 0.50 0.00 0.00 46.19 44.40 1mxf s LEU 265 CO 0.02 -0.29 0.87 -0.75 -1.32 0.00 0.00 176.35 174.88 1mxf s LYS 266 N 1.66 4.60 -0.49 1.98 2.20 -1.26 -0.42 119.74 128.01 1mxf s LYS 266 Ca 0.05 1.27 0.05 0.00 -0.36 0.00 0.00 55.97 56.98 1mxf s LYS 266 Cb -0.18 -3.37 0.19 0.00 -1.51 0.00 0.00 37.83 32.96 1mxf s LYS 266 CO 0.09 0.24 0.45 0.28 -0.36 0.00 0.00 175.35 176.05 1mxf n VAL 267 N 2.80 -0.14 -0.87 4.02 0.31 -0.16 -4.90 118.33 119.39 1mxf n VAL 267 Ca 0.00 -4.03 0.03 0.00 -0.01 0.00 0.00 64.34 60.33 1mxf n VAL 267 Cb 0.50 -1.88 0.04 0.00 -0.91 0.00 0.00 33.84 31.59 1mxf n VAL 267 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1mxf n ASP 268 N 2.17 1.36 -2.29 4.52 5.75 -1.26 -2.75 116.55 124.04 1mxf n ASP 268 Ca 0.26 -2.13 -0.13 0.00 -0.01 0.00 0.00 54.79 52.78 1mxf n ASP 268 Cb 0.45 -0.16 -0.01 0.00 -1.03 0.00 0.00 41.12 40.37 1mxf n ASP 268 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1mxf n GLY 269 N -0.60 -0.27 2.45 6.12 0.00 -1.26 -1.16 105.19 110.48 1mxf n GLY 269 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1mxf n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mxf n GLY 270 N -0.74 0.89 0.31 -0.02 0.00 -1.26 -1.73 105.19 102.65 1mxf n GLY 270 Ca -0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.93 1mxf n GLY 270 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1mxf h LEU 271 N 0.00 0.63 -2.05 0.99 5.85 -1.46 -0.85 115.31 118.42 1mxf h LEU 271 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1mxf h LEU 271 Cb 0.00 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1mxf h LEU 271 CO 0.00 0.31 0.00 -0.29 -0.34 0.00 0.00 178.44 178.12 1mxf h ILE 272 N 0.73 0.00 0.00 4.05 2.10 -1.93 -2.62 117.51 119.84 1mxf h ILE 272 Ca 0.45 -0.31 0.00 0.00 1.08 0.00 0.00 64.86 66.07 1mxf h ILE 272 Cb 0.55 1.31 0.00 0.00 -1.09 0.00 0.00 36.82 37.59 1mxf h ILE 272 CO -0.31 0.00 -0.16 0.18 -1.08 0.00 0.00 178.15 176.78 1mxf n LEU 273 N -3.08 0.63 -4.72 2.19 4.32 -0.33 -4.88 117.00 111.13 1mxf n LEU 273 Ca -0.01 0.46 -0.42 0.00 -0.02 0.00 0.00 56.01 56.02 1mxf n LEU 273 Cb 0.21 -0.32 -0.03 0.00 -1.62 0.00 0.00 43.42 41.67 1mxf n LEU 273 CO 0.24 -0.11 1.02 0.00 -1.22 0.00 0.00 177.39 177.33 1mxf s ALA 274 N -3.09 3.55 0.04 -1.18 0.00 -0.99 -5.01 121.76 115.08 1mxf s ALA 274 Ca 0.10 1.08 -0.22 0.00 0.00 0.00 0.00 51.96 52.93 1mxf s ALA 274 Cb 0.14 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 1mxf s ALA 274 CO 0.62 -0.57 0.64 0.50 0.00 0.00 0.00 175.76 176.94 1mxf s ARG 275 N 0.85 4.35 0.00 0.00 3.52 -1.26 -5.10 118.95 121.31 1mxf s ARG 275 Ca 0.62 0.84 0.31 0.00 -0.13 0.00 0.00 55.73 57.37 1mxf s ARG 275 Cb -0.36 -3.31 1.84 0.00 -1.56 0.00 0.00 34.95 31.56 1mxf s ARG 275 CO 0.32 0.44 2.17 0.00 -0.81 0.00 0.00 175.30 177.42