#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 2.98 0.07 0.00 0.04 -1.26 -4.82 135.00 132.01 1mxf s PRO 12 Ca 0.00 1.46 0.09 0.00 0.04 0.00 0.00 61.00 62.59 1mxf s PRO 12 Cb 0.00 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 1mxf s PRO 12 CO 0.00 -1.12 -0.22 0.00 0.04 0.00 0.00 177.00 175.70 1mxf s ALA 13 N -2.15 2.47 -0.01 8.56 0.00 -1.26 -1.00 121.76 128.37 1mxf s ALA 13 Ca 0.69 -1.29 0.03 0.00 0.00 0.00 0.00 51.96 51.39 1mxf s ALA 13 Cb -0.22 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 1mxf s ALA 13 CO 0.37 0.56 -0.10 0.00 0.00 0.00 0.00 175.76 176.59 1mxf s ALA 14 N -0.95 0.81 -0.12 0.00 0.00 0.25 -0.35 121.76 121.40 1mxf s ALA 14 Ca 0.14 -0.42 -0.05 0.00 0.00 0.00 0.00 51.96 51.64 1mxf s ALA 14 Cb -0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 1mxf s ALA 14 CO 0.05 0.20 0.06 0.08 0.00 0.00 0.00 175.76 176.15 1mxf s VAL 15 N -0.22 4.83 -0.20 0.00 1.01 -0.07 0.10 120.40 125.84 1mxf s VAL 15 Ca 0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 1mxf s VAL 15 Cb -0.04 -3.09 0.06 0.00 0.00 0.00 0.00 36.38 33.31 1mxf s VAL 15 CO -0.00 0.58 0.01 -0.63 0.00 0.00 0.00 175.10 175.05 1mxf s ILE 16 N -0.65 0.82 0.32 2.22 1.09 -0.72 -1.40 121.20 122.89 1mxf s ILE 16 Ca 0.11 -0.75 -0.27 0.00 -1.10 0.00 0.00 60.65 58.65 1mxf s ILE 16 Cb -0.12 -1.25 -0.09 0.00 -1.06 0.00 0.00 42.46 39.94 1mxf s ILE 16 CO 0.02 -0.17 1.02 0.42 -0.10 0.00 0.00 174.94 176.13 1mxf s THR 17 N 1.72 3.85 -1.51 2.92 -4.23 -0.96 -1.59 115.64 115.83 1mxf s THR 17 Ca -0.02 1.62 -0.05 0.00 -1.18 0.00 0.00 61.69 62.05 1mxf s THR 17 Cb -0.18 -3.94 0.02 0.00 1.34 0.00 0.00 72.50 69.74 1mxf s THR 17 CO -0.07 0.21 0.58 0.61 -0.54 0.00 0.00 174.62 175.41 1mxf n GLY 18 N 0.79 -0.52 0.59 3.99 0.00 -0.90 -2.66 105.19 106.48 1mxf n GLY 18 Ca 0.02 0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.46 0.51 0.07 -0.02 0.00 -0.43 -4.17 105.19 99.69 1mxf n GLY 19 Ca -0.10 -0.34 -0.06 0.00 0.00 0.00 0.00 46.02 45.52 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 3.56 0.45 -2.56 4.61 0.00 -1.87 -3.03 119.26 120.42 1mxf h ALA 20 Ca 0.00 -0.85 -0.39 0.00 0.00 0.00 0.00 54.91 53.67 1mxf h ALA 20 Cb 0.43 -0.15 -0.14 0.00 0.00 0.00 0.00 17.79 17.94 1mxf h ALA 20 CO 0.00 1.17 -0.55 1.03 0.00 0.00 0.00 179.25 180.90 1mxf s ARG 21 N -2.86 1.55 2.32 0.00 0.52 -1.26 -4.59 118.95 114.63 1mxf s ARG 21 Ca 0.00 -1.88 0.00 0.00 -0.52 0.00 0.00 55.73 53.34 1mxf s ARG 21 Cb 0.10 0.10 0.00 0.00 0.52 0.00 0.00 34.95 35.68 1mxf s ARG 21 CO 0.81 -0.49 0.00 0.54 0.02 0.00 0.00 175.30 176.18 1mxf n ARG 22 N -0.52 0.00 -0.19 3.54 1.74 -1.26 -1.66 116.66 118.31 1mxf n ARG 22 Ca 0.03 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.02 1mxf n ARG 22 Cb 0.64 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 32.10 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 1.25 -0.58 0.55 2.04 -1.93 -2.32 117.51 116.53 1mxf h ILE 23 Ca 0.00 -0.98 0.03 0.00 1.00 0.00 0.00 64.86 64.91 1mxf h ILE 23 Cb 0.00 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 1mxf h ILE 23 CO 0.00 0.35 0.34 1.23 0.00 0.00 0.00 178.15 180.07 1mxf h GLY 24 N 0.77 0.82 0.58 5.37 0.00 -1.62 -0.80 103.07 108.20 1mxf h GLY 24 Ca 0.16 -0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.27 1mxf h GLY 24 CO 0.01 0.20 -0.14 0.84 0.00 0.00 0.00 176.54 177.45 1mxf h HIS 25 N 0.66 -0.37 -1.00 5.60 -0.00 -1.18 0.03 115.15 118.90 1mxf h HIS 25 Ca 0.24 0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.68 1mxf h HIS 25 Cb 0.06 0.17 -0.06 0.00 -0.00 0.00 0.00 27.41 27.58 1mxf h HIS 25 CO -0.07 -0.21 0.65 1.03 -0.00 0.00 0.00 177.93 179.33 1mxf h SER 26 N -0.22 1.05 -0.38 3.26 0.87 -0.93 -1.62 113.55 115.59 1mxf h SER 26 Ca 0.06 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.56 1mxf h SER 26 Cb 0.31 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 1mxf h SER 26 CO -0.18 0.69 -0.04 0.40 -0.53 0.00 0.00 176.83 177.18 1mxf h ILE 27 N 1.20 1.27 -0.82 2.23 2.04 -0.56 -1.86 117.51 121.00 1mxf h ILE 27 Ca 0.42 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1mxf h ILE 27 Cb 0.10 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 1mxf h ILE 27 CO -0.15 0.36 0.53 0.00 0.00 0.00 0.00 178.15 178.89 1mxf h ALA 28 N 0.85 1.04 -0.45 1.87 0.00 -0.46 -1.76 119.26 120.35 1mxf h ALA 28 Ca 0.10 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1mxf h ALA 28 Cb 0.52 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1mxf h ALA 28 CO 0.03 0.47 -0.18 0.28 0.00 0.00 0.00 179.25 179.84 1mxf h VAL 29 N 1.12 1.27 -0.42 0.00 2.07 -1.24 -2.28 116.25 116.77 1mxf h VAL 29 Ca 0.30 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 1mxf h VAL 29 Cb -0.11 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 1mxf h VAL 29 CO -0.06 0.45 0.18 -0.09 0.02 0.00 0.00 177.57 178.07 1mxf h ARG 30 N 0.76 0.62 -0.43 1.57 9.65 -1.06 -1.64 114.38 123.85 1mxf h ARG 30 Ca 0.11 -0.11 -0.11 0.00 -1.10 0.00 0.00 59.98 58.77 1mxf h ARG 30 Cb 0.74 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.20 1mxf h ARG 30 CO 0.06 0.57 -0.17 -0.07 2.80 0.00 0.00 179.97 183.16 1mxf h LEU 31 N 0.53 0.82 -0.87 3.80 3.38 -1.33 -2.92 115.31 118.72 1mxf h LEU 31 Ca 0.14 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1mxf h LEU 31 Cb 0.17 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1mxf h LEU 31 CO -0.01 0.99 0.07 -0.74 0.09 0.00 0.00 178.44 178.83 1mxf h HIS 32 N 0.72 0.96 0.00 1.13 2.76 -1.23 -0.68 115.15 118.81 1mxf h HIS 32 Ca 0.11 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1mxf h HIS 32 Cb 0.68 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.37 1mxf h HIS 32 CO 0.04 0.83 0.00 1.04 -1.30 0.00 0.00 177.93 178.54 1mxf n GLN 33 N -4.23 0.18 -0.39 5.26 6.02 -0.63 -1.75 117.38 121.83 1mxf n GLN 33 Ca 0.03 0.17 0.08 0.00 -0.01 0.00 0.00 57.00 57.27 1mxf n GLN 33 Cb 0.28 -1.50 0.24 0.00 1.02 0.00 0.00 30.24 30.28 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 -1.30 2.97 0.00 -1.09 6.02 -0.30 -4.95 117.38 118.73 1mxf n GLN 34 Ca 0.06 -2.66 0.00 0.00 -0.01 0.00 0.00 57.00 54.40 1mxf n GLN 34 Cb 0.11 -1.71 0.00 0.00 1.02 0.00 0.00 30.24 29.65 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 -0.22 0.38 3.75 1.08 0.00 -0.72 -5.05 105.19 104.40 1mxf n GLY 35 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.11 3.30 -0.39 1.61 0.08 -0.94 -4.42 117.98 115.11 1mxf s PHE 36 Ca 0.00 1.36 -0.15 0.00 0.12 0.00 0.00 56.93 58.26 1mxf s PHE 36 Cb 0.00 -3.54 0.01 0.00 -0.57 0.00 0.00 43.02 38.92 1mxf s PHE 36 CO 0.00 -1.56 0.34 1.03 -0.10 0.00 0.00 175.22 174.93 1mxf s ARG 37 N -0.63 3.23 -0.06 0.44 0.52 -0.17 -4.18 118.95 118.10 1mxf s ARG 37 Ca 0.53 -0.75 -0.04 0.00 -0.52 0.00 0.00 55.73 54.94 1mxf s ARG 37 Cb -0.36 -3.91 -0.04 0.00 0.52 0.00 0.00 34.95 31.17 1mxf s ARG 37 CO 0.41 -0.67 0.14 0.14 0.02 0.00 0.00 175.30 175.34 1mxf s VAL 38 N 1.88 5.30 -0.34 3.52 -7.23 -0.76 -0.58 120.40 122.20 1mxf s VAL 38 Ca 0.09 -0.04 -0.12 0.00 -1.81 0.00 0.00 61.98 60.09 1mxf s VAL 38 Cb -0.18 -3.39 -0.01 0.00 0.56 0.00 0.00 36.38 33.37 1mxf s VAL 38 CO 0.11 0.47 0.23 -0.69 -0.31 0.00 0.00 175.10 174.91 1mxf s VAL 39 N -1.16 5.12 -0.45 1.32 1.01 0.11 -2.71 120.40 123.64 1mxf s VAL 39 Ca 0.21 -0.33 -0.25 0.00 0.00 0.00 0.00 61.98 61.61 1mxf s VAL 39 Cb -0.12 -3.66 0.03 0.00 0.00 0.00 0.00 36.38 32.63 1mxf s VAL 39 CO 0.11 -0.03 0.91 -0.69 0.00 0.00 0.00 175.10 175.39 1mxf s VAL 40 N 1.69 4.51 0.14 2.92 1.01 -0.31 -1.76 120.40 128.60 1mxf s VAL 40 Ca 0.06 0.75 -0.13 0.00 0.00 0.00 0.00 61.98 62.65 1mxf s VAL 40 Cb -0.18 -4.41 -0.07 0.00 0.00 0.00 0.00 36.38 31.73 1mxf s VAL 40 CO 0.09 -0.79 0.53 -2.28 0.00 0.00 0.00 175.10 172.65 1mxf s HIS 41 N 3.67 3.60 0.24 5.22 5.04 -0.62 -1.92 115.29 130.50 1mxf s HIS 41 Ca 0.36 1.01 -0.14 0.00 -1.54 0.00 0.00 55.06 54.75 1mxf s HIS 41 Cb -0.11 -2.33 0.00 0.00 0.04 0.00 0.00 32.58 30.19 1mxf s HIS 41 CO 0.25 0.44 0.49 1.52 -2.34 0.00 0.00 174.74 175.10 1mxf s TYR 42 N -1.47 0.25 0.10 3.88 1.13 -0.50 -1.31 117.35 119.44 1mxf s TYR 42 Ca 0.37 -0.62 0.00 0.00 -1.41 0.00 0.00 57.07 55.42 1mxf s TYR 42 Cb -0.15 0.24 0.00 0.00 -1.10 0.00 0.00 41.96 40.96 1mxf s TYR 42 CO 0.19 -0.98 0.00 -2.13 -2.51 0.00 0.00 175.55 170.12 1mxf n ARG 43 N -0.37 0.00 -0.03 -3.49 0.63 -1.26 -1.70 116.66 110.44 1mxf n ARG 43 Ca -0.03 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.90 1mxf n ARG 43 Cb 0.62 -0.46 -0.09 0.00 0.45 0.00 0.00 32.46 32.97 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 -3.44 0.00 -1.53 -0.14 8.25 -1.26 -4.75 115.22 112.36 1mxf n HIS 44 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 1mxf n HIS 44 Cb 0.05 -0.42 -0.02 0.00 1.12 0.00 0.00 29.99 30.71 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 -2.17 8.46 -0.15 0.41 7.64 -1.26 -4.66 113.62 121.88 1mxf n SER 45 Ca -0.10 -2.76 -0.09 0.00 1.01 0.00 0.00 58.87 56.93 1mxf n SER 45 Cb 0.59 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.31 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 4.81 0.67 -0.23 1.43 4.22 -1.96 -2.08 114.58 121.44 1mxf h GLU 46 Ca 0.81 -0.12 -0.02 0.00 0.08 0.00 0.00 59.36 60.11 1mxf h GLU 46 Cb 0.31 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1mxf h GLU 46 CO 1.65 0.62 0.08 0.78 -2.18 0.00 0.00 179.01 179.96 1mxf h GLY 47 N 0.58 0.38 1.33 1.92 0.00 -2.00 -2.01 103.07 103.26 1mxf h GLY 47 Ca 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 1mxf h GLY 47 CO -0.01 0.20 0.37 0.00 0.00 0.00 0.00 176.54 177.10 1mxf h ALA 48 N 0.91 1.43 -0.42 3.60 0.00 -1.89 -1.61 119.26 121.27 1mxf h ALA 48 Ca 0.07 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1mxf h ALA 48 Cb 0.22 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1mxf h ALA 48 CO -0.00 0.48 0.01 0.00 0.00 0.00 0.00 179.25 179.74 1mxf h ALA 49 N 1.51 0.57 -0.47 0.00 0.00 -1.17 -1.37 119.26 118.32 1mxf h ALA 49 Ca 0.23 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1mxf h ALA 49 Cb 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1mxf h ALA 49 CO -0.04 0.35 0.12 1.96 0.00 0.00 0.00 179.25 181.64 1mxf h GLN 50 N 0.58 0.75 -0.12 0.00 4.20 -0.99 -0.99 115.11 118.55 1mxf h GLN 50 Ca 0.12 -0.18 -0.05 0.00 0.06 0.00 0.00 58.65 58.61 1mxf h GLN 50 Cb 0.47 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 1mxf h GLN 50 CO 0.02 0.73 -0.14 0.00 -0.67 0.00 0.00 178.83 178.77 1mxf h ARG 51 N 0.63 0.18 -0.02 1.46 3.08 -1.18 -0.90 114.38 117.64 1mxf h ARG 51 Ca 0.15 -0.04 -0.18 0.00 0.07 0.00 0.00 59.98 59.98 1mxf h ARG 51 Cb 0.31 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.35 1mxf h ARG 51 CO 0.00 0.33 -0.69 1.25 -1.07 0.00 0.00 179.97 179.79 1mxf h LEU 52 N 0.18 0.64 0.07 3.04 5.85 -0.85 -2.33 115.31 121.91 1mxf h LEU 52 Ca 0.04 -0.74 -0.00 0.00 0.84 0.00 0.00 57.88 58.02 1mxf h LEU 52 Cb 0.36 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1mxf h LEU 52 CO 0.02 1.29 -0.03 0.58 -0.34 0.00 0.00 178.44 179.96 1mxf h VAL 53 N 0.05 1.10 -0.40 1.05 2.07 -1.05 0.05 116.25 119.11 1mxf h VAL 53 Ca -0.08 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 66.94 1mxf h VAL 53 Cb 1.38 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 32.55 1mxf h VAL 53 CO 0.14 0.14 0.06 0.00 0.02 0.00 0.00 177.57 177.92 1mxf h ALA 54 N 0.57 0.42 -0.93 1.67 0.00 -1.28 0.46 119.26 120.17 1mxf h ALA 54 Ca -0.01 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1mxf h ALA 54 Cb 0.30 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1mxf h ALA 54 CO 0.01 -0.35 0.61 1.49 0.00 0.00 0.00 179.25 181.02 1mxf h GLU 55 N 0.18 1.10 -0.01 0.00 4.81 -1.29 -0.01 114.58 119.37 1mxf h GLU 55 Ca 0.20 -0.07 -0.26 0.00 -0.13 0.00 0.00 59.36 59.10 1mxf h GLU 55 Cb 0.25 -0.25 0.02 0.00 0.63 0.00 0.00 28.75 29.41 1mxf h GLU 55 CO -0.28 0.73 -1.03 -0.07 -0.73 0.00 0.00 179.01 177.63 1mxf h LEU 56 N 1.14 0.90 -0.81 1.64 3.38 0.70 -3.21 115.31 119.05 1mxf h LEU 56 Ca 0.38 -0.72 -0.10 0.00 0.09 0.00 0.00 57.88 57.53 1mxf h LEU 56 Cb 0.06 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1mxf h LEU 56 CO -0.12 1.52 -0.17 0.78 0.09 0.00 0.00 178.44 180.54 1mxf h ASN 57 N 0.40 0.71 -0.94 -0.43 2.35 0.11 -2.14 115.58 115.63 1mxf h ASN 57 Ca -0.12 -0.23 0.19 0.00 -0.55 0.00 0.00 56.30 55.59 1mxf h ASN 57 Cb 1.68 -0.19 -0.08 0.00 0.05 0.00 0.00 38.32 39.78 1mxf h ASN 57 CO 0.20 0.88 0.60 0.00 -1.65 0.00 0.00 177.43 177.47 1mxf h ALA 58 N 1.18 1.98 0.00 -0.83 0.00 -1.02 0.24 119.26 120.81 1mxf h ALA 58 Ca 0.10 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1mxf h ALA 58 Cb 0.64 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1mxf h ALA 58 CO 0.04 -0.28 -0.53 0.00 0.00 0.00 0.00 179.25 178.48 1mxf h ALA 59 N 1.61 0.67 -0.95 0.00 0.00 -1.41 -3.43 119.26 115.76 1mxf h ALA 59 Ca 0.50 -0.49 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1mxf h ALA 59 Cb 1.02 -0.09 -0.21 0.00 0.00 0.00 0.00 17.79 18.51 1mxf h ALA 59 CO -0.25 0.67 -0.33 1.03 0.00 0.00 0.00 179.25 180.37 1mxf s ARG 60 N -2.99 0.54 0.39 0.00 0.52 0.71 -5.13 118.95 112.98 1mxf s ARG 60 Ca 0.03 0.63 -0.24 0.00 -0.52 0.00 0.00 55.73 55.64 1mxf s ARG 60 Cb 0.08 0.31 -0.13 0.00 0.52 0.00 0.00 34.95 35.73 1mxf s ARG 60 CO 0.75 -0.90 0.61 0.00 0.02 0.00 0.00 175.30 175.78 1mxf n ALA 61 N 5.41 -1.43 -3.17 2.13 0.00 -0.37 -1.84 120.51 121.23 1mxf n ALA 61 Ca 0.04 0.22 -0.22 0.00 0.00 0.00 0.00 53.44 53.47 1mxf n ALA 61 Cb 0.53 -1.79 0.01 0.00 0.00 0.00 0.00 19.45 18.20 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 1.72 -0.50 0.12 0.00 0.00 -1.26 -4.85 105.19 100.43 1mxf n GLY 62 Ca 0.12 0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.30 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 -2.29 1.01 -3.90 1.61 3.41 -0.77 -4.99 113.62 107.70 1mxf n SER 63 Ca -0.05 -1.00 -0.11 0.00 -0.26 0.00 0.00 58.87 57.44 1mxf n SER 63 Cb 0.57 0.82 -0.12 0.00 -0.26 0.00 0.00 64.21 65.22 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 -2.23 -0.09 0.12 7.33 0.00 -1.26 -1.83 121.76 123.80 1mxf s ALA 64 Ca 0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 51.96 51.86 1mxf s ALA 64 Cb 0.12 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 1mxf s ALA 64 CO 0.54 -0.11 0.07 0.54 0.00 0.00 0.00 175.76 176.80 1mxf s VAL 65 N -0.78 0.12 0.28 0.00 0.11 -1.10 -4.89 120.40 114.13 1mxf s VAL 65 Ca -0.09 -1.82 0.08 0.00 -2.93 0.00 0.00 61.98 57.23 1mxf s VAL 65 Cb -0.05 -1.92 -0.04 0.00 -1.53 0.00 0.00 36.38 32.84 1mxf s VAL 65 CO -0.00 -0.53 0.14 -0.22 -3.33 0.00 0.00 175.10 171.16 1mxf s LEU 66 N -3.01 3.54 -0.30 2.54 2.96 -1.26 -1.16 118.68 121.98 1mxf s LEU 66 Ca 0.20 -0.45 -0.10 0.00 -0.22 0.00 0.00 54.13 53.56 1mxf s LEU 66 Cb 0.07 -2.08 0.16 0.00 0.50 0.00 0.00 46.19 44.84 1mxf s LEU 66 CO -0.01 -0.09 0.78 0.00 -1.32 0.00 0.00 176.35 175.71 1mxf s LYS 68 N 2.77 3.54 0.00 0.00 2.20 -1.26 -1.41 119.74 125.58 1mxf s LYS 68 Ca 0.02 -0.09 0.00 0.00 -0.36 0.00 0.00 55.97 55.54 1mxf s LYS 68 Cb -0.11 -3.13 0.00 0.00 -1.51 0.00 0.00 37.83 33.08 1mxf s LYS 68 CO -0.18 0.70 0.00 0.41 -0.36 0.00 0.00 175.35 175.92 1mxf n GLY 69 N 1.46 1.13 3.73 5.54 0.00 -0.69 -4.95 105.19 111.42 1mxf n GLY 69 Ca -0.15 0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 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 7.31 -0.24 1.61 2.15 -1.26 -4.49 116.67 121.75 1mxf s ASP 70 Ca 0.00 1.58 0.14 0.00 0.43 0.00 0.00 52.55 54.69 1mxf s ASP 70 Cb 0.00 -2.52 0.66 0.00 -0.30 0.00 0.00 42.92 40.76 1mxf s ASP 70 CO 0.00 -0.08 1.61 0.18 -0.17 0.00 0.00 175.17 176.71 1mxf n LEU 71 N 3.13 4.96 -4.84 -1.34 4.77 -1.26 -4.87 117.00 117.55 1mxf n LEU 71 Ca 0.01 -3.11 -0.31 0.00 -0.03 0.00 0.00 56.01 52.57 1mxf n LEU 71 Cb 0.50 -0.64 0.01 0.00 -2.33 0.00 0.00 43.42 40.97 1mxf n LEU 71 CO 0.49 0.74 0.71 -0.44 -1.33 0.00 0.00 177.39 177.56 1mxf s SER 72 N -1.46 5.97 0.21 -1.43 0.01 -1.26 -2.04 113.70 113.71 1mxf s SER 72 Ca 0.49 1.56 -0.31 0.00 1.31 0.00 0.00 55.95 59.00 1mxf s SER 72 Cb 0.39 -2.49 -0.11 0.00 0.21 0.00 0.00 66.02 64.02 1mxf s SER 72 CO 0.11 -1.04 1.63 -0.76 0.41 0.00 0.00 173.24 173.59 1mxf s LEU 73 N -5.00 4.37 0.04 2.44 1.43 0.10 -4.61 118.68 117.44 1mxf s LEU 73 Ca 0.58 2.78 -0.27 0.00 -1.03 0.00 0.00 54.13 56.19 1mxf s LEU 73 Cb -0.12 -3.61 0.10 0.00 0.03 0.00 0.00 46.19 42.59 1mxf s LEU 73 CO 0.48 -0.89 1.22 -0.94 0.23 0.00 0.00 176.35 176.44 1mxf s SER 74 N 0.98 -0.01 0.40 2.29 1.04 -1.26 -4.87 113.70 112.27 1mxf s SER 74 Ca 0.70 -0.31 0.18 0.00 0.48 0.00 0.00 55.95 57.01 1mxf s SER 74 Cb -0.47 0.24 0.85 0.00 0.10 0.00 0.00 66.02 66.75 1mxf s SER 74 CO 0.35 -0.48 1.84 0.28 0.98 0.00 0.00 173.24 176.21 1mxf h SER 75 N 2.00 0.00 1.17 7.02 0.02 -2.04 -3.08 113.55 118.64 1mxf h SER 75 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 1mxf h SER 75 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1mxf h SER 75 CO 0.32 0.32 -0.62 0.28 -1.14 0.00 0.00 176.83 176.00 1mxf h SER 76 N 0.00 0.00 -0.62 3.07 0.02 -1.95 -3.40 113.55 110.68 1mxf h SER 76 Ca -0.00 -0.07 0.13 0.00 -0.84 0.00 0.00 61.79 61.00 1mxf h SER 76 Cb 0.70 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.12 1mxf h SER 76 CO 0.04 0.04 -0.13 0.25 -1.14 0.00 0.00 176.83 175.89 1mxf h LEU 77 N 0.00 -0.52 -0.42 5.07 5.85 -1.79 0.86 115.31 124.36 1mxf h LEU 77 Ca 0.00 0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1mxf h LEU 77 Cb 0.89 0.36 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 1mxf h LEU 77 CO 0.00 -0.19 0.22 0.25 -0.34 0.00 0.00 178.44 178.38 1mxf h LEU 78 N 0.02 0.34 -0.64 2.25 5.85 -1.81 -0.29 115.31 121.03 1mxf h LEU 78 Ca 0.30 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.92 1mxf h LEU 78 Cb 0.47 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1mxf h LEU 78 CO -0.62 0.24 -0.18 0.44 -0.34 0.00 0.00 178.44 177.98 1mxf h ASP 79 N 0.45 0.89 -0.48 1.25 3.32 -1.64 -2.74 116.42 117.47 1mxf h ASP 79 Ca 0.18 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1mxf h ASP 79 Cb 0.07 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1mxf h ASP 79 CO -0.11 1.06 0.32 0.00 -1.72 0.00 0.00 179.24 178.78 1mxf h GLU 82 N 0.00 0.12 -0.78 0.00 4.39 -1.13 -2.84 114.58 114.34 1mxf h GLU 82 Ca -0.00 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 1mxf h GLU 82 Cb 0.62 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.22 1mxf h GLU 82 CO 0.04 0.33 0.33 -0.44 -1.16 0.00 0.00 179.01 178.11 1mxf h ASP 83 N -0.11 1.06 -1.00 1.42 3.32 -1.10 0.12 116.42 120.14 1mxf h ASP 83 Ca 0.02 -0.16 0.04 0.00 0.02 0.00 0.00 57.03 56.95 1mxf h ASP 83 Cb 0.26 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.48 1mxf h ASP 83 CO 0.00 0.93 0.66 -0.29 -1.72 0.00 0.00 179.24 178.82 1mxf h ILE 84 N 1.12 1.16 -0.05 0.35 -0.00 -1.23 0.43 117.51 119.31 1mxf h ILE 84 Ca 0.26 -0.43 -0.25 0.00 -0.00 0.00 0.00 64.86 64.44 1mxf h ILE 84 Cb 0.19 -0.21 0.02 0.00 -0.00 0.00 0.00 36.82 36.82 1mxf h ILE 84 CO -0.03 0.23 -0.94 0.40 -0.00 0.00 0.00 178.15 177.82 1mxf h ILE 85 N 1.26 1.29 -0.34 2.19 1.08 -1.21 -3.11 117.51 118.67 1mxf h ILE 85 Ca 0.40 -2.15 0.05 0.00 -0.39 0.00 0.00 64.86 62.77 1mxf h ILE 85 Cb 0.02 2.27 -0.02 0.00 -3.07 0.00 0.00 36.82 36.03 1mxf h ILE 85 CO -0.13 0.67 0.23 -0.78 -0.69 0.00 0.00 178.15 177.45 1mxf h ASP 86 N 0.41 0.23 -0.87 1.72 3.58 0.20 -1.40 116.42 120.28 1mxf h ASP 86 Ca -0.10 -0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.39 1mxf h ASP 86 Cb 1.59 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 42.53 1mxf h ASP 86 CO 0.19 0.15 0.55 0.00 -2.88 0.00 0.00 179.24 177.25 1mxf h SER 88 N 1.06 0.98 -0.05 0.00 0.87 -1.34 -1.31 113.55 113.76 1mxf h SER 88 Ca 0.36 -0.10 -0.24 0.00 -1.23 0.00 0.00 61.79 60.57 1mxf h SER 88 Cb 0.06 -0.25 0.02 0.00 -0.44 0.00 0.00 62.40 61.78 1mxf h SER 88 CO -0.13 0.82 -0.92 -0.26 -0.53 0.00 0.00 176.83 175.80 1mxf h PHE 89 N 1.09 1.02 -0.40 2.24 0.04 -1.17 0.71 116.94 120.47 1mxf h PHE 89 Ca 0.27 -0.52 -0.00 0.00 2.80 0.00 0.00 57.97 60.51 1mxf h PHE 89 Cb 0.08 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.08 1mxf h PHE 89 CO 0.01 1.35 0.24 0.00 -0.60 0.00 0.00 178.31 179.31 1mxf h ARG 90 N 0.40 0.56 0.06 1.51 2.47 -0.50 0.29 114.38 119.17 1mxf h ARG 90 Ca -0.10 -0.06 -0.25 0.00 -1.26 0.00 0.00 59.98 58.31 1mxf h ARG 90 Cb 1.57 -0.11 0.01 0.00 -1.65 0.00 0.00 29.97 29.78 1mxf h ARG 90 CO 0.18 0.43 -1.08 0.00 0.56 0.00 0.00 179.97 180.06 1mxf h ALA 91 N 1.10 0.22 0.00 0.04 0.00 -1.26 -3.39 119.26 115.96 1mxf h ALA 91 Ca 0.14 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1mxf h ALA 91 Cb 0.02 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1mxf h ALA 91 CO -0.03 0.83 0.00 1.19 0.00 0.00 0.00 179.25 181.24 1mxf n PHE 92 N -3.70 0.00 -1.14 0.00 3.72 0.24 -5.00 117.46 111.57 1mxf n PHE 92 Ca -0.09 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.27 1mxf n PHE 92 Cb 0.91 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.43 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 0.22 0.65 3.61 1.37 0.00 0.10 -4.94 105.19 106.21 1mxf n GLY 93 Ca 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.87 0.71 -0.23 1.61 1.70 -1.25 -4.94 118.95 114.68 1mxf s ARG 94 Ca 0.00 -0.33 -0.04 0.00 -0.47 0.00 0.00 55.73 54.89 1mxf s ARG 94 Cb 0.00 0.28 0.12 0.00 -0.57 0.00 0.00 34.95 34.78 1mxf s ARG 94 CO 0.00 -0.32 0.40 0.00 -1.08 0.00 0.00 175.30 174.30 1mxf n ASP 96 N 5.38 2.09 -4.03 0.00 9.92 0.53 -4.93 116.55 125.50 1mxf n ASP 96 Ca -0.05 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 54.02 1mxf n ASP 96 Cb 0.50 1.08 -0.15 0.00 -0.64 0.00 0.00 41.12 41.91 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 -2.50 0.75 -0.08 2.53 1.01 -0.78 -1.69 120.40 119.63 1mxf s VAL 97 Ca -0.05 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.50 1mxf s VAL 97 Cb 0.05 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.81 1mxf s VAL 97 CO 0.50 0.19 -0.11 -0.22 0.00 0.00 0.00 175.10 175.46 1mxf s LEU 98 N -0.29 1.53 -0.26 3.92 2.96 -0.92 -0.89 118.68 124.74 1mxf s LEU 98 Ca 0.03 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 53.66 1mxf s LEU 98 Cb -0.04 -0.86 0.06 0.00 0.50 0.00 0.00 46.19 45.85 1mxf s LEU 98 CO -0.00 -0.01 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.22 1mxf s VAL 99 N 0.99 2.15 -0.90 1.68 1.01 -0.49 -0.65 120.40 124.19 1mxf s VAL 99 Ca -0.08 -1.65 -0.21 0.00 0.00 0.00 0.00 61.98 60.04 1mxf s VAL 99 Cb -0.15 -2.28 0.10 0.00 0.00 0.00 0.00 36.38 34.05 1mxf s VAL 99 CO -0.00 -0.05 1.18 0.20 0.00 0.00 0.00 175.10 176.43 1mxf s ASN 100 N 1.10 6.51 -0.19 3.32 0.01 -0.40 -2.27 114.94 123.02 1mxf s ASN 100 Ca -0.08 -1.68 0.04 0.00 -0.71 0.00 0.00 52.86 50.43 1mxf s ASN 100 Cb -0.20 -2.45 -0.14 0.00 0.41 0.00 0.00 41.25 38.87 1mxf s ASN 100 CO -0.05 -1.26 -0.13 -3.20 -1.51 0.00 0.00 177.10 170.95 1mxf n ASN 101 N 7.39 2.25 -4.56 -1.22 5.15 -1.25 -1.46 115.26 121.57 1mxf n ASN 101 Ca 0.21 -0.09 -0.49 0.00 -0.60 0.00 0.00 54.58 53.62 1mxf n ASN 101 Cb 0.49 -0.09 -0.04 0.00 -0.53 0.00 0.00 39.78 39.61 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 -2.98 -1.08 -3.63 5.20 0.00 -1.09 -4.91 120.51 112.02 1mxf n ALA 102 Ca -0.33 0.46 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 1mxf n ALA 102 Cb 0.89 -1.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.31 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 -0.21 -0.76 0.29 0.00 0.15 -1.26 -4.41 113.70 107.50 1mxf s SER 103 Ca 0.71 1.19 -0.15 0.00 0.70 0.00 0.00 55.95 58.39 1mxf s SER 103 Cb -0.86 1.37 -0.09 0.00 -1.71 0.00 0.00 66.02 64.74 1mxf s SER 103 CO 0.54 -0.19 0.71 0.00 1.20 0.00 0.00 173.24 175.50 1mxf s ALA 104 N 1.61 3.37 -0.27 5.45 0.00 -1.26 -5.03 121.76 125.63 1mxf s ALA 104 Ca -0.09 0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.88 1mxf s ALA 104 Cb -0.05 -2.73 0.16 0.00 0.00 0.00 0.00 23.12 20.50 1mxf s ALA 104 CO -0.18 0.35 0.47 -0.47 0.00 0.00 0.00 175.76 175.94 1mxf s TYR 105 N -1.86 -1.17 0.01 0.00 5.04 -1.26 -4.90 117.35 113.21 1mxf s TYR 105 Ca 0.51 1.13 -0.28 0.00 -2.44 0.00 0.00 57.07 55.99 1mxf s TYR 105 Cb -0.12 0.22 0.10 0.00 0.35 0.00 0.00 41.96 42.51 1mxf s TYR 105 CO 0.19 -0.81 0.85 1.52 -1.34 0.00 0.00 175.55 175.95 1mxf s TYR 106 N 2.67 -0.38 0.61 4.97 -0.85 -1.26 -5.17 117.35 117.94 1mxf s TYR 106 Ca 0.15 0.27 -0.17 0.00 -0.52 0.00 0.00 57.07 56.80 1mxf s TYR 106 Cb -0.15 0.53 -0.02 0.00 0.38 0.00 0.00 41.96 42.70 1mxf s TYR 106 CO -0.19 -0.58 1.15 -1.25 -1.52 0.00 0.00 175.55 173.15 1mxf s PRO 107 N -3.06 2.96 -0.42 -3.49 0.04 -1.26 -4.79 135.00 124.98 1mxf s PRO 107 Ca 0.04 1.60 0.08 0.00 0.04 0.00 0.00 61.00 62.76 1mxf s PRO 107 Cb -0.01 -1.95 0.28 0.00 0.04 0.00 0.00 34.50 32.86 1mxf s PRO 107 CO -0.09 -1.16 0.74 0.25 0.04 0.00 0.00 177.00 176.78 1mxf n THR 108 N -1.89 -0.31 -1.70 1.26 -2.24 0.27 -4.98 114.28 104.69 1mxf n THR 108 Ca 0.12 -3.18 -0.43 0.00 -2.27 0.00 0.00 64.05 58.28 1mxf n THR 108 Cb 0.51 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.47 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 1.06 2.20 -0.12 -0.78 -0.04 -1.17 -4.44 135.00 131.71 1mxf n PRO 109 Ca 0.17 0.78 -0.10 0.00 -0.04 0.00 0.00 63.50 64.31 1mxf n PRO 109 Cb 0.61 -2.44 -0.02 0.00 -0.04 0.00 0.00 33.50 31.60 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 3.82 0.61 -9.56 1.53 3.38 -2.01 -3.42 115.31 109.66 1mxf h LEU 110 Ca -0.46 -0.30 -0.64 0.00 0.09 0.00 0.00 57.88 56.58 1mxf h LEU 110 Cb 1.27 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.78 1mxf h LEU 110 CO 0.72 0.76 -0.40 -0.76 0.09 0.00 0.00 178.44 178.85 1mxf s LEU 111 N -9.47 4.37 0.55 1.67 2.01 -1.26 -5.25 118.68 111.30 1mxf s LEU 111 Ca -0.13 0.56 -0.21 0.00 0.01 0.00 0.00 54.13 54.36 1mxf s LEU 111 Cb 0.09 -2.23 -0.05 0.00 0.01 0.00 0.00 46.19 44.02 1mxf s LEU 111 CO 0.78 0.32 1.28 -2.16 1.01 0.00 0.00 176.35 177.59 1mxf s PRO 112 N -0.69 3.14 0.00 1.29 0.04 -1.26 -5.17 135.00 132.35 1mxf s PRO 112 Ca 0.16 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.25 1mxf s PRO 112 Cb -0.13 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.24 1mxf s PRO 112 CO 0.05 -1.13 0.00 1.17 0.04 0.00 0.00 177.00 177.14 1mxf n LYS 123 N -1.15 0.00 -1.62 4.56 4.81 -1.26 -5.13 118.16 118.37 1mxf n LYS 123 Ca 0.11 0.00 -0.46 0.00 -0.87 0.00 0.00 58.31 57.09 1mxf n LYS 123 Cb 0.47 -0.02 -0.03 0.00 0.02 0.00 0.00 35.03 35.47 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 0.06 1.57 -0.25 1.64 -0.02 -1.26 -4.81 135.00 131.94 1mxf n PRO 124 Ca 0.00 0.56 0.09 0.00 -2.02 0.00 0.00 63.50 62.13 1mxf n PRO 124 Cb 0.00 -2.09 0.35 0.00 -0.02 0.00 0.00 33.50 31.74 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 2.65 0.93 -0.02 4.25 6.09 -2.04 -0.73 117.51 128.64 1mxf h ILE 125 Ca -0.43 -0.26 0.01 0.00 -1.37 0.00 0.00 64.86 62.80 1mxf h ILE 125 Cb 1.31 0.10 -0.01 0.00 0.47 0.00 0.00 36.82 38.70 1mxf h ILE 125 CO 0.70 0.14 -0.01 0.44 -3.07 0.00 0.00 178.15 176.35 1mxf h ASP 126 N 0.77 -0.03 0.51 2.19 3.32 -2.00 -0.71 116.42 120.47 1mxf h ASP 126 Ca 0.40 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.43 1mxf h ASP 126 Cb 0.49 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 1mxf h ASP 126 CO -0.16 -0.01 -0.10 0.00 -1.72 0.00 0.00 179.24 177.24 1mxf h ALA 127 N 1.02 1.16 -0.01 3.45 0.00 -1.66 -1.29 119.26 121.93 1mxf h ALA 127 Ca 0.01 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.65 1mxf h ALA 127 Cb 0.02 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1mxf h ALA 127 CO -0.03 0.13 -0.68 1.96 0.00 0.00 0.00 179.25 180.63 1mxf h GLN 128 N 0.00 0.48 -0.07 0.00 4.20 -0.11 -2.35 115.11 117.25 1mxf h GLN 128 Ca -0.00 -0.50 -0.07 0.00 0.06 0.00 0.00 58.65 58.13 1mxf h GLN 128 Cb 0.38 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1mxf h GLN 128 CO 0.01 1.15 -0.29 -0.39 -0.67 0.00 0.00 178.83 178.64 1mxf h VAL 129 N 0.01 1.24 -0.34 -0.54 -1.51 -0.84 0.54 116.25 114.81 1mxf h VAL 129 Ca -0.08 -1.13 -0.02 0.00 -1.23 0.00 0.00 66.70 64.24 1mxf h VAL 129 Cb 1.38 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 32.04 1mxf h VAL 129 CO 0.13 0.33 0.14 0.00 -1.23 0.00 0.00 177.57 176.94 1mxf h ALA 130 N 1.60 0.44 0.12 5.19 0.00 -1.18 -0.73 119.26 124.68 1mxf h ALA 130 Ca 0.02 -0.13 -0.28 0.00 0.00 0.00 0.00 54.91 54.51 1mxf h ALA 130 Cb 0.58 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.26 1mxf h ALA 130 CO 0.04 0.03 -1.21 1.49 0.00 0.00 0.00 179.25 179.60 1mxf h GLU 131 N 0.40 0.49 -0.14 0.00 4.81 -1.04 0.49 114.58 119.59 1mxf h GLU 131 Ca 0.11 -0.68 -0.16 0.00 -0.13 0.00 0.00 59.36 58.50 1mxf h GLU 131 Cb 0.18 0.23 0.01 0.00 0.63 0.00 0.00 28.75 29.80 1mxf h GLU 131 CO -0.01 1.30 -0.54 -0.07 -0.73 0.00 0.00 179.01 178.96 1mxf h LEU 132 N 0.21 0.73 -0.20 1.64 3.38 -0.93 -2.91 115.31 117.23 1mxf h LEU 132 Ca -0.16 -0.61 -0.19 0.00 0.09 0.00 0.00 57.88 57.00 1mxf h LEU 132 Cb 1.89 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.41 1mxf h LEU 132 CO 0.22 1.22 -0.91 -0.26 0.09 0.00 0.00 178.44 178.80 1mxf h PHE 133 N 0.28 0.06 0.33 1.13 -1.00 -1.27 -2.87 116.94 113.61 1mxf h PHE 133 Ca -0.03 -0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.70 1mxf h PHE 133 Cb 1.17 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.73 1mxf h PHE 133 CO 0.10 0.93 -0.16 0.78 -1.61 0.00 0.00 178.31 178.35 1mxf h GLY 134 N 2.52 -0.46 1.37 -1.45 0.00 -1.47 0.22 103.07 103.81 1mxf h GLY 134 Ca -0.02 0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.37 1mxf h GLY 134 CO 0.12 -0.17 -0.24 1.48 0.00 0.00 0.00 176.54 177.74 1mxf h SER 135 N -0.86 0.73 0.95 0.19 4.64 -1.19 0.43 113.55 118.43 1mxf h SER 135 Ca -0.05 -0.27 -0.10 0.00 -0.47 0.00 0.00 61.79 60.91 1mxf h SER 135 Cb 0.53 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 1mxf h SER 135 CO 0.07 0.95 -1.11 0.78 -0.87 0.00 0.00 176.83 176.65 1mxf h ASN 136 N 0.63 0.00 0.00 4.97 2.35 -1.63 -3.42 115.58 118.48 1mxf h ASN 136 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1mxf h ASN 136 Cb 0.73 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.10 1mxf h ASN 136 CO 0.06 0.37 -0.32 0.00 -1.65 0.00 0.00 177.43 175.89 1mxf n ALA 137 N -2.30 3.00 -0.05 -0.83 0.00 -0.71 -4.51 120.51 115.12 1mxf n ALA 137 Ca -0.05 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.23 1mxf n ALA 137 Cb 0.73 0.17 -0.06 0.00 0.00 0.00 0.00 19.45 20.29 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 1.28 -0.18 0.00 2.07 -0.46 -2.72 116.25 116.24 1mxf h VAL 138 Ca 0.00 -1.87 -0.01 0.00 0.82 0.00 0.00 66.70 65.64 1mxf h VAL 138 Cb 0.32 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1mxf h VAL 138 CO 0.00 0.60 0.06 0.00 0.02 0.00 0.00 177.57 178.25 1mxf h ALA 139 N 0.59 0.24 -0.88 1.67 0.00 -0.37 -1.32 119.26 119.20 1mxf h ALA 139 Ca -0.03 -0.12 0.18 0.00 0.00 0.00 0.00 54.91 54.94 1mxf h ALA 139 Cb 1.30 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 1mxf h ALA 139 CO 0.14 -0.16 0.44 -1.35 0.00 0.00 0.00 179.25 178.32 1mxf h PRO 140 N 0.13 0.54 0.48 0.00 0.11 -1.76 0.64 132.00 132.14 1mxf h PRO 140 Ca 0.06 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.11 1mxf h PRO 140 Cb 0.20 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.20 1mxf h PRO 140 CO -0.00 0.36 -0.23 1.25 -0.21 0.00 0.00 178.00 179.17 1mxf h LEU 141 N 0.56 -0.54 -1.26 2.35 5.85 -1.11 0.20 115.31 121.36 1mxf h LEU 141 Ca 0.51 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.25 1mxf h LEU 141 Cb 0.82 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 1mxf h LEU 141 CO -0.42 -0.38 0.50 -0.26 -0.34 0.00 0.00 178.44 177.54 1mxf h PHE 142 N -0.65 0.95 0.00 1.25 0.04 -0.04 0.76 116.94 119.26 1mxf h PHE 142 Ca -0.07 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 1mxf h PHE 142 Cb 0.49 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 38.32 1mxf h PHE 142 CO -0.04 0.60 -0.00 -0.07 -0.60 0.00 0.00 178.31 178.19 1mxf h LEU 143 N 1.02 -0.00 -0.69 1.54 4.07 0.48 -1.08 115.31 120.65 1mxf h LEU 143 Ca 0.28 -0.28 0.03 0.00 0.08 0.00 0.00 57.88 57.99 1mxf h LEU 143 Cb -0.11 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.58 1mxf h LEU 143 CO -0.06 0.28 0.43 0.40 -1.08 0.00 0.00 178.44 178.40 1mxf h ILE 144 N -0.29 1.08 -0.79 1.22 2.04 -0.23 0.12 117.51 120.66 1mxf h ILE 144 Ca -0.00 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.61 1mxf h ILE 144 Cb 0.28 0.18 -0.05 0.00 -0.74 0.00 0.00 36.82 36.49 1mxf h ILE 144 CO 0.00 0.15 0.50 -0.09 0.00 0.00 0.00 178.15 178.71 1mxf h ARG 145 N 0.83 0.93 -0.17 2.37 2.43 -0.69 -0.37 114.38 119.72 1mxf h ARG 145 Ca 0.28 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.25 1mxf h ARG 145 Cb 0.03 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1mxf h ARG 145 CO -0.11 0.62 -0.45 0.00 -1.51 0.00 0.00 179.97 178.52 1mxf h ALA 146 N 1.34 0.29 -0.38 2.80 0.00 -0.65 -2.46 119.26 120.20 1mxf h ALA 146 Ca 0.32 -0.48 0.04 0.00 0.00 0.00 0.00 54.91 54.80 1mxf h ALA 146 Cb 0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1mxf h ALA 146 CO -0.13 0.43 0.14 0.35 0.00 0.00 0.00 179.25 180.04 1mxf h PHE 147 N 0.28 0.25 -0.49 0.00 3.04 -0.45 -2.32 116.94 117.25 1mxf h PHE 147 Ca -0.01 0.02 -0.13 0.00 3.98 0.00 0.00 57.97 61.83 1mxf h PHE 147 Cb 1.06 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 39.50 1mxf h PHE 147 CO 0.10 0.11 -0.20 0.00 -2.02 0.00 0.00 178.31 176.29 1mxf h ALA 148 N 1.24 0.69 0.00 2.41 0.00 -1.10 -3.15 119.26 119.35 1mxf h ALA 148 Ca 0.17 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1mxf h ALA 148 Cb 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1mxf h ALA 148 CO -0.17 0.68 0.00 0.00 0.00 0.00 0.00 179.25 179.76 1mxf h ARG 149 N 0.87 0.00 -0.47 0.00 3.08 -1.23 -3.02 114.38 113.62 1mxf h ARG 149 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1mxf h ARG 149 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1mxf h ARG 149 CO 0.07 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.51 1mxf n ARG 150 N -3.08 2.51 -0.87 0.04 1.74 -0.89 -5.10 116.66 111.01 1mxf n ARG 150 Ca 0.01 -2.30 -0.14 0.00 -0.77 0.00 0.00 57.85 54.65 1mxf n ARG 150 Cb 0.31 -1.52 0.10 0.00 -1.02 0.00 0.00 32.46 30.33 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 1.46 -0.66 -0.86 5.56 1.13 -1.14 -5.03 117.38 117.84 1mxf n GLN 151 Ca 0.21 -0.96 -0.00 0.00 -1.94 0.00 0.00 57.00 54.31 1mxf n GLN 151 Cb 0.59 -0.65 -0.00 0.00 0.11 0.00 0.00 30.24 30.29 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 -3.42 -1.69 -4.74 1.08 5.15 -1.26 -5.09 115.26 105.28 1mxf n ASN 161 Ca 0.08 -1.19 -0.39 0.00 -0.60 0.00 0.00 54.58 52.48 1mxf n ASN 161 Cb 0.27 -0.51 -0.05 0.00 -0.53 0.00 0.00 39.78 38.96 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 4.38 0.02 1.20 1.43 -1.26 -4.79 118.68 119.67 1mxf s LEU 162 Ca 0.02 1.22 -0.25 0.00 -1.03 0.00 0.00 54.13 54.08 1mxf s LEU 162 Cb -0.01 -3.03 0.06 0.00 0.03 0.00 0.00 46.19 43.24 1mxf s LEU 162 CO 0.01 0.01 0.58 -0.94 0.23 0.00 0.00 176.35 176.23 1mxf s SER 163 N 0.21 -0.53 0.05 2.29 1.04 -0.68 -1.85 113.70 114.24 1mxf s SER 163 Ca 0.35 0.36 0.09 0.00 0.48 0.00 0.00 55.95 57.23 1mxf s SER 163 Cb -0.18 0.51 -0.03 0.00 0.10 0.00 0.00 66.02 66.42 1mxf s SER 163 CO 0.18 -0.69 -0.26 -0.69 0.98 0.00 0.00 173.24 172.77 1mxf s VAL 164 N -2.04 2.21 -0.06 5.02 1.01 0.13 -2.16 120.40 124.51 1mxf s VAL 164 Ca -0.07 -1.42 0.00 0.00 0.00 0.00 0.00 61.98 60.49 1mxf s VAL 164 Cb -0.01 -1.88 0.02 0.00 0.00 0.00 0.00 36.38 34.52 1mxf s VAL 164 CO 0.02 0.33 -0.02 -0.69 0.00 0.00 0.00 175.10 174.74 1mxf s VAL 165 N -0.85 0.46 -0.08 2.92 1.01 0.17 -1.62 120.40 122.42 1mxf s VAL 165 Ca 0.12 -0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.06 1mxf s VAL 165 Cb -0.10 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 1mxf s VAL 165 CO 0.03 0.24 0.06 0.20 0.00 0.00 0.00 175.10 175.63 1mxf s ASN 166 N 1.36 5.67 -0.47 3.32 0.01 -0.12 -1.27 114.94 123.46 1mxf s ASN 166 Ca -0.04 0.24 -0.22 0.00 -0.71 0.00 0.00 52.86 52.13 1mxf s ASN 166 Cb -0.13 -1.68 0.03 0.00 0.41 0.00 0.00 41.25 39.88 1mxf s ASN 166 CO -0.02 0.36 0.72 -0.76 -1.51 0.00 0.00 177.10 175.89 1mxf s LEU 167 N -1.13 4.45 0.00 0.60 2.01 -0.53 -1.39 118.68 122.68 1mxf s LEU 167 Ca 0.16 -0.36 0.00 0.00 0.01 0.00 0.00 54.13 53.94 1mxf s LEU 167 Cb -0.12 -2.77 0.00 0.00 0.01 0.00 0.00 46.19 43.31 1mxf s LEU 167 CO 0.06 -0.89 0.00 0.00 1.01 0.00 0.00 176.35 176.52 1mxf s ASP 169 N -1.00 1.34 0.00 0.00 -1.08 -1.26 -3.92 116.67 110.75 1mxf s ASP 169 Ca 0.00 -0.05 -0.00 0.00 -0.52 0.00 0.00 52.55 51.98 1mxf s ASP 169 Cb 0.00 0.03 -0.01 0.00 -1.46 0.00 0.00 42.92 41.48 1mxf s ASP 169 CO 0.00 -0.28 0.74 0.00 0.52 0.00 0.00 175.17 176.15 1mxf n ALA 170 N 5.31 2.33 -0.25 3.66 0.00 0.04 -4.71 120.51 126.89 1mxf n ALA 170 Ca -0.05 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1mxf n ALA 170 Cb 0.50 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 1.99 0.00 0.46 0.00 -2.24 -1.26 -4.77 114.28 108.45 1mxf n THR 172 Ca 0.02 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.92 1mxf n THR 172 Cb 0.17 -0.25 0.17 0.00 -2.10 0.00 0.00 70.33 68.32 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 -2.17 3.42 3.32 -1.99 -3.33 116.42 115.67 1mxf h ASP 173 Ca 0.00 -0.12 -0.60 0.00 0.02 0.00 0.00 57.03 56.33 1mxf h ASP 173 Cb 0.00 0.00 -0.42 0.00 0.22 0.00 0.00 39.33 39.13 1mxf h ASP 173 CO 0.00 0.06 -0.65 0.18 -1.72 0.00 0.00 179.24 177.11 1mxf n LEU 174 N -2.34 3.43 -3.26 1.55 4.77 -1.26 -5.07 117.00 114.82 1mxf n LEU 174 Ca 0.03 -5.38 -0.47 0.00 -0.03 0.00 0.00 56.01 50.16 1mxf n LEU 174 Cb 0.47 -0.53 -0.07 0.00 -2.33 0.00 0.00 43.42 40.96 1mxf n LEU 174 CO 0.36 2.07 0.89 -2.65 -1.33 0.00 0.00 177.39 176.74 1mxf n PRO 175 N 0.85 0.00 -2.13 3.23 -0.02 -1.25 -4.86 135.00 130.82 1mxf n PRO 175 Ca 0.29 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.34 1mxf n PRO 175 Cb 0.42 -1.05 -0.02 0.00 -0.02 0.00 0.00 33.50 32.82 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 2.55 3.89 0.12 2.45 2.96 -1.26 -4.91 118.68 124.48 1mxf s LEU 176 Ca 0.76 1.59 -0.35 0.00 -0.22 0.00 0.00 54.13 55.91 1mxf s LEU 176 Cb -1.05 -3.53 -0.16 0.00 0.50 0.00 0.00 46.19 41.94 1mxf s LEU 176 CO 0.55 -1.25 1.26 -2.65 -1.32 0.00 0.00 176.35 172.94 1mxf n PRO 177 N 7.64 1.14 -0.12 0.98 -0.02 -1.26 -1.59 135.00 141.77 1mxf n PRO 177 Ca 0.19 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1mxf n PRO 177 Cb 0.45 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 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 2.28 1.09 1.69 -1.23 0.00 -1.26 -4.92 105.19 102.84 1mxf n GLY 178 Ca 0.17 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.00 2.08 -0.19 1.61 3.01 -0.62 0.94 117.46 122.28 1mxf n PHE 179 Ca 0.00 -2.11 -0.04 0.00 1.01 0.00 0.00 57.45 56.31 1mxf n PHE 179 Cb 0.00 -0.59 0.02 0.00 -0.01 0.00 0.00 39.48 38.90 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 -0.14 1.27 -0.38 0.00 2.07 -1.88 -2.84 116.25 114.34 1mxf h VAL 181 Ca 0.24 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 1mxf h VAL 181 Cb 0.53 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1mxf h VAL 181 CO -0.65 0.43 0.16 0.22 0.02 0.00 0.00 177.57 177.75 1mxf h TYR 182 N 0.66 0.56 0.00 1.57 3.20 -1.67 -2.06 116.97 119.23 1mxf h TYR 182 Ca 0.10 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1mxf h TYR 182 Cb 0.68 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.78 1mxf h TYR 182 CO 0.03 0.50 0.00 2.41 -1.64 0.00 0.00 178.16 179.46 1mxf n THR 183 N -4.68 0.00 0.00 1.81 -1.04 0.04 -1.48 114.28 108.93 1mxf n THR 183 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1mxf n THR 183 Cb 0.13 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 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 0.71 0.00 -0.17 2.41 0.00 -0.78 -1.41 120.51 121.27 1mxf n ALA 185 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1mxf n ALA 185 Cb 0.00 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.69 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 0.90 -0.58 0.00 1.79 -1.54 -0.45 116.57 116.69 1mxf h LYS 186 Ca 0.00 -0.09 -0.07 0.00 -2.18 0.00 0.00 60.65 58.31 1mxf h LYS 186 Cb 0.00 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.44 1mxf h LYS 186 CO 0.00 0.66 0.08 0.45 -1.08 0.00 0.00 179.45 179.56 1mxf h HIS 187 N 0.91 1.00 -0.74 -1.35 3.86 -1.50 -1.61 115.15 115.71 1mxf h HIS 187 Ca 0.23 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.30 1mxf h HIS 187 Cb 0.02 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.18 1mxf h HIS 187 CO 0.01 0.86 0.39 0.00 0.86 0.00 0.00 177.93 180.04 1mxf h ALA 188 N 1.19 0.96 -0.89 2.45 0.00 -1.60 -1.81 119.26 119.55 1mxf h ALA 188 Ca 0.18 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1mxf h ALA 188 Cb 0.41 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1mxf h ALA 188 CO 0.01 0.49 0.59 1.25 0.00 0.00 0.00 179.25 181.59 1mxf h LEU 189 N 1.03 1.03 -0.97 0.00 5.85 -0.47 0.12 115.31 121.91 1mxf h LEU 189 Ca 0.26 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 1mxf h LEU 189 Cb 0.07 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 1mxf h LEU 189 CO -0.04 0.76 -0.01 1.23 -0.34 0.00 0.00 178.44 180.04 1mxf h GLY 190 N 1.22 0.79 1.04 3.75 0.00 -0.89 -0.38 103.07 108.59 1mxf h GLY 190 Ca 0.33 -0.52 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 1mxf h GLY 190 CO -0.07 0.48 0.30 -1.33 0.00 0.00 0.00 176.54 175.92 1mxf h GLY 191 N 0.96 1.21 1.45 4.60 0.00 -0.47 -2.20 103.07 108.63 1mxf h GLY 191 Ca 0.14 -0.66 -0.08 0.00 0.00 0.00 0.00 47.33 46.72 1mxf h GLY 191 CO 0.02 0.62 -0.09 -2.00 0.00 0.00 0.00 176.54 175.09 1mxf h LEU 192 N 1.09 0.64 -0.95 3.11 5.85 -0.36 -1.43 115.31 123.26 1mxf h LEU 192 Ca 0.25 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1mxf h LEU 192 Cb 0.22 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1mxf h LEU 192 CO -0.02 0.77 0.53 0.74 -0.34 0.00 0.00 178.44 180.12 1mxf h THR 193 N 0.60 1.26 0.12 1.05 2.02 -0.47 -0.82 112.91 116.67 1mxf h THR 193 Ca 0.11 -0.60 -0.29 0.00 0.77 0.00 0.00 66.41 66.40 1mxf h THR 193 Cb 0.51 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1mxf h THR 193 CO 0.03 0.28 -1.41 0.03 0.37 0.00 0.00 175.52 174.82 1mxf h ARG 194 N 1.27 0.26 -0.14 6.66 3.08 -1.26 -2.70 114.38 121.55 1mxf h ARG 194 Ca 0.33 -0.44 -0.05 0.00 0.07 0.00 0.00 59.98 59.89 1mxf h ARG 194 Cb -0.02 0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1mxf h ARG 194 CO -0.06 1.15 -0.10 0.00 -1.07 0.00 0.00 179.97 179.90 1mxf h ALA 195 N 0.54 0.20 -0.66 0.04 0.00 -1.18 -3.00 119.26 115.20 1mxf h ALA 195 Ca -0.20 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 1mxf h ALA 195 Cb 2.00 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.72 1mxf h ALA 195 CO 0.18 0.03 0.17 0.00 0.00 0.00 0.00 179.25 179.63 1mxf h ALA 196 N 0.64 0.87 -0.66 0.00 0.00 -1.29 -1.70 119.26 117.11 1mxf h ALA 196 Ca 0.03 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1mxf h ALA 196 Cb 0.59 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 1mxf h ALA 196 CO 0.03 0.58 0.34 0.00 0.00 0.00 0.00 179.25 180.20 1mxf h ALA 197 N 1.07 0.89 -0.11 0.00 0.00 -1.49 0.51 119.26 120.13 1mxf h ALA 197 Ca 0.21 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1mxf h ALA 197 Cb 0.35 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1mxf h ALA 197 CO 0.00 -0.02 -0.11 1.25 0.00 0.00 0.00 179.25 180.37 1mxf h LEU 198 N 0.62 0.30 -1.40 0.00 5.85 -1.37 -2.01 115.31 117.30 1mxf h LEU 198 Ca 0.31 -0.48 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 1mxf h LEU 198 Cb 0.26 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1mxf h LEU 198 CO -0.22 0.72 -0.29 -0.33 -0.34 0.00 0.00 178.44 177.98 1mxf h GLU 199 N -0.12 0.00 -0.01 1.25 5.08 -1.09 -3.14 114.58 116.55 1mxf h GLU 199 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1mxf h GLU 199 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1mxf h GLU 199 CO 0.03 0.29 -0.63 1.28 -1.00 0.00 0.00 179.01 178.98 1mxf n LEU 200 N -3.91 1.14 -0.16 1.33 4.32 0.15 -4.42 117.00 115.44 1mxf n LEU 200 Ca -0.02 -0.41 -0.02 0.00 -0.02 0.00 0.00 56.01 55.55 1mxf n LEU 200 Cb 0.37 -0.08 0.07 0.00 -1.62 0.00 0.00 43.42 42.16 1mxf n LEU 200 CO 0.36 0.24 0.94 0.00 -1.22 0.00 0.00 177.39 177.71 1mxf h ALA 201 N 3.33 0.60 -0.01 -1.18 0.00 -1.31 -0.02 119.26 120.67 1mxf h ALA 201 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1mxf h ALA 201 Cb 0.56 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1mxf h ALA 201 CO 0.00 -0.27 0.02 -1.35 0.00 0.00 0.00 179.25 177.65 1mxf h PRO 202 N 0.29 0.00 -0.58 0.00 0.11 -1.79 0.54 132.00 130.58 1mxf h PRO 202 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1mxf h PRO 202 Cb 0.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.43 1mxf h PRO 202 CO -0.30 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.03 1mxf n ARG 203 N -3.58 2.34 -3.31 1.05 5.12 -0.06 -4.95 116.66 113.27 1mxf n ARG 203 Ca -0.03 -2.08 -0.24 0.00 -1.93 0.00 0.00 57.85 53.57 1mxf n ARG 203 Cb 0.10 -1.45 0.03 0.00 -1.16 0.00 0.00 32.46 29.98 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 1.20 -2.15 -4.39 -1.55 8.25 0.18 -4.99 115.22 111.77 1mxf n HIS 204 Ca 0.19 0.65 -0.33 0.00 -0.26 0.00 0.00 57.72 57.97 1mxf n HIS 204 Cb 0.49 -4.24 -0.15 0.00 1.12 0.00 0.00 29.99 27.21 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 -3.17 2.50 0.15 1.59 1.01 -1.02 -4.27 121.20 117.99 1mxf s ILE 205 Ca 0.42 -0.82 -0.15 0.00 0.00 0.00 0.00 60.65 60.10 1mxf s ILE 205 Cb -0.20 -2.06 -0.07 0.00 0.01 0.00 0.00 42.46 40.15 1mxf s ILE 205 CO 0.52 0.52 0.57 -0.13 0.00 0.00 0.00 174.94 176.42 1mxf s ARG 206 N 1.00 4.02 -0.16 2.79 0.52 -0.77 -4.12 118.95 122.24 1mxf s ARG 206 Ca -0.02 0.55 -0.02 0.00 -0.52 0.00 0.00 55.73 55.72 1mxf s ARG 206 Cb -0.15 -2.93 0.05 0.00 0.52 0.00 0.00 34.95 32.44 1mxf s ARG 206 CO -0.04 0.47 -0.00 0.08 0.02 0.00 0.00 175.30 175.83 1mxf s VAL 207 N -1.46 0.68 0.31 3.52 1.01 -1.26 0.17 120.40 123.37 1mxf s VAL 207 Ca 0.38 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.97 1mxf s VAL 207 Cb -0.15 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 1mxf s VAL 207 CO 0.19 0.00 0.13 0.59 0.00 0.00 0.00 175.10 176.02 1mxf n ASN 208 N 5.01 0.89 -3.92 3.32 3.02 -0.64 0.65 115.26 123.59 1mxf n ASN 208 Ca -0.09 -2.73 -0.10 0.00 -0.03 0.00 0.00 54.58 51.63 1mxf n ASN 208 Cb 0.48 0.90 -0.09 0.00 -0.61 0.00 0.00 39.78 40.46 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 -2.91 -0.09 -0.11 5.41 0.00 -0.36 -0.94 121.76 122.76 1mxf s ALA 209 Ca 0.19 -0.50 0.04 0.00 0.00 0.00 0.00 51.96 51.68 1mxf s ALA 209 Cb 0.01 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1mxf s ALA 209 CO 0.13 -0.30 -0.23 0.08 0.00 0.00 0.00 175.76 175.44 1mxf s VAL 210 N -2.41 2.09 -0.38 0.00 1.01 -0.49 -0.16 120.40 120.07 1mxf s VAL 210 Ca -0.07 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 1mxf s VAL 210 Cb -0.02 -1.80 0.11 0.00 0.00 0.00 0.00 36.38 34.66 1mxf s VAL 210 CO -0.04 0.56 0.15 0.00 0.00 0.00 0.00 175.10 175.77 1mxf s ALA 211 N 0.42 3.06 0.72 5.51 0.00 0.21 -1.03 121.76 130.64 1mxf s ALA 211 Ca -0.17 -2.52 -0.11 0.00 0.00 0.00 0.00 51.96 49.16 1mxf s ALA 211 Cb -0.18 -2.25 0.02 0.00 0.00 0.00 0.00 23.12 20.72 1mxf s ALA 211 CO 0.07 -1.75 1.08 -2.14 0.00 0.00 0.00 175.76 173.02 1mxf s PRO 212 N 1.06 2.67 0.00 0.00 0.02 -1.25 -0.99 135.00 136.51 1mxf s PRO 212 Ca 0.09 1.10 0.00 0.00 0.02 0.00 0.00 61.00 62.21 1mxf s PRO 212 Cb -0.21 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.35 1mxf s PRO 212 CO -0.05 -1.32 0.00 0.41 -0.33 0.00 0.00 177.00 175.71 1mxf n GLY 213 N -1.45 -0.23 2.98 0.52 0.00 -1.16 -0.78 105.19 105.08 1mxf n GLY 213 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.56 3.02 0.00 0.99 2.96 -1.26 -4.84 118.68 115.99 1mxf s LEU 214 Ca 0.00 -1.34 0.00 0.00 -0.22 0.00 0.00 54.13 52.57 1mxf s LEU 214 Cb 0.00 -1.32 0.00 0.00 0.50 0.00 0.00 46.19 45.37 1mxf s LEU 214 CO 0.00 -0.24 0.00 -0.24 -1.32 0.00 0.00 176.35 174.55 1mxf n SER 215 N 4.57 0.00 -4.57 3.68 2.88 -1.26 -0.51 113.62 118.40 1mxf n SER 215 Ca -0.11 0.00 -0.50 0.00 -1.33 0.00 0.00 58.87 56.93 1mxf n SER 215 Cb 0.43 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.83 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 2.73 -4.81 2.46 4.77 -1.24 -4.57 117.00 116.34 1mxf n LEU 216 Ca 0.00 0.65 -0.33 0.00 -0.03 0.00 0.00 56.01 56.30 1mxf n LEU 216 Cb 0.00 -1.32 0.01 0.00 -2.33 0.00 0.00 43.42 39.78 1mxf n LEU 216 CO 0.00 -0.47 0.71 -0.76 -1.33 0.00 0.00 177.39 175.54 1mxf s LEU 217 N 5.94 3.50 0.10 2.23 1.43 -1.26 -4.95 118.68 125.66 1mxf s LEU 217 Ca 1.02 1.77 -0.34 0.00 -1.03 0.00 0.00 54.13 55.55 1mxf s LEU 217 Cb -0.77 -4.53 -0.14 0.00 0.03 0.00 0.00 46.19 40.79 1mxf s LEU 217 CO 0.50 -1.09 1.64 -2.65 0.23 0.00 0.00 176.35 174.97 1mxf n PRO 218 N -2.02 2.09 -0.20 1.29 -0.02 -1.26 -4.87 135.00 130.01 1mxf n PRO 218 Ca 0.08 0.76 0.13 0.00 -2.02 0.00 0.00 63.50 62.45 1mxf n PRO 218 Cb 0.53 -2.54 0.45 0.00 -0.02 0.00 0.00 33.50 31.92 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 6.61 0.53 -5.83 0.52 0.13 -2.04 -3.46 132.00 128.47 1mxf h PRO 219 Ca -0.46 -0.03 -0.62 0.00 -0.87 0.00 0.00 66.00 64.02 1mxf h PRO 219 Cb 1.26 -0.12 -0.12 0.00 0.13 0.00 0.00 31.00 32.15 1mxf h PRO 219 CO 0.90 0.35 1.22 0.00 -0.23 0.00 0.00 178.00 180.23 1mxf s ALA 220 N -5.53 2.91 -0.00 -0.56 0.00 -1.26 -5.03 121.76 112.29 1mxf s ALA 220 Ca -0.09 -2.25 0.04 0.00 0.00 0.00 0.00 51.96 49.66 1mxf s ALA 220 Cb 0.21 -4.33 -0.03 0.00 0.00 0.00 0.00 23.12 18.97 1mxf s ALA 220 CO 0.77 -3.36 -0.11 -1.25 0.00 0.00 0.00 175.76 171.81 1mxf s PRO 222 N 4.44 2.43 0.27 0.00 0.04 -1.26 -5.17 135.00 135.76 1mxf s PRO 222 Ca 0.40 -0.77 0.01 0.00 0.04 0.00 0.00 61.00 60.67 1mxf s PRO 222 Cb -0.03 -2.40 0.59 0.00 0.04 0.00 0.00 34.50 32.70 1mxf s PRO 222 CO -0.05 0.59 1.75 1.96 0.04 0.00 0.00 177.00 181.29 1mxf h GLN 223 N 4.74 0.56 -0.85 4.56 4.20 -1.98 -0.94 115.11 125.41 1mxf h GLN 223 Ca -0.48 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.17 1mxf h GLN 223 Cb 1.16 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.78 1mxf h GLN 223 CO 0.51 0.37 0.42 1.49 -0.67 0.00 0.00 178.83 180.96 1mxf h GLU 224 N 0.58 1.20 -0.54 1.46 4.22 -2.03 0.18 114.58 119.66 1mxf h GLU 224 Ca 0.49 -0.16 -0.11 0.00 0.08 0.00 0.00 59.36 59.66 1mxf h GLU 224 Cb 0.77 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1mxf h GLU 224 CO -0.40 0.91 -0.09 1.15 -2.18 0.00 0.00 179.01 178.40 1mxf h THR 225 N 1.20 1.27 -0.89 0.32 2.02 -1.75 -2.13 112.91 112.94 1mxf h THR 225 Ca 0.29 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 66.24 1mxf h THR 225 Cb 0.09 0.97 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 1mxf h THR 225 CO -0.04 0.44 0.58 1.56 0.37 0.00 0.00 175.52 178.42 1mxf h GLN 226 N 0.88 1.17 -0.23 6.66 4.20 -0.34 -1.83 115.11 125.61 1mxf h GLN 226 Ca 0.14 -0.08 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 1mxf h GLN 226 Cb 0.65 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1mxf h GLN 226 CO 0.04 0.78 -0.27 1.49 -0.67 0.00 0.00 178.83 180.21 1mxf h GLU 227 N 1.21 0.46 -0.10 1.46 4.57 -0.36 -2.05 114.58 119.76 1mxf h GLU 227 Ca 0.32 -0.18 -0.10 0.00 -1.18 0.00 0.00 59.36 58.23 1mxf h GLU 227 Cb -0.12 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 1mxf h GLU 227 CO -0.07 0.69 -0.37 0.93 -1.18 0.00 0.00 179.01 179.01 1mxf h GLU 228 N 0.40 0.21 -0.08 1.92 5.08 -0.68 -2.33 114.58 119.09 1mxf h GLU 228 Ca 0.06 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 1mxf h GLU 228 Cb 0.69 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1mxf h GLU 228 CO 0.05 0.55 -0.17 1.88 -1.00 0.00 0.00 179.01 180.32 1mxf h TYR 229 N 0.18 0.33 -0.96 4.33 -1.99 -1.06 -3.28 116.97 114.52 1mxf h TYR 229 Ca 0.02 -0.12 -0.00 0.00 2.00 0.00 0.00 58.73 60.63 1mxf h TYR 229 Cb 0.74 -0.06 -0.05 0.00 2.00 0.00 0.00 36.73 39.36 1mxf h TYR 229 CO 0.01 0.78 0.59 0.00 -0.00 0.00 0.00 178.16 179.53 1mxf h ARG 230 N -0.21 1.29 0.00 4.88 3.08 -1.31 -2.41 114.38 119.69 1mxf h ARG 230 Ca 0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1mxf h ARG 230 Cb 0.76 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1mxf h ARG 230 CO 0.04 0.89 0.13 -0.09 -1.07 0.00 0.00 179.97 179.87 1mxf h ARG 231 N 1.31 0.00 0.00 0.04 9.65 -1.48 -0.86 114.38 123.04 1mxf h ARG 231 Ca 0.34 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.22 1mxf h ARG 231 Cb -0.07 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 1mxf h ARG 231 CO -0.07 0.00 -0.07 0.87 2.80 0.00 0.00 179.97 183.51 1mxf h LYS 232 N 0.00 0.00 -6.35 0.20 1.57 -1.54 -3.45 116.57 107.01 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 0.26 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.53 1mxf h LYS 232 CO 0.00 0.00 0.99 0.08 -0.57 0.00 0.00 179.45 179.95 1mxf s VAL 233 N -3.14 4.08 0.23 0.50 1.01 -0.33 -4.85 120.40 117.90 1mxf s VAL 233 Ca 0.09 1.21 -0.07 0.00 0.00 0.00 0.00 61.98 63.22 1mxf s VAL 233 Cb 0.10 -4.10 0.18 0.00 0.00 0.00 0.00 36.38 32.57 1mxf s VAL 233 CO 0.63 -0.46 1.81 -0.65 0.00 0.00 0.00 175.10 176.43 1mxf h PRO 234 N 9.51 0.74 -5.04 2.72 0.11 -1.84 -1.17 132.00 137.03 1mxf h PRO 234 Ca -0.27 -0.04 -0.69 0.00 0.11 0.00 0.00 66.00 65.10 1mxf h PRO 234 Cb 1.10 -0.17 -0.17 0.00 0.11 0.00 0.00 31.00 31.87 1mxf h PRO 234 CO 1.03 0.49 0.87 -1.17 -0.21 0.00 0.00 178.00 179.01 1mxf s LEU 235 N -10.26 5.02 0.00 2.35 2.96 -0.56 -4.40 118.68 113.79 1mxf s LEU 235 Ca -0.13 -2.06 0.00 0.00 -0.22 0.00 0.00 54.13 51.72 1mxf s LEU 235 Cb 0.18 -2.40 0.00 0.00 0.50 0.00 0.00 46.19 44.47 1mxf s LEU 235 CO 0.77 -1.06 0.00 0.61 -1.32 0.00 0.00 176.35 175.35 1mxf n GLY 236 N 5.48 1.16 3.97 7.98 0.00 -1.26 -4.32 105.19 118.20 1mxf n GLY 236 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.00 -4.61 -4.02 1.61 3.00 -0.44 -4.96 117.38 105.96 1mxf n GLN 237 Ca 0.00 0.52 -0.08 0.00 -0.01 0.00 0.00 57.00 57.43 1mxf n GLN 237 Cb 0.00 -5.25 -0.11 0.00 0.00 0.00 0.00 30.24 24.89 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 -3.55 0.33 0.65 1.08 0.15 -1.24 -4.32 113.70 106.79 1mxf s SER 238 Ca 0.53 -0.67 -0.08 0.00 0.70 0.00 0.00 55.95 56.43 1mxf s SER 238 Cb -0.27 0.13 0.02 0.00 -1.71 0.00 0.00 66.02 64.19 1mxf s SER 238 CO 0.86 -0.40 0.98 -1.83 1.20 0.00 0.00 173.24 174.05 1mxf s GLU 239 N -2.29 2.78 0.26 5.44 1.03 -1.26 -4.85 118.70 119.80 1mxf s GLU 239 Ca -0.08 0.10 -0.29 0.00 0.03 0.00 0.00 54.97 54.73 1mxf s GLU 239 Cb -0.04 -2.18 -0.09 0.00 -0.80 0.00 0.00 34.13 31.02 1mxf s GLU 239 CO -0.04 -0.90 0.95 0.00 -1.33 0.00 0.00 175.26 173.94 1mxf s ALA 240 N -3.15 3.32 0.46 -0.84 0.00 0.34 -4.94 121.76 116.94 1mxf s ALA 240 Ca 0.56 0.62 -0.13 0.00 0.00 0.00 0.00 51.96 53.01 1mxf s ALA 240 Cb -0.11 -3.21 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 1mxf s ALA 240 CO 0.47 0.18 0.87 -1.54 0.00 0.00 0.00 175.76 175.74 1mxf s SER 241 N -1.23 6.56 0.45 0.00 1.04 -1.26 -3.71 113.70 115.55 1mxf s SER 241 Ca 0.43 1.32 0.19 0.00 0.48 0.00 0.00 55.95 58.37 1mxf s SER 241 Cb -0.25 -2.40 1.15 0.00 0.10 0.00 0.00 66.02 64.61 1mxf s SER 241 CO 0.31 -0.49 1.93 0.00 0.98 0.00 0.00 173.24 175.97 1mxf h ALA 242 N 1.07 2.24 -0.13 5.32 0.00 -1.96 -0.58 119.26 125.22 1mxf h ALA 242 Ca -0.47 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 1mxf h ALA 242 Cb 1.19 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1mxf h ALA 242 CO 0.63 -0.44 -0.42 0.00 0.00 0.00 0.00 179.25 179.01 1mxf h ALA 243 N 1.65 1.05 -0.02 0.00 0.00 -1.93 -0.07 119.26 119.94 1mxf h ALA 243 Ca 0.36 -0.42 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 1mxf h ALA 243 Cb 0.96 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1mxf h ALA 243 CO -0.09 0.61 -0.63 1.96 0.00 0.00 0.00 179.25 181.09 1mxf h GLN 244 N 0.24 0.08 -0.09 0.00 4.20 -1.48 -0.70 115.11 117.36 1mxf h GLN 244 Ca 0.02 -0.06 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 1mxf h GLN 244 Cb 0.85 0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.64 1mxf h GLN 244 CO 0.07 0.69 -0.50 0.82 -0.67 0.00 0.00 178.83 179.23 1mxf h ILE 245 N 0.06 1.38 -0.16 2.54 1.08 -1.23 -3.17 117.51 118.00 1mxf h ILE 245 Ca -0.01 -1.84 -0.01 0.00 -0.39 0.00 0.00 64.86 62.61 1mxf h ILE 245 Cb 1.13 2.24 -0.01 0.00 -3.07 0.00 0.00 36.82 37.11 1mxf h ILE 245 CO 0.09 0.55 0.05 0.00 -0.69 0.00 0.00 178.15 178.15 1mxf h ALA 246 N 0.46 1.78 0.16 1.87 0.00 -0.85 -2.72 119.26 119.96 1mxf h ALA 246 Ca -0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1mxf h ALA 246 Cb 1.15 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1mxf h ALA 246 CO 0.10 0.17 -0.08 -0.44 0.00 0.00 0.00 179.25 179.01 1mxf h ASP 247 N 0.23 -0.19 -0.68 0.00 3.32 -1.10 0.33 116.42 118.33 1mxf h ASP 247 Ca 0.06 -0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.11 1mxf h ASP 247 Cb 0.08 0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.62 1mxf h ASP 247 CO -0.00 -0.08 0.39 0.00 -1.72 0.00 0.00 179.24 177.83 1mxf h ALA 248 N 0.55 0.90 -0.27 3.45 0.00 -1.52 -0.73 119.26 121.64 1mxf h ALA 248 Ca -0.02 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1mxf h ALA 248 Cb 0.22 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1mxf h ALA 248 CO 0.04 0.09 0.12 0.82 0.00 0.00 0.00 179.25 180.32 1mxf h ILE 249 N 0.73 1.16 -0.40 0.00 2.04 -1.34 -1.63 117.51 118.06 1mxf h ILE 249 Ca 0.29 -0.46 0.03 0.00 1.00 0.00 0.00 64.86 65.72 1mxf h ILE 249 Cb 0.14 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1mxf h ILE 249 CO -0.16 0.16 0.27 0.00 0.00 0.00 0.00 178.15 178.42 1mxf h ALA 250 N 0.97 1.85 -0.19 1.87 0.00 -0.37 -1.73 119.26 121.66 1mxf h ALA 250 Ca 0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1mxf h ALA 250 Cb 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1mxf h ALA 250 CO -0.01 0.11 -0.09 0.35 0.00 0.00 0.00 179.25 179.61 1mxf h PHE 251 N 0.43 0.46 0.00 0.00 3.57 -0.60 -2.64 116.94 118.15 1mxf h PHE 251 Ca 0.16 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1mxf h PHE 251 Cb 0.12 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 1mxf h PHE 251 CO -0.00 0.69 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.59 1mxf h LEU 252 N 0.09 0.00 0.00 0.59 3.38 -0.44 -2.28 115.31 116.66 1mxf h LEU 252 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1mxf h LEU 252 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1mxf h LEU 252 CO 0.03 0.11 -0.88 1.33 0.09 0.00 0.00 178.44 179.12 1mxf n VAL 253 N -3.44 0.33 -1.35 1.22 0.24 -0.88 -4.78 118.33 109.66 1mxf n VAL 253 Ca -0.01 -0.32 -0.29 0.00 -2.04 0.00 0.00 64.34 61.68 1mxf n VAL 253 Cb 0.27 -0.04 0.14 0.00 -1.47 0.00 0.00 33.84 32.74 1mxf n VAL 253 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1mxf s SER 254 N -4.33 3.31 0.32 -1.34 1.04 -0.86 -4.93 113.70 106.92 1mxf s SER 254 Ca 0.04 1.18 0.26 0.00 0.48 0.00 0.00 55.95 57.91 1mxf s SER 254 Cb 0.13 -1.83 0.99 0.00 0.10 0.00 0.00 66.02 65.41 1mxf s SER 254 CO 0.77 -2.70 1.78 0.11 0.98 0.00 0.00 173.24 174.18 1mxf h LYS 255 N -1.59 0.00 0.00 4.02 1.57 -1.92 -2.45 116.57 116.20 1mxf h LYS 255 Ca -0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1mxf h LYS 255 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1mxf h LYS 255 CO 0.59 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 179.22 1mxf n ASP 256 N -2.48 0.00 -0.11 0.86 9.92 -1.26 -1.80 116.55 121.68 1mxf n ASP 256 Ca 0.03 -0.24 0.07 0.00 -0.53 0.00 0.00 54.79 54.11 1mxf n ASP 256 Cb 0.30 -0.15 0.10 0.00 -0.64 0.00 0.00 41.12 40.73 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 -1.15 2.15 0.19 2.24 0.00 -0.92 -4.83 120.51 118.18 1mxf n ALA 257 Ca 0.11 -2.10 0.09 0.00 0.00 0.00 0.00 53.44 51.54 1mxf n ALA 257 Cb 0.10 -0.32 0.48 0.00 0.00 0.00 0.00 19.45 19.71 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 0.00 0.00 -1.04 0.00 0.00 -1.46 0.20 103.07 100.77 1mxf h GLY 258 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 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 -2.22 0.16 -3.51 5.60 9.36 -1.26 -4.96 117.16 120.32 1mxf n TYR 259 Ca -0.01 -0.17 -0.38 0.00 3.32 0.00 0.00 57.90 60.66 1mxf n TYR 259 Cb 0.27 -0.01 -0.10 0.00 -0.63 0.00 0.00 39.34 38.88 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 -0.96 5.26 -0.13 2.97 1.01 0.71 -5.06 121.20 124.99 1mxf s ILE 260 Ca 0.17 0.37 -0.16 0.00 0.00 0.00 0.00 60.65 61.03 1mxf s ILE 260 Cb 0.10 -3.61 0.04 0.00 0.01 0.00 0.00 42.46 39.01 1mxf s ILE 260 CO 0.15 0.23 0.43 0.28 0.00 0.00 0.00 174.94 176.03 1mxf s THR 261 N 1.71 0.01 -0.35 2.92 -1.32 -1.26 -4.69 115.64 112.65 1mxf s THR 261 Ca 0.11 -0.08 0.00 0.00 -1.21 0.00 0.00 61.69 60.52 1mxf s THR 261 Cb -0.15 -0.64 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 1mxf s THR 261 CO 0.09 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 173.07 1mxf n GLY 262 N 2.48 0.64 3.69 6.08 0.00 0.21 -4.93 105.19 113.35 1mxf n GLY 262 Ca -0.15 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.05 3.95 -0.25 2.61 -4.23 -1.26 -4.80 115.64 109.61 1mxf s THR 263 Ca 0.00 -1.14 -0.04 0.00 -1.18 0.00 0.00 61.69 59.33 1mxf s THR 263 Cb 0.00 -2.93 0.00 0.00 1.34 0.00 0.00 72.50 70.92 1mxf s THR 263 CO 0.00 0.03 -0.02 -0.89 -0.54 0.00 0.00 174.62 173.20 1mxf s THR 264 N -1.47 3.41 -0.43 3.99 2.01 -1.26 -1.23 115.64 120.67 1mxf s THR 264 Ca 0.27 -0.66 -0.19 0.00 0.31 0.00 0.00 61.69 61.42 1mxf s THR 264 Cb -0.11 -2.65 0.02 0.00 0.01 0.00 0.00 72.50 69.78 1mxf s THR 264 CO 0.19 0.29 0.52 -0.22 -0.69 0.00 0.00 174.62 174.70 1mxf s LEU 265 N 1.45 4.71 0.04 4.42 2.96 0.78 -4.91 118.68 128.13 1mxf s LEU 265 Ca 0.04 -0.53 -0.29 0.00 -0.22 0.00 0.00 54.13 53.12 1mxf s LEU 265 Cb -0.16 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 1mxf s LEU 265 CO -0.02 -0.66 0.94 -0.75 -1.32 0.00 0.00 176.35 174.54 1mxf s LYS 266 N 2.41 4.59 -0.51 1.98 2.20 -1.26 0.65 119.74 129.80 1mxf s LYS 266 Ca 0.16 1.37 0.05 0.00 -0.36 0.00 0.00 55.97 57.19 1mxf s LYS 266 Cb -0.16 -3.42 0.20 0.00 -1.51 0.00 0.00 37.83 32.94 1mxf s LYS 266 CO 0.16 0.07 0.48 0.28 -0.36 0.00 0.00 175.35 175.98 1mxf n VAL 267 N 3.44 0.11 -0.55 4.02 0.31 -0.16 -4.89 118.33 120.61 1mxf n VAL 267 Ca 0.04 -4.17 0.00 0.00 -0.01 0.00 0.00 64.34 60.20 1mxf n VAL 267 Cb 0.50 -1.92 0.01 0.00 -0.91 0.00 0.00 33.84 31.52 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 2.00 1.10 -2.73 4.52 5.75 -1.26 -2.97 116.55 122.97 1mxf n ASP 268 Ca 0.26 -1.64 -0.16 0.00 -0.01 0.00 0.00 54.79 53.24 1mxf n ASP 268 Cb 0.45 -0.03 -0.00 0.00 -1.03 0.00 0.00 41.12 40.51 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 -0.32 -0.50 2.40 6.12 0.00 -1.26 -1.36 105.19 110.27 1mxf n GLY 269 Ca 0.01 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.96 0.89 0.22 -0.02 0.00 -1.26 -1.50 105.19 102.56 1mxf n GLY 270 Ca -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.90 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 0.15 -1.36 0.99 5.85 -1.55 -0.77 115.31 118.63 1mxf h LEU 271 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1mxf h LEU 271 Cb 0.00 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1mxf h LEU 271 CO 0.00 0.10 0.00 -0.29 -0.34 0.00 0.00 178.44 177.91 1mxf h ILE 272 N 0.35 0.00 0.00 4.05 2.10 -1.92 -2.36 117.51 119.73 1mxf h ILE 272 Ca 0.29 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 66.14 1mxf h ILE 272 Cb 0.36 0.71 0.00 0.00 -1.09 0.00 0.00 36.82 36.80 1mxf h ILE 272 CO -0.31 0.00 -0.68 -0.07 -1.08 0.00 0.00 178.15 176.01 1mxf h LEU 273 N 0.00 0.00 -9.53 2.19 4.07 -1.54 -3.47 115.31 107.03 1mxf h LEU 273 Ca 0.00 -0.06 -0.53 0.00 0.08 0.00 0.00 57.88 57.37 1mxf h LEU 273 Cb 0.13 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.89 1mxf h LEU 273 CO 0.00 0.03 0.79 0.00 -1.08 0.00 0.00 178.44 178.18 1mxf s ALA 274 N -3.27 3.63 0.07 1.53 0.00 -0.89 -5.00 121.76 117.83 1mxf s ALA 274 Ca 0.03 1.15 -0.27 0.00 0.00 0.00 0.00 51.96 52.87 1mxf s ALA 274 Cb 0.10 -3.57 -0.06 0.00 0.00 0.00 0.00 23.12 19.59 1mxf s ALA 274 CO 0.74 -0.72 0.85 0.50 0.00 0.00 0.00 175.76 177.13 1mxf s ARG 275 N 1.38 4.58 0.00 0.00 3.52 -1.26 -5.09 118.95 122.08 1mxf s ARG 275 Ca 0.66 1.22 0.13 0.00 -0.13 0.00 0.00 55.73 57.62 1mxf s ARG 275 Cb -0.38 -3.37 0.78 0.00 -1.56 0.00 0.00 34.95 30.42 1mxf s ARG 275 CO 0.30 0.25 1.20 0.00 -0.81 0.00 0.00 175.30 176.25