#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 3.87 -0.04 0.00 0.04 -1.26 -4.90 135.00 132.71 1mxf s PRO 12 Ca 0.00 1.03 0.05 0.00 0.04 0.00 0.00 61.00 62.12 1mxf s PRO 12 Cb 0.00 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.39 1mxf s PRO 12 CO 0.00 -0.34 -0.18 0.00 0.04 0.00 0.00 177.00 176.52 1mxf s ALA 13 N -2.53 2.49 -0.05 8.56 0.00 -1.26 -1.11 121.76 127.85 1mxf s ALA 13 Ca 0.60 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 51.56 1mxf s ALA 13 Cb -0.11 -0.83 0.01 0.00 0.00 0.00 0.00 23.12 22.19 1mxf s ALA 13 CO 0.30 0.54 -0.13 0.00 0.00 0.00 0.00 175.76 176.48 1mxf s ALA 14 N -0.68 1.24 -0.21 0.00 0.00 0.98 0.07 121.76 123.16 1mxf s ALA 14 Ca 0.11 -0.47 -0.10 0.00 0.00 0.00 0.00 51.96 51.49 1mxf s ALA 14 Cb -0.10 -0.49 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 1mxf s ALA 14 CO 0.00 0.17 0.15 0.08 0.00 0.00 0.00 175.76 176.16 1mxf s VAL 15 N 0.37 5.39 -0.28 0.00 1.01 0.48 -0.80 120.40 126.56 1mxf s VAL 15 Ca -0.09 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1mxf s VAL 15 Cb -0.13 -3.49 0.08 0.00 0.00 0.00 0.00 36.38 32.84 1mxf s VAL 15 CO 0.02 0.42 -0.02 -0.63 0.00 0.00 0.00 175.10 174.89 1mxf s ILE 16 N 0.52 1.88 0.36 2.22 1.09 -0.70 -0.80 121.20 125.77 1mxf s ILE 16 Ca 0.09 -1.72 -0.26 0.00 -1.10 0.00 0.00 60.65 57.66 1mxf s ILE 16 Cb -0.12 -2.21 -0.09 0.00 -1.06 0.00 0.00 42.46 38.98 1mxf s ILE 16 CO -0.00 -0.30 1.05 0.42 -0.10 0.00 0.00 174.94 176.01 1mxf s THR 17 N 1.18 3.70 -1.75 2.92 -4.23 -0.93 -2.26 115.64 114.27 1mxf s THR 17 Ca 0.00 1.42 0.00 0.00 -1.18 0.00 0.00 61.69 61.93 1mxf s THR 17 Cb -0.19 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 69.86 1mxf s THR 17 CO -0.08 0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 1mxf n GLY 18 N 0.61 -0.32 1.02 3.99 0.00 -1.10 -2.25 105.19 107.14 1mxf n GLY 18 Ca 0.03 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.99 1.70 0.09 -0.02 0.00 -0.89 -4.26 105.19 100.83 1mxf n GLY 19 Ca -0.24 -0.45 -0.08 0.00 0.00 0.00 0.00 46.02 45.25 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 3.27 0.42 -2.87 4.61 0.00 -1.85 -3.06 119.26 119.78 1mxf h ALA 20 Ca 0.00 -0.82 -0.43 0.00 0.00 0.00 0.00 54.91 53.66 1mxf h ALA 20 Cb 0.98 -0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.53 1mxf h ALA 20 CO 0.16 1.07 -0.49 1.03 0.00 0.00 0.00 179.25 181.02 1mxf s ARG 21 N -2.92 1.69 1.29 0.00 0.52 -1.26 -4.51 118.95 113.77 1mxf s ARG 21 Ca -0.01 -1.95 0.00 0.00 -0.52 0.00 0.00 55.73 53.25 1mxf s ARG 21 Cb 0.10 0.33 0.00 0.00 0.52 0.00 0.00 34.95 35.89 1mxf s ARG 21 CO 0.83 -0.62 0.00 0.54 0.02 0.00 0.00 175.30 176.06 1mxf n ARG 22 N -0.57 0.00 -0.22 3.54 1.74 -1.26 -1.60 116.66 118.29 1mxf n ARG 22 Ca 0.06 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.17 1mxf n ARG 22 Cb 0.63 0.00 0.13 0.00 -1.02 0.00 0.00 32.46 32.20 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 0.61 -0.79 0.55 2.04 -1.92 -1.23 117.51 116.76 1mxf h ILE 23 Ca 0.00 -0.09 0.02 0.00 1.00 0.00 0.00 64.86 65.79 1mxf h ILE 23 Cb 0.00 0.31 -0.04 0.00 -0.74 0.00 0.00 36.82 36.35 1mxf h ILE 23 CO 0.00 0.05 0.52 1.23 0.00 0.00 0.00 178.15 179.95 1mxf h GLY 24 N 0.27 1.12 0.80 5.37 0.00 -1.65 -0.73 103.07 108.25 1mxf h GLY 24 Ca 0.35 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 1mxf h GLY 24 CO -0.43 0.37 -0.00 0.84 0.00 0.00 0.00 176.54 177.32 1mxf h HIS 25 N 1.03 -0.01 -1.00 5.60 -0.00 -0.26 -1.61 115.15 118.91 1mxf h HIS 25 Ca 0.30 -0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.76 1mxf h HIS 25 Cb -0.05 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 27.29 1mxf h HIS 25 CO -0.00 0.19 0.64 1.03 -0.00 0.00 0.00 177.93 179.79 1mxf h SER 26 N -0.21 0.98 -0.17 3.26 0.87 -0.88 -1.36 113.55 116.04 1mxf h SER 26 Ca -0.00 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1mxf h SER 26 Cb 0.20 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 1mxf h SER 26 CO 0.00 0.58 -0.02 0.40 -0.53 0.00 0.00 176.83 177.26 1mxf h ILE 27 N 1.09 1.27 -0.29 2.23 2.04 -0.90 -1.86 117.51 121.09 1mxf h ILE 27 Ca 0.46 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.41 1mxf h ILE 27 Cb 0.32 1.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 1mxf h ILE 27 CO -0.21 0.28 0.13 0.00 0.00 0.00 0.00 178.15 178.34 1mxf h ALA 28 N 0.75 0.34 0.41 1.87 0.00 -0.69 -1.04 119.26 120.91 1mxf h ALA 28 Ca 0.05 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1mxf h ALA 28 Cb 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1mxf h ALA 28 CO 0.01 -0.27 -0.31 0.28 0.00 0.00 0.00 179.25 178.96 1mxf h VAL 29 N 0.27 0.36 -0.22 0.00 2.07 -1.27 0.19 116.25 117.65 1mxf h VAL 29 Ca 0.13 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.70 1mxf h VAL 29 Cb 0.07 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.12 1mxf h VAL 29 CO -0.11 0.00 -0.43 -0.09 0.02 0.00 0.00 177.57 176.97 1mxf h ARG 30 N -0.72 -0.42 -0.46 1.57 9.65 -1.12 0.51 114.38 123.39 1mxf h ARG 30 Ca -0.04 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 58.91 1mxf h ARG 30 Cb 0.61 0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.27 1mxf h ARG 30 CO 0.00 -0.28 0.30 -0.07 2.80 0.00 0.00 179.97 182.72 1mxf h LEU 31 N -0.44 0.41 -0.32 3.80 3.38 -1.11 -1.31 115.31 119.72 1mxf h LEU 31 Ca 0.09 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 1mxf h LEU 31 Cb 0.61 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1mxf h LEU 31 CO -0.45 0.28 -0.40 -0.74 0.09 0.00 0.00 178.44 177.21 1mxf h HIS 32 N 0.48 1.02 0.00 1.13 2.76 0.11 -1.14 115.15 119.51 1mxf h HIS 32 Ca 0.19 -0.33 0.00 0.00 -2.20 0.00 0.00 60.37 58.03 1mxf h HIS 32 Cb 0.16 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 28.91 1mxf h HIS 32 CO -0.00 1.13 0.00 1.04 -1.30 0.00 0.00 177.93 178.80 1mxf n GLN 33 N -4.12 0.04 -0.39 5.26 6.02 0.16 -1.20 117.38 123.16 1mxf n GLN 33 Ca -0.04 0.42 0.10 0.00 -0.01 0.00 0.00 57.00 57.47 1mxf n GLN 33 Cb 0.55 -1.61 0.29 0.00 1.02 0.00 0.00 30.24 30.49 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 -1.69 3.03 -0.36 -1.09 6.02 -0.96 -4.93 117.38 117.41 1mxf n GLN 34 Ca 0.01 -2.58 0.00 0.00 -0.01 0.00 0.00 57.00 54.42 1mxf n GLN 34 Cb 0.10 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 29.77 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 1.14 0.80 3.83 1.08 0.00 -0.34 -5.07 105.19 106.63 1mxf n GLY 35 Ca 0.22 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 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 3.67 -0.27 1.61 0.08 -0.47 -4.44 117.98 116.17 1mxf s PHE 36 Ca 0.00 1.15 -0.13 0.00 0.12 0.00 0.00 56.93 58.07 1mxf s PHE 36 Cb 0.00 -2.43 -0.04 0.00 -0.57 0.00 0.00 43.02 39.98 1mxf s PHE 36 CO 0.00 0.47 0.28 1.03 -0.10 0.00 0.00 175.22 176.90 1mxf s ARG 37 N -1.69 4.00 -0.02 0.44 0.52 -0.27 -4.28 118.95 117.65 1mxf s ARG 37 Ca 0.35 -0.12 0.03 0.00 -0.52 0.00 0.00 55.73 55.47 1mxf s ARG 37 Cb -0.16 -3.64 -0.03 0.00 0.52 0.00 0.00 34.95 31.63 1mxf s ARG 37 CO 0.19 -0.19 -0.08 0.14 0.02 0.00 0.00 175.30 175.37 1mxf s VAL 38 N 1.81 3.53 -0.40 3.52 -7.23 -0.64 -0.02 120.40 120.98 1mxf s VAL 38 Ca 0.11 -0.70 -0.12 0.00 -1.81 0.00 0.00 61.98 59.46 1mxf s VAL 38 Cb -0.16 -2.49 0.04 0.00 0.56 0.00 0.00 36.38 34.34 1mxf s VAL 38 CO 0.10 0.48 0.26 -0.69 -0.31 0.00 0.00 175.10 174.94 1mxf s VAL 39 N -0.90 4.75 -0.52 1.32 1.01 0.02 -2.10 120.40 123.99 1mxf s VAL 39 Ca 0.15 -0.93 -0.21 0.00 0.00 0.00 0.00 61.98 60.99 1mxf s VAL 39 Cb -0.11 -3.71 0.05 0.00 0.00 0.00 0.00 36.38 32.61 1mxf s VAL 39 CO 0.05 -0.34 0.73 -0.69 0.00 0.00 0.00 175.10 174.85 1mxf s VAL 40 N 1.57 4.71 0.20 2.92 1.01 -0.10 -1.72 120.40 129.00 1mxf s VAL 40 Ca 0.03 -0.19 -0.10 0.00 0.00 0.00 0.00 61.98 61.72 1mxf s VAL 40 Cb -0.20 -4.37 -0.07 0.00 0.00 0.00 0.00 36.38 31.73 1mxf s VAL 40 CO 0.07 -0.90 0.53 -2.28 0.00 0.00 0.00 175.10 172.52 1mxf s HIS 41 N 3.09 3.46 0.33 5.22 5.04 -0.96 -1.90 115.29 129.57 1mxf s HIS 41 Ca 0.21 0.87 -0.11 0.00 -1.54 0.00 0.00 55.06 54.48 1mxf s HIS 41 Cb -0.17 -2.25 0.02 0.00 0.04 0.00 0.00 32.58 30.23 1mxf s HIS 41 CO 0.15 0.32 0.61 1.52 -2.34 0.00 0.00 174.74 174.99 1mxf s TYR 42 N -1.74 0.46 0.12 3.88 1.13 -0.47 -2.10 117.35 118.64 1mxf s TYR 42 Ca 0.45 -0.90 0.00 0.00 -1.41 0.00 0.00 57.07 55.21 1mxf s TYR 42 Cb -0.12 0.37 0.00 0.00 -1.10 0.00 0.00 41.96 41.12 1mxf s TYR 42 CO 0.21 -1.27 0.00 -2.13 -2.51 0.00 0.00 175.55 169.85 1mxf n ARG 43 N -0.50 0.00 -0.00 -3.49 0.63 -1.26 -1.14 116.66 110.90 1mxf n ARG 43 Ca -0.03 0.00 0.02 0.00 -0.92 0.00 0.00 57.85 56.91 1mxf n ARG 43 Cb 0.61 -0.35 -0.02 0.00 0.45 0.00 0.00 32.46 33.15 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 -3.36 0.00 -0.57 -0.14 8.25 -1.26 -4.70 115.22 113.44 1mxf n HIS 44 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 1mxf n HIS 44 Cb 0.00 -0.07 -0.06 0.00 1.12 0.00 0.00 29.99 30.98 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 -1.59 4.11 -0.35 0.41 7.64 -1.26 -4.56 113.62 118.02 1mxf n SER 45 Ca -0.01 -2.17 0.16 0.00 1.01 0.00 0.00 58.87 57.86 1mxf n SER 45 Cb 0.08 -0.98 0.36 0.00 -1.01 0.00 0.00 64.21 62.66 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 2.61 0.64 0.08 1.43 4.22 -1.97 -1.01 114.58 120.57 1mxf h GLU 46 Ca 0.07 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.47 1mxf h GLU 46 Cb 0.96 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1mxf h GLU 46 CO 0.14 0.42 -0.04 0.78 -2.18 0.00 0.00 179.01 178.13 1mxf h GLY 47 N 0.66 -0.11 1.28 1.92 0.00 -2.01 -2.51 103.07 102.30 1mxf h GLY 47 Ca 0.62 0.04 0.01 0.00 0.00 0.00 0.00 47.33 48.00 1mxf h GLY 47 CO -0.44 -0.04 0.48 0.00 0.00 0.00 0.00 176.54 176.54 1mxf h ALA 48 N 0.43 1.47 -0.75 3.60 0.00 -1.76 -1.98 119.26 120.27 1mxf h ALA 48 Ca -0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1mxf h ALA 48 Cb 0.38 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1mxf h ALA 48 CO 0.02 0.49 0.42 0.00 0.00 0.00 0.00 179.25 180.17 1mxf h ALA 49 N 1.54 0.97 -0.10 0.00 0.00 -1.12 -1.01 119.26 119.53 1mxf h ALA 49 Ca 0.27 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1mxf h ALA 49 Cb -0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 1mxf h ALA 49 CO -0.06 0.48 -0.66 1.96 0.00 0.00 0.00 179.25 180.97 1mxf h GLN 50 N 1.04 0.39 -0.01 0.00 4.20 -0.99 -1.47 115.11 118.28 1mxf h GLN 50 Ca 0.27 -0.29 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 1mxf h GLN 50 Cb 0.03 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1mxf h GLN 50 CO -0.04 0.91 -0.61 0.00 -0.67 0.00 0.00 178.83 178.42 1mxf h ARG 51 N 0.28 0.03 -0.02 1.46 3.08 -1.14 -1.85 114.38 116.22 1mxf h ARG 51 Ca -0.02 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1mxf h ARG 51 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1mxf h ARG 51 CO 0.11 0.63 -0.14 1.25 -1.07 0.00 0.00 179.97 180.76 1mxf h LEU 52 N 0.02 0.17 -0.73 3.04 5.85 -1.10 -2.30 115.31 120.26 1mxf h LEU 52 Ca -0.01 -0.68 -0.07 0.00 0.84 0.00 0.00 57.88 57.96 1mxf h LEU 52 Cb 1.09 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 1mxf h LEU 52 CO 0.08 0.81 0.13 0.58 -0.34 0.00 0.00 178.44 179.70 1mxf h VAL 53 N -0.47 1.26 -0.11 1.05 2.07 -1.27 -0.03 116.25 118.75 1mxf h VAL 53 Ca -0.01 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1mxf h VAL 53 Cb 0.81 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1mxf h VAL 53 CO 0.03 0.38 -0.02 0.00 0.02 0.00 0.00 177.57 177.98 1mxf h ALA 54 N 1.10 0.15 -0.91 1.67 0.00 -1.44 0.20 119.26 120.03 1mxf h ALA 54 Ca 0.21 -0.21 0.15 0.00 0.00 0.00 0.00 54.91 55.05 1mxf h ALA 54 Cb 0.41 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.07 1mxf h ALA 54 CO 0.01 -0.13 0.51 1.49 0.00 0.00 0.00 179.25 181.14 1mxf h GLU 55 N -0.11 0.71 -0.02 0.00 4.81 -1.21 0.36 114.58 119.13 1mxf h GLU 55 Ca 0.03 -0.04 -0.23 0.00 -0.13 0.00 0.00 59.36 58.99 1mxf h GLU 55 Cb 0.42 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.65 1mxf h GLU 55 CO 0.01 0.47 -0.93 -0.07 -0.73 0.00 0.00 179.01 177.76 1mxf h LEU 56 N 0.73 0.61 -1.21 1.64 3.38 -0.84 -2.99 115.31 116.64 1mxf h LEU 56 Ca 0.49 -0.48 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1mxf h LEU 56 Cb 0.67 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1mxf h LEU 56 CO -0.35 1.27 -0.28 0.78 0.09 0.00 0.00 178.44 179.96 1mxf h ASN 57 N 0.28 0.00 -0.42 -0.43 2.35 0.40 -1.04 115.58 116.72 1mxf h ASN 57 Ca -0.08 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.54 1mxf h ASN 57 Cb 1.56 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.92 1mxf h ASN 57 CO 0.17 0.28 -0.23 0.00 -1.65 0.00 0.00 177.43 175.99 1mxf h ALA 58 N 1.72 0.73 -0.11 -0.83 0.00 -0.27 -1.76 119.26 118.75 1mxf h ALA 58 Ca -0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 54.91 54.38 1mxf h ALA 58 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1mxf h ALA 58 CO 0.04 0.67 -0.53 0.00 0.00 0.00 0.00 179.25 179.42 1mxf h ALA 59 N 0.93 0.89 -1.37 0.00 0.00 -1.27 -3.42 119.26 115.02 1mxf h ALA 59 Ca 0.10 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1mxf h ALA 59 Cb 0.80 -0.09 -0.25 0.00 0.00 0.00 0.00 17.79 18.25 1mxf h ALA 59 CO 0.07 0.68 -0.38 1.03 0.00 0.00 0.00 179.25 180.65 1mxf s ARG 60 N -3.94 0.48 0.38 0.00 0.52 -0.45 -5.12 118.95 110.83 1mxf s ARG 60 Ca -0.05 0.72 -0.26 0.00 -0.52 0.00 0.00 55.73 55.62 1mxf s ARG 60 Cb 0.12 0.10 -0.11 0.00 0.52 0.00 0.00 34.95 35.58 1mxf s ARG 60 CO 0.80 -0.71 1.18 0.00 0.02 0.00 0.00 175.30 176.59 1mxf n ALA 61 N 5.40 0.81 -2.05 2.13 0.00 -0.68 -2.29 120.51 123.82 1mxf n ALA 61 Ca -0.01 0.30 -0.21 0.00 0.00 0.00 0.00 53.44 53.52 1mxf n ALA 61 Cb 0.51 -2.18 -0.04 0.00 0.00 0.00 0.00 19.45 17.73 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 0.95 0.60 0.02 0.00 0.00 -1.26 -4.88 105.19 100.61 1mxf n GLY 62 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.74 0.10 -3.91 1.61 3.41 -0.97 -4.96 113.62 107.16 1mxf n SER 63 Ca -0.23 -0.01 -0.17 0.00 -0.26 0.00 0.00 58.87 58.19 1mxf n SER 63 Cb 0.69 1.84 -0.15 0.00 -0.26 0.00 0.00 64.21 66.33 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 -3.49 0.48 0.18 7.33 0.00 -1.26 -1.61 121.76 123.39 1mxf s ALA 64 Ca -0.07 -0.10 0.07 0.00 0.00 0.00 0.00 51.96 51.86 1mxf s ALA 64 Cb 0.14 -0.24 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 1mxf s ALA 64 CO 0.90 0.04 -0.14 0.54 0.00 0.00 0.00 175.76 177.11 1mxf s VAL 65 N 0.39 1.59 0.19 0.00 0.11 -0.89 -4.84 120.40 116.95 1mxf s VAL 65 Ca -0.04 -2.13 0.05 0.00 -2.93 0.00 0.00 61.98 56.93 1mxf s VAL 65 Cb -0.08 -1.96 -0.04 0.00 -1.53 0.00 0.00 36.38 32.78 1mxf s VAL 65 CO -0.00 -0.60 0.19 -0.22 -3.33 0.00 0.00 175.10 171.13 1mxf s LEU 66 N -3.20 3.92 -0.30 2.54 2.96 -1.26 -0.92 118.68 122.42 1mxf s LEU 66 Ca 0.20 -0.11 -0.05 0.00 -0.22 0.00 0.00 54.13 53.95 1mxf s LEU 66 Cb -0.01 -2.50 0.16 0.00 0.50 0.00 0.00 46.19 44.35 1mxf s LEU 66 CO 0.05 0.03 0.65 0.00 -1.32 0.00 0.00 176.35 175.75 1mxf s LYS 68 N 2.87 3.42 0.00 0.00 2.20 -1.26 -1.36 119.74 125.60 1mxf s LYS 68 Ca 0.09 -0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.47 1mxf s LYS 68 Cb -0.13 -3.13 0.00 0.00 -1.51 0.00 0.00 37.83 33.05 1mxf s LYS 68 CO -0.20 0.73 0.00 0.41 -0.36 0.00 0.00 175.35 175.93 1mxf n GLY 69 N 1.52 1.13 3.90 5.54 0.00 -0.29 -4.94 105.19 112.04 1mxf n GLY 69 Ca -0.16 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.06 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 6.40 -0.15 1.61 2.15 -1.26 -4.25 116.67 121.16 1mxf s ASP 70 Ca 0.00 0.41 0.16 0.00 0.43 0.00 0.00 52.55 53.55 1mxf s ASP 70 Cb 0.00 -2.03 0.45 0.00 -0.30 0.00 0.00 42.92 41.03 1mxf s ASP 70 CO 0.00 0.30 1.34 0.18 -0.17 0.00 0.00 175.17 176.82 1mxf n LEU 71 N 1.21 3.44 -4.81 -1.34 4.77 -1.26 -4.93 117.00 114.08 1mxf n LEU 71 Ca -0.13 -2.91 -0.32 0.00 -0.03 0.00 0.00 56.01 52.63 1mxf n LEU 71 Cb 0.53 -0.48 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 1mxf n LEU 71 CO 0.40 0.68 0.71 -0.44 -1.33 0.00 0.00 177.39 177.42 1mxf s SER 72 N -2.01 5.44 0.51 -1.43 0.01 -1.26 -2.31 113.70 112.66 1mxf s SER 72 Ca 0.37 1.70 -0.23 0.00 1.31 0.00 0.00 55.95 59.11 1mxf s SER 72 Cb 0.30 -2.51 -0.06 0.00 0.21 0.00 0.00 66.02 63.96 1mxf s SER 72 CO 0.08 -1.40 1.29 0.18 0.41 0.00 0.00 173.24 173.80 1mxf n LEU 73 N -2.80 4.90 0.00 2.44 4.77 0.88 -4.63 117.00 122.55 1mxf n LEU 73 Ca 0.08 1.00 0.00 0.00 -0.03 0.00 0.00 56.01 57.06 1mxf n LEU 73 Cb 0.53 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 1mxf n LEU 73 CO 0.53 -0.72 0.00 -0.24 -1.33 0.00 0.00 177.39 175.63 1mxf n SER 74 N -0.61 0.00 0.23 -1.43 2.88 -1.26 -4.88 113.62 108.56 1mxf n SER 74 Ca 0.09 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.73 1mxf n SER 74 Cb 0.43 0.00 0.57 0.00 -0.75 0.00 0.00 64.21 64.47 1mxf n SER 74 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1mxf h SER 75 N 0.00 0.00 0.50 -3.46 0.02 -2.05 -2.93 113.55 105.62 1mxf h SER 75 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1mxf h SER 75 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1mxf h SER 75 CO 0.00 0.21 -0.72 -1.20 -1.14 0.00 0.00 176.83 173.98 1mxf n SER 76 N -3.76 0.61 -0.10 3.07 7.64 -1.26 -4.50 113.62 115.32 1mxf n SER 76 Ca -0.02 -0.25 -0.06 0.00 1.01 0.00 0.00 58.87 59.56 1mxf n SER 76 Cb 0.31 0.46 0.01 0.00 -1.01 0.00 0.00 64.21 63.98 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 0.00 -0.58 -0.50 -3.43 5.85 -1.77 -0.29 115.31 114.59 1mxf h LEU 77 Ca 0.00 0.14 0.09 0.00 0.84 0.00 0.00 57.88 58.95 1mxf h LEU 77 Cb 0.61 0.32 -0.08 0.00 0.37 0.00 0.00 40.66 41.88 1mxf h LEU 77 CO 0.00 -0.20 0.02 0.25 -0.34 0.00 0.00 178.44 178.17 1mxf h LEU 78 N -0.11 -0.16 -0.76 2.25 5.85 -1.79 -0.61 115.31 119.98 1mxf h LEU 78 Ca 0.18 0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.88 1mxf h LEU 78 Cb 0.39 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1mxf h LEU 78 CO -0.43 -0.05 -0.57 0.44 -0.34 0.00 0.00 178.44 177.48 1mxf h ASP 79 N 0.14 0.15 -0.65 1.25 3.32 -1.74 -2.21 116.42 116.68 1mxf h ASP 79 Ca 0.25 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 1mxf h ASP 79 Cb 0.37 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1mxf h ASP 79 CO -0.40 0.69 0.09 0.00 -1.72 0.00 0.00 179.24 177.91 1mxf h GLU 82 N 0.45 1.09 -0.02 0.00 4.39 -0.99 -2.71 114.58 116.79 1mxf h GLU 82 Ca 0.04 -0.16 -0.15 0.00 0.34 0.00 0.00 59.36 59.43 1mxf h GLU 82 Cb 0.92 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.36 1mxf h GLU 82 CO 0.08 0.84 -0.67 -0.44 -1.16 0.00 0.00 179.01 177.67 1mxf h ASP 83 N 1.07 0.10 -0.34 1.42 3.32 -1.11 -1.36 116.42 119.51 1mxf h ASP 83 Ca 0.26 -0.06 -0.11 0.00 0.02 0.00 0.00 57.03 57.14 1mxf h ASP 83 Cb 0.11 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1mxf h ASP 83 CO -0.03 0.74 -0.19 -0.29 -1.72 0.00 0.00 179.24 177.75 1mxf h ILE 84 N 0.06 1.27 -0.04 0.35 -0.00 -1.18 0.14 117.51 118.11 1mxf h ILE 84 Ca -0.01 -1.30 -0.14 0.00 -0.00 0.00 0.00 64.86 63.41 1mxf h ILE 84 Cb 1.19 1.14 0.01 0.00 -0.00 0.00 0.00 36.82 39.16 1mxf h ILE 84 CO 0.09 0.44 -0.51 0.40 -0.00 0.00 0.00 178.15 178.57 1mxf h ILE 85 N 0.72 1.42 -0.73 2.19 1.08 -1.42 -3.17 117.51 117.60 1mxf h ILE 85 Ca 0.11 -1.95 0.11 0.00 -0.39 0.00 0.00 64.86 62.74 1mxf h ILE 85 Cb 0.70 2.45 -0.05 0.00 -3.07 0.00 0.00 36.82 36.85 1mxf h ILE 85 CO 0.05 0.57 0.48 -0.78 -0.69 0.00 0.00 178.15 177.78 1mxf h ASP 86 N -0.07 0.50 -0.90 1.72 3.58 -1.13 -0.64 116.42 119.48 1mxf h ASP 86 Ca -0.05 0.02 0.14 0.00 0.42 0.00 0.00 57.03 57.55 1mxf h ASP 86 Cb 1.20 -0.09 -0.07 0.00 1.72 0.00 0.00 39.33 42.09 1mxf h ASP 86 CO 0.10 0.29 0.58 0.00 -2.88 0.00 0.00 179.24 177.33 1mxf h SER 88 N 0.72 0.82 -0.10 0.00 0.87 -1.20 -1.94 113.55 112.72 1mxf h SER 88 Ca 0.45 -0.31 -0.21 0.00 -1.23 0.00 0.00 61.79 60.49 1mxf h SER 88 Cb 0.68 -0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.43 1mxf h SER 88 CO -0.21 1.03 -0.77 -0.26 -0.53 0.00 0.00 176.83 176.09 1mxf h PHE 89 N 0.70 0.97 0.00 2.24 0.04 -1.13 0.16 116.94 119.92 1mxf h PHE 89 Ca 0.09 -0.46 -0.00 0.00 2.80 0.00 0.00 57.97 60.40 1mxf h PHE 89 Cb 0.77 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.78 1mxf h PHE 89 CO 0.04 1.28 -0.00 0.00 -0.60 0.00 0.00 178.31 179.03 1mxf h ARG 90 N 0.38 -0.00 -0.15 1.51 2.47 -0.91 1.94 114.38 119.61 1mxf h ARG 90 Ca -0.07 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.45 1mxf h ARG 90 Cb 1.42 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.74 1mxf h ARG 90 CO 0.16 0.01 -0.70 0.00 0.56 0.00 0.00 179.97 180.00 1mxf h ALA 91 N 0.99 0.48 0.00 0.04 0.00 -1.41 -3.38 119.26 115.98 1mxf h ALA 91 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1mxf h ALA 91 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1mxf h ALA 91 CO 0.00 0.71 0.00 1.19 0.00 0.00 0.00 179.25 181.15 1mxf n PHE 92 N -3.92 0.00 -1.05 0.00 3.72 0.54 -5.00 117.46 111.75 1mxf n PHE 92 Ca -0.05 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.33 1mxf n PHE 92 Cb 0.70 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.23 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 0.13 0.32 3.59 1.37 0.00 0.66 -4.92 105.19 106.34 1mxf n GLY 93 Ca 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.58 0.91 -0.23 1.61 1.70 -1.25 -4.90 118.95 115.22 1mxf s ARG 94 Ca 0.00 -0.41 -0.04 0.00 -0.47 0.00 0.00 55.73 54.82 1mxf s ARG 94 Cb 0.00 0.37 0.12 0.00 -0.57 0.00 0.00 34.95 34.87 1mxf s ARG 94 CO 0.00 -0.41 0.36 0.00 -1.08 0.00 0.00 175.30 174.18 1mxf n ASP 96 N 5.36 1.64 -4.15 0.00 9.92 0.11 -4.92 116.55 124.52 1mxf n ASP 96 Ca -0.05 -0.03 -0.26 0.00 -0.53 0.00 0.00 54.79 53.93 1mxf n ASP 96 Cb 0.50 0.51 -0.16 0.00 -0.64 0.00 0.00 41.12 41.34 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 -2.37 1.42 -0.13 2.53 1.01 -0.70 -2.11 120.40 120.04 1mxf s VAL 97 Ca -0.13 -0.74 -0.00 0.00 0.00 0.00 0.00 61.98 61.11 1mxf s VAL 97 Cb 0.05 -1.20 0.03 0.00 0.00 0.00 0.00 36.38 35.26 1mxf s VAL 97 CO 0.57 0.41 -0.09 -0.22 0.00 0.00 0.00 175.10 175.76 1mxf s LEU 98 N -0.18 1.41 -0.33 3.92 2.96 -1.02 -0.39 118.68 125.05 1mxf s LEU 98 Ca 0.01 -0.42 -0.02 0.00 -0.22 0.00 0.00 54.13 53.48 1mxf s LEU 98 Cb -0.09 -0.95 0.07 0.00 0.50 0.00 0.00 46.19 45.71 1mxf s LEU 98 CO 0.01 -0.11 0.07 -0.69 -1.32 0.00 0.00 176.35 174.30 1mxf s VAL 99 N 1.63 3.13 -1.09 1.68 1.01 0.02 -0.79 120.40 126.00 1mxf s VAL 99 Ca 0.04 -1.56 -0.20 0.00 0.00 0.00 0.00 61.98 60.26 1mxf s VAL 99 Cb -0.13 -2.90 0.09 0.00 0.00 0.00 0.00 36.38 33.44 1mxf s VAL 99 CO -0.09 -0.28 1.44 0.20 0.00 0.00 0.00 175.10 176.37 1mxf s ASN 100 N 1.41 6.69 -0.22 3.32 0.01 -0.25 -2.18 114.94 123.70 1mxf s ASN 100 Ca -0.01 -2.03 0.04 0.00 -0.71 0.00 0.00 52.86 50.15 1mxf s ASN 100 Cb -0.20 -2.51 -0.20 0.00 0.41 0.00 0.00 41.25 38.75 1mxf s ASN 100 CO -0.02 -1.22 -0.07 -3.20 -1.51 0.00 0.00 177.10 171.08 1mxf n ASN 101 N 7.78 1.59 -4.48 -1.22 5.15 -1.23 -1.81 115.26 121.03 1mxf n ASN 101 Ca 0.35 -0.05 -0.48 0.00 -0.60 0.00 0.00 54.58 53.80 1mxf n ASN 101 Cb 0.48 -0.19 -0.03 0.00 -0.53 0.00 0.00 39.78 39.52 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 -3.11 -1.92 -3.58 5.20 0.00 -0.95 -4.88 120.51 111.27 1mxf n ALA 102 Ca -0.41 0.43 -0.02 0.00 0.00 0.00 0.00 53.44 53.45 1mxf n ALA 102 Cb 1.03 -1.78 -0.06 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.73 -0.63 0.18 0.00 0.15 -1.26 -4.57 113.70 106.84 1mxf s SER 103 Ca 0.64 0.96 -0.20 0.00 0.70 0.00 0.00 55.95 58.05 1mxf s SER 103 Cb -0.87 1.43 -0.08 0.00 -1.71 0.00 0.00 66.02 64.80 1mxf s SER 103 CO 0.57 -0.15 0.69 0.00 1.20 0.00 0.00 173.24 175.56 1mxf s ALA 104 N 1.79 3.46 -0.20 5.45 0.00 -1.26 -5.04 121.76 125.95 1mxf s ALA 104 Ca -0.07 0.16 -0.04 0.00 0.00 0.00 0.00 51.96 52.01 1mxf s ALA 104 Cb -0.05 -2.79 0.10 0.00 0.00 0.00 0.00 23.12 20.38 1mxf s ALA 104 CO -0.17 0.34 0.28 -0.47 0.00 0.00 0.00 175.76 175.75 1mxf s TYR 105 N -1.38 -0.48 -0.08 0.00 5.04 -1.26 -4.90 117.35 114.29 1mxf s TYR 105 Ca 0.39 0.56 -0.32 0.00 -2.44 0.00 0.00 57.07 55.26 1mxf s TYR 105 Cb -0.18 -0.18 0.12 0.00 0.35 0.00 0.00 41.96 42.07 1mxf s TYR 105 CO 0.22 -0.60 1.04 1.52 -1.34 0.00 0.00 175.55 176.38 1mxf s TYR 106 N 2.42 -0.24 0.67 4.97 -0.85 -1.26 -5.17 117.35 117.88 1mxf s TYR 106 Ca 0.08 0.14 -0.15 0.00 -0.52 0.00 0.00 57.07 56.62 1mxf s TYR 106 Cb -0.15 0.53 0.01 0.00 0.38 0.00 0.00 41.96 42.73 1mxf s TYR 106 CO -0.13 -0.40 1.13 -1.25 -1.52 0.00 0.00 175.55 173.38 1mxf s PRO 107 N -2.80 2.68 -0.45 -3.49 0.04 -1.26 -4.74 135.00 124.98 1mxf s PRO 107 Ca 0.07 1.46 0.07 0.00 0.04 0.00 0.00 61.00 62.64 1mxf s PRO 107 Cb -0.01 -1.93 0.27 0.00 0.04 0.00 0.00 34.50 32.87 1mxf s PRO 107 CO -0.07 -1.35 0.81 0.25 0.04 0.00 0.00 177.00 176.68 1mxf n THR 108 N -2.46 -0.21 -1.67 1.26 -2.24 0.27 -4.97 114.28 104.26 1mxf n THR 108 Ca 0.11 -2.49 -0.45 0.00 -2.27 0.00 0.00 64.05 58.94 1mxf n THR 108 Cb 0.52 0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 69.10 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 1.22 2.07 -0.13 -0.78 -0.04 -1.19 -4.43 135.00 131.71 1mxf n PRO 109 Ca 0.13 0.74 -0.08 0.00 -0.04 0.00 0.00 63.50 64.25 1mxf n PRO 109 Cb 0.62 -2.44 -0.00 0.00 -0.04 0.00 0.00 33.50 31.64 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 4.89 0.49 -9.63 1.53 3.38 -2.01 -3.41 115.31 110.55 1mxf h LEU 110 Ca -0.45 -0.06 -0.64 0.00 0.09 0.00 0.00 57.88 56.82 1mxf h LEU 110 Cb 1.27 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.83 1mxf h LEU 110 CO 0.81 0.41 -0.37 -0.76 0.09 0.00 0.00 178.44 178.62 1mxf s LEU 111 N -10.05 4.41 0.51 1.67 2.01 -1.26 -5.26 118.68 110.71 1mxf s LEU 111 Ca -0.13 0.65 -0.23 0.00 0.01 0.00 0.00 54.13 54.43 1mxf s LEU 111 Cb 0.11 -2.28 -0.06 0.00 0.01 0.00 0.00 46.19 43.97 1mxf s LEU 111 CO 0.73 0.36 1.36 -2.16 1.01 0.00 0.00 176.35 177.65 1mxf s PRO 112 N -0.95 3.37 0.00 1.29 0.04 -1.26 -5.16 135.00 132.33 1mxf s PRO 112 Ca 0.18 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.47 1mxf s PRO 112 Cb -0.14 -2.40 0.00 0.00 0.04 0.00 0.00 34.50 32.00 1mxf s PRO 112 CO 0.07 -1.01 0.00 1.17 0.04 0.00 0.00 177.00 177.27 1mxf n LYS 123 N -0.71 0.00 -1.54 4.56 4.81 -1.26 -5.15 118.16 118.86 1mxf n LYS 123 Ca 0.08 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.10 1mxf n LYS 123 Cb 0.44 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.49 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 0.16 1.02 -0.24 1.64 -0.02 -1.26 -4.83 135.00 131.47 1mxf n PRO 124 Ca 0.00 0.36 -0.06 0.00 -2.02 0.00 0.00 63.50 61.78 1mxf n PRO 124 Cb 0.00 -1.76 0.08 0.00 -0.02 0.00 0.00 33.50 31.80 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 1.37 1.26 -0.77 4.25 6.09 -2.04 -1.36 117.51 126.32 1mxf h ILE 125 Ca -0.41 -0.94 -0.02 0.00 -1.37 0.00 0.00 64.86 62.12 1mxf h ILE 125 Cb 1.36 0.54 -0.04 0.00 0.47 0.00 0.00 36.82 39.15 1mxf h ILE 125 CO 0.56 0.36 0.39 0.44 -3.07 0.00 0.00 178.15 176.83 1mxf h ASP 126 N 1.04 0.99 -0.46 2.19 3.32 -1.99 -0.38 116.42 121.12 1mxf h ASP 126 Ca 0.22 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 1mxf h ASP 126 Cb 0.35 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1mxf h ASP 126 CO -0.00 0.83 -0.02 0.00 -1.72 0.00 0.00 179.24 178.33 1mxf h ALA 127 N 1.20 0.99 -0.14 3.45 0.00 -1.84 -2.18 119.26 120.74 1mxf h ALA 127 Ca 0.27 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1mxf h ALA 127 Cb 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1mxf h ALA 127 CO -0.04 0.62 0.01 1.96 0.00 0.00 0.00 179.25 181.80 1mxf h GLN 128 N 0.82 0.23 0.00 0.00 4.20 -0.57 -1.80 115.11 117.99 1mxf h GLN 128 Ca 0.15 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 1mxf h GLN 128 Cb 0.52 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.27 1mxf h GLN 128 CO 0.03 0.44 -0.11 -0.39 -0.67 0.00 0.00 178.83 178.13 1mxf h VAL 129 N -0.01 0.79 -0.22 -0.54 -1.51 -1.00 0.16 116.25 113.92 1mxf h VAL 129 Ca 0.04 -0.42 -0.20 0.00 -1.23 0.00 0.00 66.70 64.89 1mxf h VAL 129 Cb 0.33 1.25 0.01 0.00 -2.13 0.00 0.00 31.29 30.75 1mxf h VAL 129 CO 0.00 0.11 -0.65 0.00 -1.23 0.00 0.00 177.57 175.80 1mxf h ALA 130 N 1.89 0.37 0.18 5.19 0.00 -1.02 -1.93 119.26 123.94 1mxf h ALA 130 Ca -0.00 -0.55 -0.31 0.00 0.00 0.00 0.00 54.91 54.04 1mxf h ALA 130 Cb 0.24 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.00 1mxf h ALA 130 CO 0.01 0.66 -1.45 1.49 0.00 0.00 0.00 179.25 179.96 1mxf h GLU 131 N 0.57 0.39 -0.10 0.00 4.81 -0.69 0.27 114.58 119.83 1mxf h GLU 131 Ca -0.02 -0.66 -0.06 0.00 -0.13 0.00 0.00 59.36 58.49 1mxf h GLU 131 Cb 1.27 0.25 -0.00 0.00 0.63 0.00 0.00 28.75 30.90 1mxf h GLU 131 CO 0.14 1.30 -0.17 -0.07 -0.73 0.00 0.00 179.01 179.48 1mxf h LEU 132 N 0.11 0.32 -0.42 1.64 3.38 -0.80 -2.79 115.31 116.75 1mxf h LEU 132 Ca -0.23 -0.54 -0.18 0.00 0.09 0.00 0.00 57.88 57.02 1mxf h LEU 132 Cb 2.07 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 42.73 1mxf h LEU 132 CO 0.22 0.80 -0.69 -0.26 0.09 0.00 0.00 178.44 178.60 1mxf h PHE 133 N -0.14 0.61 0.43 1.13 -1.00 -1.50 -2.70 116.94 113.76 1mxf h PHE 133 Ca 0.01 -0.26 -0.02 0.00 2.81 0.00 0.00 57.97 60.51 1mxf h PHE 133 Cb 0.74 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.20 1mxf h PHE 133 CO 0.10 1.01 -0.21 0.78 -1.61 0.00 0.00 178.31 178.38 1mxf h GLY 134 N 1.19 -0.61 1.45 -1.45 0.00 -1.46 -0.44 103.07 101.75 1mxf h GLY 134 Ca -0.02 0.22 -0.15 0.00 0.00 0.00 0.00 47.33 47.38 1mxf h GLY 134 CO 0.12 -0.22 -0.49 1.48 0.00 0.00 0.00 176.54 177.43 1mxf h SER 135 N -0.68 0.64 1.13 0.19 4.64 -1.17 1.01 113.55 119.31 1mxf h SER 135 Ca -0.06 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1mxf h SER 135 Cb 0.50 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1mxf h SER 135 CO 0.10 1.02 -0.87 0.78 -0.87 0.00 0.00 176.83 176.99 1mxf h ASN 136 N 0.46 0.00 0.00 4.97 2.35 -1.54 -3.41 115.58 118.41 1mxf h ASN 136 Ca 0.02 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1mxf h ASN 136 Cb 1.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.39 1mxf h ASN 136 CO 0.09 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.88 1mxf n ALA 137 N -2.17 3.00 0.05 -0.83 0.00 -0.57 -4.48 120.51 115.52 1mxf n ALA 137 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.33 1mxf n ALA 137 Cb 0.55 0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.97 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 0.88 0.09 0.00 2.07 -1.14 -1.26 116.25 116.89 1mxf h VAL 138 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1mxf h VAL 138 Cb 0.00 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 1mxf h VAL 138 CO 0.00 0.00 -0.34 0.00 0.02 0.00 0.00 177.57 177.25 1mxf h ALA 139 N 0.89 -0.57 -0.87 1.67 0.00 0.86 -0.60 119.26 120.64 1mxf h ALA 139 Ca 0.02 -0.05 0.22 0.00 0.00 0.00 0.00 54.91 55.10 1mxf h ALA 139 Cb 0.11 0.57 -0.13 0.00 0.00 0.00 0.00 17.79 18.35 1mxf h ALA 139 CO -0.04 -0.88 0.32 -1.35 0.00 0.00 0.00 179.25 177.29 1mxf h PRO 140 N -0.55 0.30 -0.45 0.00 0.11 -1.69 0.16 132.00 129.89 1mxf h PRO 140 Ca 0.04 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.17 1mxf h PRO 140 Cb 0.59 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.60 1mxf h PRO 140 CO -0.22 0.20 0.21 1.25 -0.21 0.00 0.00 178.00 179.23 1mxf h LEU 141 N 0.31 0.30 -0.64 2.35 5.85 0.06 -0.33 115.31 123.22 1mxf h LEU 141 Ca 0.55 0.03 -0.14 0.00 0.84 0.00 0.00 57.88 59.15 1mxf h LEU 141 Cb 1.06 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1mxf h LEU 141 CO -0.57 0.21 -0.47 -0.26 -0.34 0.00 0.00 178.44 177.01 1mxf h PHE 142 N 0.43 0.62 0.19 1.25 0.04 0.37 -0.92 116.94 118.93 1mxf h PHE 142 Ca 0.20 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1mxf h PHE 142 Cb 0.12 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.14 1mxf h PHE 142 CO -0.11 0.89 -0.09 -0.07 -0.60 0.00 0.00 178.31 178.33 1mxf h LEU 143 N 0.41 -0.22 -0.65 1.54 -0.00 -0.53 0.14 115.31 116.01 1mxf h LEU 143 Ca 0.02 -0.08 0.04 0.00 -0.00 0.00 0.00 57.88 57.86 1mxf h LEU 143 Cb 0.98 0.06 -0.05 0.00 -0.00 0.00 0.00 40.66 41.65 1mxf h LEU 143 CO 0.09 -0.05 0.39 0.40 -0.00 0.00 0.00 178.44 179.26 1mxf h ILE 144 N -0.38 1.03 -0.62 1.22 2.04 -1.02 0.48 117.51 120.26 1mxf h ILE 144 Ca -0.03 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 1mxf h ILE 144 Cb 0.29 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 1mxf h ILE 144 CO 0.04 0.13 0.30 -0.09 0.00 0.00 0.00 178.15 178.53 1mxf h ARG 145 N 0.74 0.90 -0.33 2.37 2.43 -0.99 -0.03 114.38 119.47 1mxf h ARG 145 Ca 0.27 -0.13 -0.10 0.00 -0.81 0.00 0.00 59.98 59.21 1mxf h ARG 145 Cb 0.09 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1mxf h ARG 145 CO -0.14 0.72 -0.19 0.00 -1.51 0.00 0.00 179.97 178.86 1mxf h ALA 146 N 1.13 0.47 -0.29 2.80 0.00 -0.01 -2.29 119.26 121.06 1mxf h ALA 146 Ca 0.21 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1mxf h ALA 146 Cb 0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1mxf h ALA 146 CO -0.03 0.41 0.05 0.35 0.00 0.00 0.00 179.25 180.03 1mxf h PHE 147 N 0.48 0.43 0.22 0.00 3.04 0.24 -2.63 116.94 118.73 1mxf h PHE 147 Ca 0.07 -0.02 -0.34 0.00 3.98 0.00 0.00 57.97 61.66 1mxf h PHE 147 Cb 0.73 -0.13 0.03 0.00 2.56 0.00 0.00 35.95 39.14 1mxf h PHE 147 CO 0.06 0.40 -1.56 0.00 -2.02 0.00 0.00 178.31 175.19 1mxf h ALA 148 N 1.64 -0.04 -0.41 2.41 0.00 -0.94 -3.31 119.26 118.60 1mxf h ALA 148 Ca 0.10 -0.96 -0.05 0.00 0.00 0.00 0.00 54.91 54.00 1mxf h ALA 148 Cb 0.20 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1mxf h ALA 148 CO -0.00 0.83 0.04 0.00 0.00 0.00 0.00 179.25 180.12 1mxf h ARG 149 N 0.13 0.63 -0.14 0.00 3.08 -1.29 -2.76 114.38 114.03 1mxf h ARG 149 Ca -0.28 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.64 1mxf h ARG 149 Cb 2.14 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 32.09 1mxf h ARG 149 CO 0.24 0.62 0.00 0.54 -1.07 0.00 0.00 179.97 180.30 1mxf n ARG 150 N -4.28 1.45 -0.63 0.04 1.74 -1.00 -5.12 116.66 108.86 1mxf n ARG 150 Ca 0.02 -0.68 -0.08 0.00 -0.77 0.00 0.00 57.85 56.34 1mxf n ARG 150 Cb 0.24 -1.27 0.05 0.00 -1.02 0.00 0.00 32.46 30.46 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 -0.04 -0.21 -0.82 5.56 1.13 -1.05 -5.04 117.38 116.92 1mxf n GLN 151 Ca 0.12 -0.59 0.00 0.00 -1.94 0.00 0.00 57.00 54.59 1mxf n GLN 151 Cb 0.20 -0.34 0.00 0.00 0.11 0.00 0.00 30.24 30.21 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 -3.19 -1.43 -4.69 1.08 5.15 -1.26 -5.09 115.26 105.82 1mxf n ASN 161 Ca 0.05 -0.97 -0.40 0.00 -0.60 0.00 0.00 54.58 52.66 1mxf n ASN 161 Cb 0.16 -0.37 -0.05 0.00 -0.53 0.00 0.00 39.78 38.99 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 4.24 0.05 1.20 1.43 -1.26 -4.79 118.68 119.55 1mxf s LEU 162 Ca 0.00 1.01 -0.15 0.00 -1.03 0.00 0.00 54.13 53.96 1mxf s LEU 162 Cb 0.00 -2.97 0.03 0.00 0.03 0.00 0.00 46.19 43.28 1mxf s LEU 162 CO 0.00 -0.18 0.34 -0.94 0.23 0.00 0.00 176.35 175.80 1mxf s SER 163 N 0.94 -0.18 -0.01 2.29 1.04 -0.90 -1.62 113.70 115.26 1mxf s SER 163 Ca 0.33 -0.15 0.08 0.00 0.48 0.00 0.00 55.95 56.69 1mxf s SER 163 Cb -0.17 0.39 -0.02 0.00 0.10 0.00 0.00 66.02 66.32 1mxf s SER 163 CO 0.14 -0.65 -0.26 -0.69 0.98 0.00 0.00 173.24 172.76 1mxf s VAL 164 N -2.62 2.07 -0.19 5.02 1.01 0.18 -2.42 120.40 123.44 1mxf s VAL 164 Ca -0.04 -1.13 -0.01 0.00 0.00 0.00 0.00 61.98 60.80 1mxf s VAL 164 Cb -0.01 -1.72 0.05 0.00 0.00 0.00 0.00 36.38 34.71 1mxf s VAL 164 CO -0.04 0.56 -0.03 -0.69 0.00 0.00 0.00 175.10 174.90 1mxf s VAL 165 N -0.63 1.12 -0.04 2.92 1.01 0.03 -1.23 120.40 123.58 1mxf s VAL 165 Ca 0.10 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.15 1mxf s VAL 165 Cb -0.10 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 1mxf s VAL 165 CO -0.01 -0.02 0.34 0.20 0.00 0.00 0.00 175.10 175.62 1mxf s ASN 166 N 1.61 6.68 -0.35 3.32 0.01 -0.43 -1.09 114.94 124.69 1mxf s ASN 166 Ca -0.02 0.81 -0.21 0.00 -0.71 0.00 0.00 52.86 52.73 1mxf s ASN 166 Cb -0.17 -2.21 0.00 0.00 0.41 0.00 0.00 41.25 39.29 1mxf s ASN 166 CO -0.07 0.32 0.69 -0.76 -1.51 0.00 0.00 177.10 175.76 1mxf s LEU 167 N -0.89 4.20 0.00 0.60 2.01 -0.75 -1.82 118.68 122.03 1mxf s LEU 167 Ca 0.21 0.26 0.00 0.00 0.01 0.00 0.00 54.13 54.61 1mxf s LEU 167 Cb -0.15 -2.88 0.00 0.00 0.01 0.00 0.00 46.19 43.17 1mxf s LEU 167 CO 0.10 -0.63 0.00 0.00 1.01 0.00 0.00 176.35 176.83 1mxf s ASP 169 N -0.79 1.67 0.00 0.00 -1.08 -1.26 -3.98 116.67 111.23 1mxf s ASP 169 Ca 0.00 -0.27 0.00 0.00 -0.52 0.00 0.00 52.55 51.76 1mxf s ASP 169 Cb 0.00 0.04 0.00 0.00 -1.46 0.00 0.00 42.92 41.50 1mxf s ASP 169 CO 0.00 -0.32 0.15 0.00 0.52 0.00 0.00 175.17 175.53 1mxf n ALA 170 N 5.30 1.69 -0.05 3.66 0.00 0.01 -4.66 120.51 126.45 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 0.49 -1.67 0.00 0.00 0.00 0.00 0.00 19.45 18.27 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 1.69 0.00 0.23 0.00 -2.24 -1.26 -4.77 114.28 107.93 1mxf n THR 172 Ca 0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 1mxf n THR 172 Cb 0.04 -0.04 0.15 0.00 -2.10 0.00 0.00 70.33 68.38 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 -2.51 3.42 3.32 -1.99 -3.30 116.42 115.36 1mxf h ASP 173 Ca 0.00 -0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 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 0.00 -0.60 0.18 -1.72 0.00 0.00 179.24 177.10 1mxf n LEU 174 N -2.94 3.39 -4.22 1.55 4.77 -1.26 -5.07 117.00 113.21 1mxf n LEU 174 Ca 0.03 -5.34 -0.59 0.00 -0.03 0.00 0.00 56.01 50.08 1mxf n LEU 174 Cb 0.53 -0.66 -0.09 0.00 -2.33 0.00 0.00 43.42 40.87 1mxf n LEU 174 CO 0.35 1.95 0.91 -2.65 -1.33 0.00 0.00 177.39 176.62 1mxf n PRO 175 N 1.27 0.00 -2.27 3.23 -0.02 -1.25 -4.88 135.00 131.08 1mxf n PRO 175 Ca 0.26 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.32 1mxf n PRO 175 Cb 0.39 -1.35 -0.03 0.00 -0.02 0.00 0.00 33.50 32.50 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 2.04 4.27 -0.06 2.45 2.96 -1.26 -4.93 118.68 124.15 1mxf s LEU 176 Ca 0.91 1.97 -0.35 0.00 -0.22 0.00 0.00 54.13 56.45 1mxf s LEU 176 Cb -1.30 -3.55 -0.13 0.00 0.50 0.00 0.00 46.19 41.72 1mxf s LEU 176 CO 0.68 -0.76 1.80 -2.65 -1.32 0.00 0.00 176.35 174.11 1mxf n PRO 177 N 6.08 2.03 -0.04 0.98 -0.02 -1.26 -2.01 135.00 140.75 1mxf n PRO 177 Ca 0.14 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1mxf n PRO 177 Cb 0.44 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 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 4.16 0.40 1.95 -1.23 0.00 -1.26 -4.95 105.19 104.25 1mxf n GLY 178 Ca 0.22 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 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 2.56 -0.24 1.61 3.01 -0.85 0.96 117.46 122.50 1mxf n PHE 179 Ca 0.00 -2.35 -0.03 0.00 1.01 0.00 0.00 57.45 56.08 1mxf n PHE 179 Cb 0.00 -0.76 0.03 0.00 -0.01 0.00 0.00 39.48 38.74 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 -0.10 1.27 -0.78 0.00 2.07 -1.88 -3.06 116.25 113.77 1mxf h VAL 181 Ca 0.28 -1.00 0.05 0.00 0.82 0.00 0.00 66.70 66.85 1mxf h VAL 181 Cb 0.56 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 31.69 1mxf h VAL 181 CO -0.75 0.32 0.48 0.22 0.02 0.00 0.00 177.57 177.85 1mxf h TYR 182 N 0.23 0.88 0.00 1.57 3.20 -1.74 -1.46 116.97 119.65 1mxf h TYR 182 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1mxf h TYR 182 Cb 0.48 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1mxf h TYR 182 CO 0.04 0.46 0.00 2.41 -1.64 0.00 0.00 178.16 179.43 1mxf n THR 183 N -4.67 0.02 0.00 1.81 -1.04 -0.31 -1.35 114.28 108.74 1mxf n THR 183 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1mxf n THR 183 Cb 0.15 -0.21 0.00 0.00 -1.82 0.00 0.00 70.33 68.45 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 0.67 0.00 -0.17 2.41 0.00 -0.55 -1.71 120.51 121.16 1mxf n ALA 185 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1mxf n ALA 185 Cb 0.01 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.52 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 0.97 -0.76 0.00 1.79 -1.49 -1.06 116.57 116.03 1mxf h LYS 186 Ca 0.00 -0.33 0.03 0.00 -2.18 0.00 0.00 60.65 58.17 1mxf h LYS 186 Cb 0.00 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 30.53 1mxf h LYS 186 CO 0.00 1.00 0.48 0.45 -1.08 0.00 0.00 179.45 180.30 1mxf h HIS 187 N 0.88 0.91 -0.51 -1.35 3.86 -1.59 -0.07 115.15 117.26 1mxf h HIS 187 Ca 0.15 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.34 1mxf h HIS 187 Cb 0.61 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.76 1mxf h HIS 187 CO 0.04 0.53 0.14 0.00 0.86 0.00 0.00 177.93 179.50 1mxf h ALA 188 N 1.31 1.29 -0.60 2.45 0.00 -1.76 -1.36 119.26 120.60 1mxf h ALA 188 Ca 0.30 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1mxf h ALA 188 Cb -0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1mxf h ALA 188 CO -0.10 0.50 0.23 1.25 0.00 0.00 0.00 179.25 181.13 1mxf h LEU 189 N 0.75 0.80 -0.49 0.00 5.85 0.25 -1.17 115.31 121.30 1mxf h LEU 189 Ca 0.17 -0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 1mxf h LEU 189 Cb 0.24 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1mxf h LEU 189 CO -0.01 0.72 0.09 1.23 -0.34 0.00 0.00 178.44 180.14 1mxf h GLY 190 N 0.98 0.87 1.14 3.75 0.00 -0.07 -1.51 103.07 108.23 1mxf h GLY 190 Ca 0.20 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1mxf h GLY 190 CO -0.02 0.54 0.36 -1.33 0.00 0.00 0.00 176.54 176.09 1mxf h GLY 191 N 0.69 1.19 1.02 4.60 0.00 -0.83 -2.52 103.07 107.23 1mxf h GLY 191 Ca 0.15 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1mxf h GLY 191 CO 0.01 0.56 0.38 -2.00 0.00 0.00 0.00 176.54 175.49 1mxf h LEU 192 N 1.10 1.01 -0.50 3.11 5.85 -0.94 0.92 115.31 125.86 1mxf h LEU 192 Ca 0.27 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1mxf h LEU 192 Cb 0.12 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 1mxf h LEU 192 CO -0.03 0.85 0.26 0.74 -0.34 0.00 0.00 178.44 179.92 1mxf h THR 193 N 1.09 0.96 0.02 1.05 2.02 -0.84 0.20 112.91 117.42 1mxf h THR 193 Ca 0.27 -0.17 -0.25 0.00 0.77 0.00 0.00 66.41 67.03 1mxf h THR 193 Cb 0.11 0.42 0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1mxf h THR 193 CO -0.04 0.09 -1.03 0.03 0.37 0.00 0.00 175.52 174.95 1mxf h ARG 194 N 0.50 0.52 0.39 6.66 3.08 -1.32 -1.77 114.38 122.43 1mxf h ARG 194 Ca 0.22 -0.59 -0.02 0.00 0.07 0.00 0.00 59.98 59.66 1mxf h ARG 194 Cb 0.12 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1mxf h ARG 194 CO -0.15 1.21 -0.19 0.00 -1.07 0.00 0.00 179.97 179.78 1mxf h ALA 195 N 0.57 -0.52 -0.53 0.04 0.00 -0.58 -2.63 119.26 115.61 1mxf h ALA 195 Ca -0.11 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1mxf h ALA 195 Cb 1.68 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 19.63 1mxf h ALA 195 CO 0.19 -0.72 0.30 0.00 0.00 0.00 0.00 179.25 179.01 1mxf h ALA 196 N -0.10 0.68 -0.75 0.00 0.00 -0.70 -2.27 119.26 116.11 1mxf h ALA 196 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 54.91 54.98 1mxf h ALA 196 Cb 0.48 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.06 1mxf h ALA 196 CO 0.09 -0.02 0.35 0.00 0.00 0.00 0.00 179.25 179.67 1mxf h ALA 197 N 1.26 1.07 -0.08 0.00 0.00 -1.25 0.62 119.26 120.87 1mxf h ALA 197 Ca 0.22 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 1mxf h ALA 197 Cb 0.07 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1mxf h ALA 197 CO -0.12 -0.11 -0.18 1.25 0.00 0.00 0.00 179.25 180.08 1mxf h LEU 198 N 0.55 0.31 -1.50 0.00 5.85 -1.19 -2.77 115.31 116.56 1mxf h LEU 198 Ca 0.40 -0.57 -0.05 0.00 0.84 0.00 0.00 57.88 58.49 1mxf h LEU 198 Cb 0.52 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1mxf h LEU 198 CO -0.33 0.82 -0.23 -0.33 -0.34 0.00 0.00 178.44 178.03 1mxf h GLU 199 N -0.20 0.00 -0.02 1.25 5.08 -1.06 -3.09 114.58 116.54 1mxf h GLU 199 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1mxf h GLU 199 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1mxf h GLU 199 CO 0.04 0.23 -0.16 1.28 -1.00 0.00 0.00 179.01 179.40 1mxf n LEU 200 N -3.70 2.49 -0.17 1.33 4.32 0.18 -4.40 117.00 117.06 1mxf n LEU 200 Ca -0.01 -0.85 -0.05 0.00 -0.02 0.00 0.00 56.01 55.07 1mxf n LEU 200 Cb 0.34 -0.01 0.04 0.00 -1.62 0.00 0.00 43.42 42.17 1mxf n LEU 200 CO 0.33 0.43 1.05 0.00 -1.22 0.00 0.00 177.39 177.98 1mxf h ALA 201 N 4.38 0.64 0.00 -1.18 0.00 -1.40 -0.62 119.26 121.08 1mxf h ALA 201 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1mxf h ALA 201 Cb 0.86 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1mxf h ALA 201 CO 0.00 -0.03 -0.04 -1.35 0.00 0.00 0.00 179.25 177.83 1mxf h PRO 202 N 0.57 0.00 -0.27 0.00 0.11 -1.79 0.12 132.00 130.75 1mxf h PRO 202 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 1mxf h PRO 202 Cb 0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.16 1mxf h PRO 202 CO -0.11 0.04 0.00 0.54 -0.21 0.00 0.00 178.00 178.27 1mxf n ARG 203 N -3.71 1.82 -2.88 1.05 5.12 -0.31 -4.92 116.66 112.83 1mxf n ARG 203 Ca -0.03 -1.26 -0.21 0.00 -1.93 0.00 0.00 57.85 54.42 1mxf n ARG 203 Cb 0.14 -1.36 0.02 0.00 -1.16 0.00 0.00 32.46 30.10 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 0.49 -1.70 -4.22 -1.55 8.25 0.03 -4.98 115.22 111.55 1mxf n HIS 204 Ca 0.15 0.36 -0.34 0.00 -0.26 0.00 0.00 57.72 57.63 1mxf n HIS 204 Cb 0.34 -4.06 -0.14 0.00 1.12 0.00 0.00 29.99 27.24 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 -3.08 3.08 0.10 1.59 1.01 -0.81 -4.31 121.20 118.79 1mxf s ILE 205 Ca 0.23 -0.61 -0.16 0.00 0.00 0.00 0.00 60.65 60.11 1mxf s ILE 205 Cb -0.10 -2.36 -0.07 0.00 0.01 0.00 0.00 42.46 39.94 1mxf s ILE 205 CO 0.28 0.47 0.54 -0.13 0.00 0.00 0.00 174.94 176.10 1mxf s ARG 206 N 1.08 4.05 -0.17 2.79 0.52 -0.64 -4.12 118.95 122.46 1mxf s ARG 206 Ca 0.00 0.56 -0.01 0.00 -0.52 0.00 0.00 55.73 55.77 1mxf s ARG 206 Cb -0.15 -3.07 0.05 0.00 0.52 0.00 0.00 34.95 32.30 1mxf s ARG 206 CO -0.02 0.56 -0.02 0.08 0.02 0.00 0.00 175.30 175.92 1mxf s VAL 207 N -1.30 0.88 0.25 3.52 1.01 -1.26 0.49 120.40 123.99 1mxf s VAL 207 Ca 0.33 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.78 1mxf s VAL 207 Cb -0.17 -1.16 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 1mxf s VAL 207 CO 0.18 0.03 0.11 0.59 0.00 0.00 0.00 175.10 176.01 1mxf n ASN 208 N 4.94 0.85 -3.79 3.32 3.02 -0.36 0.08 115.26 123.32 1mxf n ASN 208 Ca -0.10 -2.37 -0.12 0.00 -0.03 0.00 0.00 54.58 51.96 1mxf n ASN 208 Cb 0.48 0.72 -0.08 0.00 -0.61 0.00 0.00 39.78 40.28 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 -2.72 -0.60 -0.07 5.41 0.00 -0.33 -1.31 121.76 122.14 1mxf s ALA 209 Ca 0.15 0.03 0.05 0.00 0.00 0.00 0.00 51.96 52.19 1mxf s ALA 209 Cb 0.01 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.32 1mxf s ALA 209 CO 0.11 -0.33 -0.22 0.08 0.00 0.00 0.00 175.76 175.40 1mxf s VAL 210 N -2.01 2.30 -0.35 0.00 1.01 -0.76 0.58 120.40 121.17 1mxf s VAL 210 Ca -0.09 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 60.94 1mxf s VAL 210 Cb -0.03 -1.86 0.10 0.00 0.00 0.00 0.00 36.38 34.59 1mxf s VAL 210 CO -0.00 0.57 0.09 0.00 0.00 0.00 0.00 175.10 175.76 1mxf s ALA 211 N -0.17 2.53 0.78 5.51 0.00 0.10 -0.20 121.76 130.31 1mxf s ALA 211 Ca -0.03 -2.38 -0.11 0.00 0.00 0.00 0.00 51.96 49.44 1mxf s ALA 211 Cb -0.14 -1.89 0.06 0.00 0.00 0.00 0.00 23.12 21.16 1mxf s ALA 211 CO 0.04 -1.74 1.09 -2.14 0.00 0.00 0.00 175.76 173.01 1mxf s PRO 212 N 0.95 2.19 0.00 0.00 0.02 -1.26 -1.43 135.00 135.47 1mxf s PRO 212 Ca 0.12 0.71 0.00 0.00 0.02 0.00 0.00 61.00 61.85 1mxf s PRO 212 Cb -0.20 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.40 1mxf s PRO 212 CO -0.11 -1.56 0.00 0.41 -0.33 0.00 0.00 177.00 175.40 1mxf n GLY 213 N -2.01 -0.14 3.03 0.52 0.00 -1.21 -0.81 105.19 104.56 1mxf n GLY 213 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.15 3.57 0.00 0.99 2.96 -1.26 -4.88 118.68 116.90 1mxf s LEU 214 Ca 0.00 -1.53 0.00 0.00 -0.22 0.00 0.00 54.13 52.38 1mxf s LEU 214 Cb 0.00 -1.49 0.00 0.00 0.50 0.00 0.00 46.19 45.20 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 4.44 0.00 -4.60 3.68 2.88 -1.26 -0.52 113.62 118.24 1mxf n SER 215 Ca -0.10 0.00 -0.57 0.00 -1.33 0.00 0.00 58.87 56.87 1mxf n SER 215 Cb 0.42 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.80 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 2.03 -4.77 2.46 4.77 -1.23 -4.60 117.00 115.67 1mxf n LEU 216 Ca 0.00 0.90 -0.31 0.00 -0.03 0.00 0.00 56.01 56.57 1mxf n LEU 216 Cb 0.00 -1.11 0.10 0.00 -2.33 0.00 0.00 43.42 40.07 1mxf n LEU 216 CO 0.00 -0.57 0.69 -0.76 -1.33 0.00 0.00 177.39 175.43 1mxf s LEU 217 N 4.62 2.82 0.14 2.23 1.43 -1.26 -4.94 118.68 123.71 1mxf s LEU 217 Ca 1.04 1.67 -0.31 0.00 -1.03 0.00 0.00 54.13 55.49 1mxf s LEU 217 Cb -1.12 -4.31 -0.11 0.00 0.03 0.00 0.00 46.19 40.68 1mxf s LEU 217 CO 0.64 -2.09 1.80 -2.84 0.23 0.00 0.00 176.35 174.08 1mxf s PRO 218 N -4.95 4.14 0.49 1.29 0.02 -1.26 -4.87 135.00 129.84 1mxf s PRO 218 Ca 0.61 2.58 0.24 0.00 0.02 0.00 0.00 61.00 64.46 1mxf s PRO 218 Cb -0.17 -3.47 1.29 0.00 0.02 0.00 0.00 34.50 32.17 1mxf s PRO 218 CO 0.56 -0.81 1.90 -1.00 -0.33 0.00 0.00 177.00 177.31 1mxf h PRO 219 N 8.16 0.17 -5.72 5.54 0.13 -2.04 -3.45 132.00 134.80 1mxf h PRO 219 Ca -0.45 -0.01 -0.65 0.00 -0.87 0.00 0.00 66.00 64.01 1mxf h PRO 219 Cb 1.21 -0.04 -0.11 0.00 0.13 0.00 0.00 31.00 32.19 1mxf h PRO 219 CO 0.95 0.11 1.62 0.00 -0.23 0.00 0.00 178.00 180.45 1mxf s ALA 220 N -5.18 3.15 -0.05 -0.56 0.00 -1.26 -5.06 121.76 112.80 1mxf s ALA 220 Ca -0.06 -2.67 0.06 0.00 0.00 0.00 0.00 51.96 49.28 1mxf s ALA 220 Cb 0.22 -4.45 -0.01 0.00 0.00 0.00 0.00 23.12 18.87 1mxf s ALA 220 CO 0.77 -3.33 -0.25 -1.25 0.00 0.00 0.00 175.76 171.70 1mxf s PRO 222 N 4.02 2.50 0.30 0.00 0.04 -1.26 -5.17 135.00 135.42 1mxf s PRO 222 Ca 0.46 -0.90 0.01 0.00 0.04 0.00 0.00 61.00 60.61 1mxf s PRO 222 Cb 0.00 -2.15 0.72 0.00 0.04 0.00 0.00 34.50 33.11 1mxf s PRO 222 CO -0.03 0.41 1.59 1.96 0.04 0.00 0.00 177.00 180.97 1mxf h GLN 223 N 5.97 0.05 -0.68 4.56 4.20 -1.98 0.95 115.11 128.19 1mxf h GLN 223 Ca -0.34 -0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.38 1mxf h GLN 223 Cb 1.17 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.90 1mxf h GLN 223 CO 0.47 0.04 0.45 1.49 -0.67 0.00 0.00 178.83 180.61 1mxf h GLU 224 N 0.06 0.89 -0.11 1.46 4.22 -2.03 0.25 114.58 119.32 1mxf h GLU 224 Ca 0.57 -0.05 -0.02 0.00 0.08 0.00 0.00 59.36 59.94 1mxf h GLU 224 Cb 1.18 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.22 1mxf h GLU 224 CO -0.83 0.59 -0.02 1.15 -2.18 0.00 0.00 179.01 177.71 1mxf h THR 225 N 0.92 1.29 -0.96 0.32 2.02 -1.28 -1.87 112.91 113.35 1mxf h THR 225 Ca 0.25 -0.94 0.12 0.00 0.77 0.00 0.00 66.41 66.60 1mxf h THR 225 Cb -0.11 1.69 -0.08 0.00 -1.74 0.00 0.00 68.15 67.91 1mxf h THR 225 CO -0.05 0.27 0.59 1.56 0.37 0.00 0.00 175.52 178.25 1mxf h GLN 226 N -0.10 0.90 -0.37 6.66 4.20 -0.48 -0.50 115.11 125.41 1mxf h GLN 226 Ca 0.03 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 1mxf h GLN 226 Cb 0.43 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1mxf h GLN 226 CO 0.01 0.60 -0.21 1.49 -0.67 0.00 0.00 178.83 180.04 1mxf h GLU 227 N 0.93 0.73 -0.26 1.46 4.57 -0.33 -1.23 114.58 120.43 1mxf h GLU 227 Ca 0.48 -0.28 -0.06 0.00 -1.18 0.00 0.00 59.36 58.32 1mxf h GLU 227 Cb 0.48 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 1mxf h GLU 227 CO -0.27 0.88 -0.08 0.93 -1.18 0.00 0.00 179.01 179.29 1mxf h GLU 228 N 0.64 0.42 -0.12 1.92 5.08 -0.29 -1.56 114.58 120.67 1mxf h GLU 228 Ca 0.09 -0.10 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1mxf h GLU 228 Cb 0.70 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1mxf h GLU 228 CO 0.05 0.51 -0.34 1.88 -1.00 0.00 0.00 179.01 180.11 1mxf h TYR 229 N 0.40 0.58 -0.74 4.33 -1.99 -0.80 -3.28 116.97 115.48 1mxf h TYR 229 Ca 0.08 -0.23 0.00 0.00 2.00 0.00 0.00 58.73 60.58 1mxf h TYR 229 Cb 0.39 -0.10 -0.04 0.00 2.00 0.00 0.00 36.73 38.98 1mxf h TYR 229 CO 0.01 0.96 0.46 0.00 -0.00 0.00 0.00 178.16 179.59 1mxf h ARG 230 N 0.04 0.99 -0.64 4.88 3.08 -1.00 -2.66 114.38 119.07 1mxf h ARG 230 Ca -0.01 -0.08 0.19 0.00 0.07 0.00 0.00 59.98 60.15 1mxf h ARG 230 Cb 0.96 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.77 1mxf h ARG 230 CO 0.07 0.68 0.53 -0.09 -1.07 0.00 0.00 179.97 180.10 1mxf h ARG 231 N 1.00 0.00 0.00 0.04 9.65 -1.35 -1.36 114.38 122.37 1mxf h ARG 231 Ca 0.27 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.15 1mxf h ARG 231 Cb -0.06 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 1mxf h ARG 231 CO -0.05 0.00 0.00 0.87 2.80 0.00 0.00 179.97 183.59 1mxf h LYS 232 N 0.00 0.00 -6.41 0.20 1.57 -1.58 -3.44 116.57 106.91 1mxf h LYS 232 Ca 0.30 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.52 1mxf h LYS 232 Cb 1.36 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.63 1mxf h LYS 232 CO -0.00 0.00 1.05 0.08 -0.57 0.00 0.00 179.45 180.01 1mxf s VAL 233 N -3.38 3.94 0.22 0.50 1.01 -0.51 -4.85 120.40 117.32 1mxf s VAL 233 Ca 0.05 1.02 -0.10 0.00 0.00 0.00 0.00 61.98 62.95 1mxf s VAL 233 Cb 0.09 -4.08 0.19 0.00 0.00 0.00 0.00 36.38 32.58 1mxf s VAL 233 CO 0.53 -0.56 1.68 -0.65 0.00 0.00 0.00 175.10 176.10 1mxf h PRO 234 N 10.26 0.16 -5.26 2.72 0.11 -1.86 -0.54 132.00 137.61 1mxf h PRO 234 Ca -0.28 -0.01 -0.66 0.00 0.11 0.00 0.00 66.00 65.16 1mxf h PRO 234 Cb 1.11 -0.04 -0.16 0.00 0.11 0.00 0.00 31.00 32.03 1mxf h PRO 234 CO 1.05 0.11 0.77 -1.17 -0.21 0.00 0.00 178.00 178.55 1mxf s LEU 235 N -10.63 4.70 0.00 2.35 2.96 -0.96 -4.32 118.68 112.79 1mxf s LEU 235 Ca -0.13 -1.61 0.00 0.00 -0.22 0.00 0.00 54.13 52.17 1mxf s LEU 235 Cb 0.19 -2.42 0.00 0.00 0.50 0.00 0.00 46.19 44.46 1mxf s LEU 235 CO 0.74 -1.24 0.00 0.61 -1.32 0.00 0.00 176.35 175.14 1mxf n GLY 236 N 5.54 1.76 3.78 7.98 0.00 -1.26 -4.21 105.19 118.78 1mxf n GLY 236 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 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 -4.50 -3.79 1.61 3.00 -0.21 -4.97 117.38 106.52 1mxf n GLN 237 Ca 0.00 0.56 -0.13 0.00 -0.01 0.00 0.00 57.00 57.42 1mxf n GLN 237 Cb 0.00 -5.02 -0.09 0.00 0.00 0.00 0.00 30.24 25.13 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 -4.33 -0.16 0.72 1.08 0.15 -1.23 -4.35 113.70 105.58 1mxf s SER 238 Ca 0.03 0.12 -0.11 0.00 0.70 0.00 0.00 55.95 56.69 1mxf s SER 238 Cb -0.01 0.34 0.02 0.00 -1.71 0.00 0.00 66.02 64.66 1mxf s SER 238 CO 0.83 -0.36 1.07 -1.83 1.20 0.00 0.00 173.24 174.16 1mxf s GLU 239 N -1.03 2.76 0.04 5.44 1.03 -1.26 -4.88 118.70 120.81 1mxf s GLU 239 Ca -0.11 0.80 -0.30 0.00 0.03 0.00 0.00 54.97 55.38 1mxf s GLU 239 Cb -0.05 -1.98 -0.05 0.00 -0.80 0.00 0.00 34.13 31.25 1mxf s GLU 239 CO 0.03 -1.18 1.11 0.00 -1.33 0.00 0.00 175.26 173.89 1mxf s ALA 240 N -3.12 3.30 0.81 -0.84 0.00 0.33 -4.93 121.76 117.30 1mxf s ALA 240 Ca 0.58 0.73 -0.11 0.00 0.00 0.00 0.00 51.96 53.16 1mxf s ALA 240 Cb -0.13 -3.40 0.08 0.00 0.00 0.00 0.00 23.12 19.66 1mxf s ALA 240 CO 0.54 -0.34 1.09 -1.54 0.00 0.00 0.00 175.76 175.51 1mxf s SER 241 N 0.97 4.26 0.33 0.00 1.04 -1.26 -3.48 113.70 115.57 1mxf s SER 241 Ca 0.56 1.56 0.05 0.00 0.48 0.00 0.00 55.95 58.59 1mxf s SER 241 Cb -0.26 -2.28 0.59 0.00 0.10 0.00 0.00 66.02 64.16 1mxf s SER 241 CO 0.29 -2.15 1.84 0.00 0.98 0.00 0.00 173.24 174.20 1mxf h ALA 242 N -1.21 1.33 -0.25 5.32 0.00 -1.95 -2.81 119.26 119.68 1mxf h ALA 242 Ca -0.46 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 1mxf h ALA 242 Cb 1.25 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1mxf h ALA 242 CO 0.55 0.45 0.14 0.00 0.00 0.00 0.00 179.25 180.39 1mxf h ALA 243 N 1.48 0.33 -0.51 0.00 0.00 -1.94 -0.78 119.26 117.84 1mxf h ALA 243 Ca 0.08 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.02 1mxf h ALA 243 Cb 0.43 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1mxf h ALA 243 CO 0.02 -0.14 0.35 1.96 0.00 0.00 0.00 179.25 181.44 1mxf h GLN 244 N 0.30 0.25 0.03 0.00 4.20 -1.87 0.12 115.11 118.14 1mxf h GLN 244 Ca 0.09 -0.02 -0.26 0.00 0.06 0.00 0.00 58.65 58.53 1mxf h GLN 244 Cb 0.07 -0.06 0.02 0.00 0.30 0.00 0.00 27.48 27.82 1mxf h GLN 244 CO -0.01 0.17 -1.03 0.82 -0.67 0.00 0.00 178.83 178.11 1mxf h ILE 245 N 0.26 1.30 -0.12 2.54 1.08 -1.34 -3.16 117.51 118.08 1mxf h ILE 245 Ca 0.24 -2.28 -0.04 0.00 -0.39 0.00 0.00 64.86 62.39 1mxf h ILE 245 Cb 0.59 2.50 -0.01 0.00 -3.07 0.00 0.00 36.82 36.83 1mxf h ILE 245 CO -0.05 0.70 -0.11 0.00 -0.69 0.00 0.00 178.15 177.99 1mxf h ALA 246 N 0.35 1.59 -0.06 1.87 0.00 0.34 -2.58 119.26 120.78 1mxf h ALA 246 Ca -0.14 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1mxf h ALA 246 Cb 1.70 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 1mxf h ALA 246 CO 0.20 0.30 -0.05 -0.44 0.00 0.00 0.00 179.25 179.27 1mxf h ASP 247 N 0.18 -0.14 -0.94 0.00 3.32 -0.81 0.25 116.42 118.29 1mxf h ASP 247 Ca 0.04 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.13 1mxf h ASP 247 Cb 0.32 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.90 1mxf h ASP 247 CO 0.02 -0.06 0.61 0.00 -1.72 0.00 0.00 179.24 178.08 1mxf h ALA 248 N 1.00 1.19 -0.32 3.45 0.00 -1.46 -0.05 119.26 123.07 1mxf h ALA 248 Ca 0.04 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1mxf h ALA 248 Cb 0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1mxf h ALA 248 CO -0.09 0.60 -0.15 0.82 0.00 0.00 0.00 179.25 180.44 1mxf h ILE 249 N 1.28 1.29 -0.93 0.00 2.04 -1.10 -1.88 117.51 118.20 1mxf h ILE 249 Ca 0.34 -1.25 0.02 0.00 1.00 0.00 0.00 64.86 64.97 1mxf h ILE 249 Cb -0.12 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 37.33 1mxf h ILE 249 CO -0.07 0.40 0.61 0.00 0.00 0.00 0.00 178.15 179.10 1mxf h ALA 250 N 0.77 1.37 -0.03 1.87 0.00 -0.07 -1.61 119.26 121.56 1mxf h ALA 250 Ca 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1mxf h ALA 250 Cb 0.67 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1mxf h ALA 250 CO 0.05 0.57 0.01 0.35 0.00 0.00 0.00 179.25 180.23 1mxf h PHE 251 N 1.22 0.05 0.00 0.00 3.57 -0.75 -0.53 116.94 120.49 1mxf h PHE 251 Ca 0.35 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.83 1mxf h PHE 251 Cb -0.07 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.65 1mxf h PHE 251 CO -0.00 0.16 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.05 1mxf h LEU 252 N -0.08 0.00 0.00 0.59 3.38 -0.82 -1.99 115.31 116.39 1mxf h LEU 252 Ca 0.01 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 1mxf h LEU 252 Cb 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1mxf h LEU 252 CO -0.00 0.12 -1.07 -0.37 0.09 0.00 0.00 178.44 177.21 1mxf h VAL 253 N 0.00 1.00 -3.81 1.22 -1.51 -1.12 -3.45 116.25 108.58 1mxf h VAL 253 Ca -0.00 -2.58 -0.48 0.00 -1.23 0.00 0.00 66.70 62.41 1mxf h VAL 253 Cb 0.28 2.44 0.19 0.00 -2.13 0.00 0.00 31.29 32.07 1mxf h VAL 253 CO 0.02 0.57 0.15 -0.94 -1.23 0.00 0.00 177.57 176.13 1mxf s SER 254 N -6.29 2.28 0.12 4.19 1.04 -0.22 -4.89 113.70 109.92 1mxf s SER 254 Ca -0.00 1.73 0.20 0.00 0.48 0.00 0.00 55.95 58.36 1mxf s SER 254 Cb 0.09 -2.36 0.83 0.00 0.10 0.00 0.00 66.02 64.68 1mxf s SER 254 CO 0.80 -3.42 1.63 0.29 0.98 0.00 0.00 173.24 173.51 1mxf n LYS 255 N -4.42 0.10 0.00 4.02 5.02 -1.26 -2.48 118.16 119.14 1mxf n LYS 255 Ca 0.07 0.29 0.10 0.00 -2.02 0.00 0.00 58.31 56.75 1mxf n LYS 255 Cb 0.54 -1.67 0.58 0.00 -0.02 0.00 0.00 35.03 34.46 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 -1.85 0.00 -0.40 4.39 9.92 -1.26 -1.73 116.55 125.62 1mxf n ASP 256 Ca 0.03 -0.57 0.06 0.00 -0.53 0.00 0.00 54.79 53.78 1mxf n ASP 256 Cb 0.23 -0.02 0.09 0.00 -0.64 0.00 0.00 41.12 40.78 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 -1.02 2.33 0.25 2.24 0.00 -1.04 -4.86 120.51 118.41 1mxf n ALA 257 Ca 0.15 -2.11 0.16 0.00 0.00 0.00 0.00 53.44 51.64 1mxf n ALA 257 Cb 0.08 -0.45 0.73 0.00 0.00 0.00 0.00 19.45 19.80 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 0.19 0.00 -1.71 0.00 0.00 -1.47 0.10 103.07 100.18 1mxf h GLY 258 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1mxf h GLY 258 CO 0.01 0.00 0.00 2.98 0.00 0.00 0.00 176.54 179.53 1mxf n TYR 259 N -3.12 0.45 -3.67 5.60 9.36 -1.26 -4.95 117.16 119.57 1mxf n TYR 259 Ca 0.02 -0.33 -0.37 0.00 3.32 0.00 0.00 57.90 60.54 1mxf n TYR 259 Cb 0.53 -0.01 -0.11 0.00 -0.63 0.00 0.00 39.34 39.13 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 -1.13 5.14 -0.15 2.97 1.01 0.35 -5.06 121.20 124.33 1mxf s ILE 260 Ca 0.29 0.11 -0.20 0.00 0.00 0.00 0.00 60.65 60.85 1mxf s ILE 260 Cb 0.17 -3.41 0.05 0.00 0.01 0.00 0.00 42.46 39.27 1mxf s ILE 260 CO 0.23 0.32 0.53 0.28 0.00 0.00 0.00 174.94 176.29 1mxf s THR 261 N 1.36 0.01 0.00 2.92 -1.32 -1.26 -4.71 115.64 112.63 1mxf s THR 261 Ca 0.07 -0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.47 1mxf s THR 261 Cb -0.15 -0.78 0.00 0.00 -1.51 0.00 0.00 72.50 70.07 1mxf s THR 261 CO 0.07 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 1mxf n GLY 262 N 2.23 0.67 3.83 6.08 0.00 0.11 -4.95 105.19 113.16 1mxf n GLY 262 Ca -0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.57 4.73 -0.20 2.61 -4.23 -1.26 -4.73 115.64 109.99 1mxf s THR 263 Ca 0.00 -0.86 -0.02 0.00 -1.18 0.00 0.00 61.69 59.62 1mxf s THR 263 Cb 0.00 -3.37 -0.00 0.00 1.34 0.00 0.00 72.50 70.46 1mxf s THR 263 CO 0.00 -0.02 -0.09 -0.89 -0.54 0.00 0.00 174.62 173.08 1mxf s THR 264 N -1.63 3.00 -0.36 3.99 2.01 -1.26 -1.18 115.64 120.20 1mxf s THR 264 Ca 0.31 -0.62 -0.16 0.00 0.31 0.00 0.00 61.69 61.53 1mxf s THR 264 Cb -0.11 -2.34 -0.00 0.00 0.01 0.00 0.00 72.50 70.06 1mxf s THR 264 CO 0.24 0.46 0.41 -0.22 -0.69 0.00 0.00 174.62 174.83 1mxf s LEU 265 N 1.36 4.50 0.03 4.42 2.96 0.20 -4.93 118.68 127.22 1mxf s LEU 265 Ca 0.05 -0.28 -0.24 0.00 -0.22 0.00 0.00 54.13 53.44 1mxf s LEU 265 Cb -0.14 -2.41 -0.05 0.00 0.50 0.00 0.00 46.19 44.09 1mxf s LEU 265 CO -0.05 -0.42 0.73 -0.75 -1.32 0.00 0.00 176.35 174.53 1mxf s LYS 266 N 2.13 4.45 -0.50 1.98 2.20 -1.26 0.03 119.74 128.77 1mxf s LYS 266 Ca 0.13 0.98 0.05 0.00 -0.36 0.00 0.00 55.97 56.78 1mxf s LYS 266 Cb -0.16 -3.36 0.19 0.00 -1.51 0.00 0.00 37.83 32.99 1mxf s LYS 266 CO 0.12 0.29 0.45 0.28 -0.36 0.00 0.00 175.35 176.14 1mxf n VAL 267 N 2.84 -0.06 -0.40 4.02 0.31 -0.52 -4.89 118.33 119.63 1mxf n VAL 267 Ca -0.03 -4.07 0.00 0.00 -0.01 0.00 0.00 64.34 60.23 1mxf n VAL 267 Cb 0.50 -1.89 0.00 0.00 -0.91 0.00 0.00 33.84 31.55 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 2.16 1.19 -2.66 4.52 5.75 -1.26 -3.34 116.55 122.91 1mxf n ASP 268 Ca 0.26 -1.59 -0.19 0.00 -0.01 0.00 0.00 54.79 53.26 1mxf n ASP 268 Cb 0.45 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 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 -0.29 -0.50 2.93 6.12 0.00 -1.26 -1.70 105.19 110.48 1mxf n GLY 269 Ca 0.00 0.04 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 -1.10 0.72 0.29 -0.02 0.00 -1.26 -2.26 105.19 101.56 1mxf n GLY 270 Ca -0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.94 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 0.25 -1.49 0.99 5.85 -1.66 0.98 115.31 120.23 1mxf h LEU 271 Ca 0.00 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1mxf h LEU 271 Cb 0.05 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1mxf h LEU 271 CO 0.00 0.04 0.00 -0.29 -0.34 0.00 0.00 178.44 177.85 1mxf h ILE 272 N 0.40 0.00 0.00 4.05 2.10 -1.91 -2.16 117.51 119.99 1mxf h ILE 272 Ca 0.48 -0.18 -0.02 0.00 1.08 0.00 0.00 64.86 66.21 1mxf h ILE 272 Cb 0.82 0.95 -0.00 0.00 -1.09 0.00 0.00 36.82 37.49 1mxf h ILE 272 CO -0.48 0.00 -0.48 -0.07 -1.08 0.00 0.00 178.15 176.04 1mxf h LEU 273 N 0.00 0.00 -9.19 2.19 4.07 -1.20 -3.46 115.31 107.72 1mxf h LEU 273 Ca 0.00 0.00 -0.56 0.00 0.08 0.00 0.00 57.88 57.40 1mxf h LEU 273 Cb 0.23 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.97 1mxf h LEU 273 CO 0.00 0.09 1.31 0.00 -1.08 0.00 0.00 178.44 178.76 1mxf s ALA 274 N -3.22 3.24 0.15 1.53 0.00 -0.81 -4.97 121.76 117.68 1mxf s ALA 274 Ca 0.04 1.03 -0.30 0.00 0.00 0.00 0.00 51.96 52.72 1mxf s ALA 274 Cb 0.07 -3.93 -0.07 0.00 0.00 0.00 0.00 23.12 19.19 1mxf s ALA 274 CO 0.73 -2.05 1.15 0.50 0.00 0.00 0.00 175.76 176.09 1mxf s ARG 275 N 5.15 4.52 0.00 0.00 3.52 -1.26 -5.10 118.95 125.78 1mxf s ARG 275 Ca 0.90 1.77 0.17 0.00 -0.13 0.00 0.00 55.73 58.45 1mxf s ARG 275 Cb -0.37 -3.29 1.00 0.00 -1.56 0.00 0.00 34.95 30.73 1mxf s ARG 275 CO 0.38 -0.06 1.41 0.00 -0.81 0.00 0.00 175.30 176.21