#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mxh s PRO 12 N 0.00 3.48 0.02 0.00 0.04 -1.26 -4.81 135.00 132.46 1mxh s PRO 12 Ca 0.00 1.53 0.05 0.00 0.04 0.00 0.00 61.00 62.62 1mxh s PRO 12 Cb 0.00 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1mxh s PRO 12 CO 0.00 -0.73 -0.12 0.00 0.04 0.00 0.00 177.00 176.19 1mxh s ALA 13 N -1.86 2.81 -0.01 8.56 0.00 -1.26 -0.50 121.76 129.51 1mxh s ALA 13 Ca 0.71 -1.10 0.03 0.00 0.00 0.00 0.00 51.96 51.59 1mxh s ALA 13 Cb -0.21 -0.94 -0.01 0.00 0.00 0.00 0.00 23.12 21.96 1mxh s ALA 13 CO 0.25 0.59 -0.09 0.00 0.00 0.00 0.00 175.76 176.52 1mxh s ALA 14 N -0.96 0.75 -0.22 0.00 0.00 0.64 -0.40 121.76 121.57 1mxh s ALA 14 Ca 0.16 -0.40 -0.06 0.00 0.00 0.00 0.00 51.96 51.66 1mxh s ALA 14 Cb -0.11 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 1mxh s ALA 14 CO 0.06 0.18 0.03 0.08 0.00 0.00 0.00 175.76 176.12 1mxh s VAL 15 N -0.23 4.16 -0.31 0.00 1.01 0.62 -0.81 120.40 124.86 1mxh s VAL 15 Ca 0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 61.98 61.77 1mxh s VAL 15 Cb -0.04 -2.91 0.06 0.00 0.00 0.00 0.00 36.38 33.50 1mxh s VAL 15 CO -0.00 0.40 0.00 -0.63 0.00 0.00 0.00 175.10 174.86 1mxh s ILE 16 N 1.18 2.80 0.39 2.22 1.09 -0.90 -0.91 121.20 127.08 1mxh s ILE 16 Ca 0.04 -1.57 -0.25 0.00 -1.10 0.00 0.00 60.65 57.77 1mxh s ILE 16 Cb -0.14 -2.68 -0.09 0.00 -1.06 0.00 0.00 42.46 38.49 1mxh s ILE 16 CO 0.02 -0.18 1.10 0.42 -0.10 0.00 0.00 174.94 176.20 1mxh s THR 17 N 1.19 3.47 -1.47 2.92 -4.23 -0.99 -1.89 115.64 114.63 1mxh s THR 17 Ca -0.03 1.19 -0.11 0.00 -1.18 0.00 0.00 61.69 61.55 1mxh s THR 17 Cb -0.20 -3.65 0.06 0.00 1.34 0.00 0.00 72.50 70.06 1mxh s THR 17 CO -0.03 0.07 1.01 0.61 -0.54 0.00 0.00 174.62 175.75 1mxh n GLY 18 N 0.53 -0.49 0.55 3.99 0.00 -0.61 -2.63 105.19 106.53 1mxh n GLY 18 Ca 0.04 0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.38 1mxh n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mxh n GLY 19 N -1.75 0.24 0.36 -0.02 0.00 0.03 -4.28 105.19 99.77 1mxh n GLY 19 Ca 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.55 1mxh n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mxh h ALA 20 N 4.18 1.16 -2.69 4.61 0.00 -1.86 -2.63 119.26 122.03 1mxh h ALA 20 Ca 0.00 -0.12 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 1mxh h ALA 20 Cb 0.51 -0.36 -0.14 0.00 0.00 0.00 0.00 17.79 17.80 1mxh h ALA 20 CO 0.00 0.65 -0.56 1.03 0.00 0.00 0.00 179.25 180.38 1mxh s ARG 21 N -5.88 1.38 4.37 0.00 0.52 -1.26 -4.39 118.95 113.68 1mxh s ARG 21 Ca -0.13 -1.72 0.00 0.00 -0.52 0.00 0.00 55.73 53.36 1mxh s ARG 21 Cb 0.17 0.30 0.00 0.00 0.52 0.00 0.00 34.95 35.94 1mxh s ARG 21 CO 0.83 -0.48 0.00 0.54 0.02 0.00 0.00 175.30 176.21 1mxh n ARG 22 N -0.38 0.00 0.00 3.54 1.74 -1.26 -2.39 116.66 117.91 1mxh n ARG 22 Ca 0.03 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.02 1mxh n ARG 22 Cb 0.65 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.06 1mxh n ARG 22 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1mxh h ILE 23 N 0.00 0.61 -0.87 0.55 2.04 -1.92 -1.56 117.51 116.36 1mxh h ILE 23 Ca 0.00 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.99 1mxh h ILE 23 Cb 0.00 0.61 -0.07 0.00 -0.74 0.00 0.00 36.82 36.62 1mxh h ILE 23 CO 0.00 0.00 0.56 1.23 0.00 0.00 0.00 178.15 179.94 1mxh h GLY 24 N -0.18 1.16 1.03 5.37 0.00 -1.72 -0.45 103.07 108.27 1mxh h GLY 24 Ca 0.09 -0.30 -0.10 0.00 0.00 0.00 0.00 47.33 47.02 1mxh h GLY 24 CO -0.23 0.11 -0.10 0.84 0.00 0.00 0.00 176.54 177.16 1mxh h HIS 25 N 0.69 1.00 -0.14 5.60 -0.00 -0.99 -1.69 115.15 119.63 1mxh h HIS 25 Ca 0.43 -0.21 -0.09 0.00 -0.00 0.00 0.00 60.37 60.50 1mxh h HIS 25 Cb 0.67 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.82 1mxh h HIS 25 CO -0.00 0.97 -0.33 1.03 -0.00 0.00 0.00 177.93 179.60 1mxh h SER 26 N 0.74 0.28 0.07 3.26 0.87 -0.19 -1.79 113.55 116.80 1mxh h SER 26 Ca 0.12 -0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1mxh h SER 26 Cb 0.64 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 1mxh h SER 26 CO 0.04 0.60 -0.03 0.40 -0.53 0.00 0.00 176.83 177.31 1mxh h ILE 27 N 0.24 1.20 -0.50 2.23 2.04 -1.03 -1.00 117.51 120.68 1mxh h ILE 27 Ca 0.03 -1.06 0.10 0.00 1.00 0.00 0.00 64.86 64.93 1mxh h ILE 27 Cb 0.71 1.88 -0.10 0.00 -0.74 0.00 0.00 36.82 38.56 1mxh h ILE 27 CO 0.05 0.26 -0.21 0.00 0.00 0.00 0.00 178.15 178.25 1mxh h ALA 28 N 0.27 0.16 -0.49 1.87 0.00 -1.17 0.17 119.26 120.08 1mxh h ALA 28 Ca -0.01 0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1mxh h ALA 28 Cb 0.50 0.54 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1mxh h ALA 28 CO 0.02 -0.55 0.12 0.28 0.00 0.00 0.00 179.25 179.13 1mxh h VAL 29 N -0.10 1.24 -0.37 0.00 2.07 -1.35 -1.09 116.25 116.65 1mxh h VAL 29 Ca 0.23 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1mxh h VAL 29 Cb 0.47 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1mxh h VAL 29 CO -0.57 0.30 0.24 -0.09 0.02 0.00 0.00 177.57 177.48 1mxh h ARG 30 N 0.67 0.49 -0.28 1.57 9.65 -0.02 0.17 114.38 126.64 1mxh h ARG 30 Ca 0.15 -0.03 -0.11 0.00 -1.10 0.00 0.00 59.98 58.89 1mxh h ARG 30 Cb 0.32 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 1mxh h ARG 30 CO 0.00 0.33 -0.30 -0.07 2.80 0.00 0.00 179.97 182.73 1mxh h LEU 31 N 0.50 0.58 -0.49 3.80 3.38 -0.62 -2.46 115.31 120.00 1mxh h LEU 31 Ca 0.14 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1mxh h LEU 31 Cb -0.05 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1mxh h LEU 31 CO -0.03 0.85 0.14 -0.74 0.09 0.00 0.00 178.44 178.76 1mxh h HIS 32 N 0.49 0.81 0.00 1.13 2.76 -0.75 -0.55 115.15 119.04 1mxh h HIS 32 Ca 0.06 -0.09 -0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1mxh h HIS 32 Cb 0.76 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 29.49 1mxh h HIS 32 CO 0.03 0.71 -0.02 1.96 -1.30 0.00 0.00 177.93 179.31 1mxh h GLN 33 N 0.67 0.00 -0.34 5.26 4.20 -0.36 -0.60 115.11 123.94 1mxh h GLN 33 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1mxh h GLN 33 Cb 0.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1mxh h GLN 33 CO -0.00 0.02 0.00 1.04 -0.67 0.00 0.00 178.83 179.22 1mxh n GLN 34 N -3.28 2.04 0.00 1.46 6.02 -0.69 -4.91 117.38 118.02 1mxh n GLN 34 Ca -0.02 -1.59 0.00 0.00 -0.01 0.00 0.00 57.00 55.38 1mxh n GLN 34 Cb 0.14 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 29.99 1mxh n GLN 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1mxh n GLY 35 N 1.26 0.78 3.79 1.08 0.00 -0.23 -5.08 105.19 106.79 1mxh n GLY 35 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1mxh n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mxh s PHE 36 N -2.00 3.75 -0.16 1.61 0.08 -0.30 -4.42 117.98 116.54 1mxh s PHE 36 Ca 0.00 1.64 -0.18 0.00 0.12 0.00 0.00 56.93 58.51 1mxh s PHE 36 Cb 0.00 -2.80 -0.04 0.00 -0.57 0.00 0.00 43.02 39.62 1mxh s PHE 36 CO 0.00 0.33 0.48 1.03 -0.10 0.00 0.00 175.22 176.97 1mxh s ARG 37 N -1.77 4.26 0.15 0.44 0.52 0.35 -4.19 118.95 118.70 1mxh s ARG 37 Ca 0.44 0.40 0.09 0.00 -0.52 0.00 0.00 55.73 56.14 1mxh s ARG 37 Cb -0.19 -3.50 -0.04 0.00 0.52 0.00 0.00 34.95 31.73 1mxh s ARG 37 CO 0.24 0.01 -0.15 0.14 0.02 0.00 0.00 175.30 175.56 1mxh s VAL 38 N 1.12 2.96 -0.40 3.52 -7.23 -0.47 -0.26 120.40 119.64 1mxh s VAL 38 Ca 0.24 -1.63 -0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1mxh s VAL 38 Cb -0.15 -2.42 0.11 0.00 0.56 0.00 0.00 36.38 34.48 1mxh s VAL 38 CO 0.10 -0.02 0.20 -0.69 -0.31 0.00 0.00 175.10 174.37 1mxh s VAL 39 N -1.46 3.32 -0.55 1.32 1.01 0.01 -1.75 120.40 122.30 1mxh s VAL 39 Ca 0.22 -2.00 -0.28 0.00 0.00 0.00 0.00 61.98 59.92 1mxh s VAL 39 Cb -0.09 -3.25 0.03 0.00 0.00 0.00 0.00 36.38 33.07 1mxh s VAL 39 CO 0.12 -0.66 1.15 -0.69 0.00 0.00 0.00 175.10 175.03 1mxh s VAL 40 N 1.16 4.11 0.06 2.92 1.01 0.13 -2.12 120.40 127.67 1mxh s VAL 40 Ca 0.07 0.93 -0.08 0.00 0.00 0.00 0.00 61.98 62.91 1mxh s VAL 40 Cb -0.23 -4.67 -0.05 0.00 0.00 0.00 0.00 36.38 31.43 1mxh s VAL 40 CO -0.04 -1.23 0.34 -2.28 0.00 0.00 0.00 175.10 171.90 1mxh s HIS 41 N 4.72 3.57 0.32 5.22 5.04 -0.79 -0.97 115.29 132.39 1mxh s HIS 41 Ca 0.43 0.66 -0.05 0.00 -1.54 0.00 0.00 55.06 54.57 1mxh s HIS 41 Cb -0.08 -2.06 0.00 0.00 0.04 0.00 0.00 32.58 30.48 1mxh s HIS 41 CO 0.27 0.55 0.47 1.52 -2.34 0.00 0.00 174.74 175.21 1mxh s TYR 42 N -1.39 0.91 0.00 3.88 1.13 -0.42 -0.79 117.35 120.68 1mxh s TYR 42 Ca 0.32 -1.18 0.00 0.00 -1.41 0.00 0.00 57.07 54.80 1mxh s TYR 42 Cb -0.13 -0.02 0.00 0.00 -1.10 0.00 0.00 41.96 40.70 1mxh s TYR 42 CO 0.18 -1.10 0.00 -2.13 -2.51 0.00 0.00 175.55 169.99 1mxh n ARG 43 N -0.52 0.00 0.00 -3.49 0.63 -1.26 -2.15 116.66 109.88 1mxh n ARG 43 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1mxh n ARG 43 Cb 0.62 -0.36 0.00 0.00 0.45 0.00 0.00 32.46 33.17 1mxh n ARG 43 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1mxh n HIS 44 N -2.87 0.00 -1.99 -0.14 8.25 -1.26 -4.79 115.22 112.41 1mxh n HIS 44 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 1mxh n HIS 44 Cb 0.35 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.45 1mxh n HIS 44 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1mxh n SER 45 N -1.10 7.47 -0.14 0.41 7.64 -1.26 -4.70 113.62 121.94 1mxh n SER 45 Ca 0.00 -3.34 -0.04 0.00 1.01 0.00 0.00 58.87 56.50 1mxh n SER 45 Cb 0.00 -1.26 0.05 0.00 -1.01 0.00 0.00 64.21 61.98 1mxh n SER 45 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1mxh h GLU 46 N 3.97 0.24 -0.53 1.43 4.22 -1.97 -0.55 114.58 121.39 1mxh h GLU 46 Ca 0.58 -0.01 0.03 0.00 0.08 0.00 0.00 59.36 60.04 1mxh h GLU 46 Cb 0.38 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 1mxh h GLU 46 CO 1.26 0.16 0.31 0.78 -2.18 0.00 0.00 179.01 179.34 1mxh h GLY 47 N 0.25 0.75 1.06 1.92 0.00 -1.99 0.15 103.07 105.21 1mxh h GLY 47 Ca 0.21 -0.23 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 1mxh h GLY 47 CO -0.26 0.18 0.02 0.00 0.00 0.00 0.00 176.54 176.47 1mxh h ALA 48 N 1.25 0.78 -0.04 3.60 0.00 -1.79 -1.62 119.26 121.44 1mxh h ALA 48 Ca 0.22 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1mxh h ALA 48 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1mxh h ALA 48 CO -0.11 0.61 -0.03 0.00 0.00 0.00 0.00 179.25 179.72 1mxh h ALA 49 N 0.98 0.01 -0.90 0.00 0.00 -0.57 -1.94 119.26 116.84 1mxh h ALA 49 Ca 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1mxh h ALA 49 Cb 0.53 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1mxh h ALA 49 CO 0.03 -0.51 0.53 0.37 0.00 0.00 0.00 179.25 179.67 1mxh h GLN 50 N -0.03 1.24 -0.08 0.00 4.15 -0.59 0.21 115.11 120.01 1mxh h GLN 50 Ca 0.03 -0.12 -0.05 0.00 0.77 0.00 0.00 58.65 59.28 1mxh h GLN 50 Cb 0.07 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 1mxh h GLN 50 CO -0.06 0.88 -0.18 0.00 -1.93 0.00 0.00 178.83 177.53 1mxh h ARG 51 N 1.25 0.12 0.06 1.69 3.08 -1.04 -0.75 114.38 118.80 1mxh h ARG 51 Ca 0.32 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.34 1mxh h ARG 51 Cb -0.03 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1mxh h ARG 51 CO -0.06 0.31 -0.03 1.25 -1.07 0.00 0.00 179.97 180.37 1mxh h LEU 52 N 0.12 -0.07 -1.56 3.04 5.85 -0.58 -2.45 115.31 119.65 1mxh h LEU 52 Ca 0.02 -0.48 0.12 0.00 0.84 0.00 0.00 57.88 58.38 1mxh h LEU 52 Cb 0.39 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1mxh h LEU 52 CO 0.03 0.62 0.47 0.58 -0.34 0.00 0.00 178.44 179.79 1mxh h VAL 53 N -0.94 0.85 -0.17 1.05 2.07 -0.95 -0.11 116.25 118.05 1mxh h VAL 53 Ca -0.01 -0.16 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 1mxh h VAL 53 Cb 0.55 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1mxh h VAL 53 CO 0.01 0.08 -0.09 0.00 0.02 0.00 0.00 177.57 177.60 1mxh h ALA 54 N 1.66 0.25 -0.74 1.67 0.00 -1.20 -2.24 119.26 118.64 1mxh h ALA 54 Ca 0.34 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1mxh h ALA 54 Cb 0.68 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1mxh h ALA 54 CO -0.11 0.07 0.39 1.49 0.00 0.00 0.00 179.25 181.09 1mxh h GLU 55 N 0.05 1.05 -0.27 0.00 4.81 -0.65 -2.23 114.58 117.33 1mxh h GLU 55 Ca 0.04 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 1mxh h GLU 55 Cb 0.57 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1mxh h GLU 55 CO 0.03 0.79 -0.01 -0.07 -0.73 0.00 0.00 179.01 179.02 1mxh h LEU 56 N 1.03 0.47 -2.05 1.64 3.38 -1.07 -2.73 115.31 115.98 1mxh h LEU 56 Ca 0.26 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1mxh h LEU 56 Cb 0.06 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1mxh h LEU 56 CO -0.04 0.67 -0.01 0.78 0.09 0.00 0.00 178.44 179.94 1mxh h ASN 57 N 0.26 0.00 1.52 -0.43 -0.26 -1.30 -1.24 115.58 114.13 1mxh h ASN 57 Ca 0.08 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.78 1mxh h ASN 57 Cb 0.43 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.69 1mxh h ASN 57 CO 0.02 0.01 -0.19 0.00 -1.06 0.00 0.00 177.43 176.20 1mxh h ALA 58 N 1.99 0.91 0.00 -0.83 0.00 -1.09 -2.82 119.26 117.42 1mxh h ALA 58 Ca -0.00 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1mxh h ALA 58 Cb 0.32 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1mxh h ALA 58 CO 0.00 0.24 -1.57 0.00 0.00 0.00 0.00 179.25 177.92 1mxh n ALA 59 N -2.16 2.02 -3.21 0.00 0.00 -0.56 -4.84 120.51 111.77 1mxh n ALA 59 Ca 0.02 -0.62 0.01 0.00 0.00 0.00 0.00 53.44 52.86 1mxh n ALA 59 Cb 0.54 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 1mxh n ALA 59 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1mxh s ARG 60 N -2.97 0.52 0.20 0.00 0.52 -0.69 -5.13 118.95 111.41 1mxh s ARG 60 Ca -0.04 0.92 -0.32 0.00 -0.52 0.00 0.00 55.73 55.77 1mxh s ARG 60 Cb 0.09 0.35 -0.14 0.00 0.52 0.00 0.00 34.95 35.77 1mxh s ARG 60 CO 0.82 -0.61 1.41 0.00 0.02 0.00 0.00 175.30 176.94 1mxh n ALA 61 N 5.42 0.76 -2.09 2.13 0.00 -1.07 -2.27 120.51 123.38 1mxh n ALA 61 Ca -0.02 0.44 -0.19 0.00 0.00 0.00 0.00 53.44 53.67 1mxh n ALA 61 Cb 0.51 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 1mxh n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mxh n GLY 62 N 2.47 0.33 1.03 0.00 0.00 -1.26 -4.89 105.19 102.86 1mxh n GLY 62 Ca 0.14 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.18 1mxh n GLY 62 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mxh n SER 63 N -1.43 3.10 -3.68 1.61 3.41 -0.96 -4.94 113.62 110.73 1mxh n SER 63 Ca -0.21 -1.95 -0.13 0.00 -0.26 0.00 0.00 58.87 56.32 1mxh n SER 63 Cb 0.65 -0.19 -0.09 0.00 -0.26 0.00 0.00 64.21 64.33 1mxh n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mxh s ALA 64 N -1.62 -1.40 0.04 7.33 0.00 -1.26 -1.37 121.76 123.48 1mxh s ALA 64 Ca 0.36 1.61 0.01 0.00 0.00 0.00 0.00 51.96 53.94 1mxh s ALA 64 Cb 0.22 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 1mxh s ALA 64 CO 0.31 -0.27 -0.05 0.54 0.00 0.00 0.00 175.76 176.29 1mxh s VAL 65 N 0.35 0.31 0.28 0.00 0.11 -0.72 -4.87 120.40 115.86 1mxh s VAL 65 Ca -0.00 -1.27 0.08 0.00 -2.93 0.00 0.00 61.98 57.85 1mxh s VAL 65 Cb -0.04 -0.79 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 1mxh s VAL 65 CO -0.00 -0.62 0.18 -1.48 -3.33 0.00 0.00 175.10 169.84 1mxh s LEU 66 N -2.00 3.62 -0.14 2.54 2.34 -1.26 -0.69 118.68 123.09 1mxh s LEU 66 Ca -0.06 -0.41 -0.08 0.00 0.06 0.00 0.00 54.13 53.65 1mxh s LEU 66 Cb -0.04 -2.17 0.05 0.00 -0.56 0.00 0.00 46.19 43.47 1mxh s LEU 66 CO -0.03 -0.11 0.34 0.00 -1.06 0.00 0.00 176.35 175.49 1mxh s LYS 68 N 1.32 2.98 0.00 0.00 2.20 -1.26 -1.30 119.74 123.68 1mxh s LYS 68 Ca -0.09 -0.49 0.00 0.00 -0.36 0.00 0.00 55.97 55.03 1mxh s LYS 68 Cb -0.09 -2.80 0.00 0.00 -1.51 0.00 0.00 37.83 33.43 1mxh s LYS 68 CO -0.11 0.66 0.00 0.41 -0.36 0.00 0.00 175.35 175.95 1mxh n GLY 69 N 1.48 1.40 3.73 5.54 0.00 -0.91 -4.97 105.19 111.47 1mxh n GLY 69 Ca -0.15 0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 1mxh n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mxh s ASP 70 N 0.00 6.72 0.00 1.61 2.15 -1.26 -4.48 116.67 121.41 1mxh s ASP 70 Ca 0.00 0.86 0.23 0.00 0.43 0.00 0.00 52.55 54.06 1mxh s ASP 70 Cb 0.00 -2.29 0.53 0.00 -0.30 0.00 0.00 42.92 40.85 1mxh s ASP 70 CO 0.00 0.03 1.46 0.18 -0.17 0.00 0.00 175.17 176.67 1mxh n LEU 71 N 3.48 3.52 -4.75 -1.34 4.77 -1.26 -4.85 117.00 116.56 1mxh n LEU 71 Ca -0.07 -1.62 -0.31 0.00 -0.03 0.00 0.00 56.01 53.97 1mxh n LEU 71 Cb 0.52 -0.34 0.10 0.00 -2.33 0.00 0.00 43.42 41.37 1mxh n LEU 71 CO 0.43 0.81 0.69 -0.44 -1.33 0.00 0.00 177.39 177.55 1mxh s SER 72 N -1.29 4.25 0.22 -1.43 0.01 -1.26 -2.28 113.70 111.92 1mxh s SER 72 Ca 0.42 1.81 -0.30 0.00 1.31 0.00 0.00 55.95 59.19 1mxh s SER 72 Cb 0.23 -2.49 -0.10 0.00 0.21 0.00 0.00 66.02 63.88 1mxh s SER 72 CO 0.32 -2.19 1.41 -0.76 0.41 0.00 0.00 173.24 172.42 1mxh s LEU 73 N -6.01 4.39 0.02 2.44 1.43 0.11 -4.68 118.68 116.37 1mxh s LEU 73 Ca 0.62 2.56 -0.29 0.00 -1.03 0.00 0.00 54.13 55.99 1mxh s LEU 73 Cb -0.18 -3.61 0.11 0.00 0.03 0.00 0.00 46.19 42.54 1mxh s LEU 73 CO 0.56 -0.66 1.23 -0.94 0.23 0.00 0.00 176.35 176.78 1mxh s SER 74 N 0.48 -0.06 0.32 2.29 1.04 -1.26 -4.84 113.70 111.66 1mxh s SER 74 Ca 0.60 -0.20 0.25 0.00 0.48 0.00 0.00 55.95 57.08 1mxh s SER 74 Cb -0.40 0.22 1.10 0.00 0.10 0.00 0.00 66.02 67.04 1mxh s SER 74 CO 0.40 -0.41 1.76 0.77 0.98 0.00 0.00 173.24 176.74 1mxh h SER 75 N 2.00 0.00 0.02 7.02 4.64 -2.04 -2.84 113.55 122.35 1mxh h SER 75 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1mxh h SER 75 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1mxh h SER 75 CO 0.29 0.00 -0.57 -1.20 -0.87 0.00 0.00 176.83 174.48 1mxh n SER 76 N -2.38 1.72 0.03 4.97 7.64 -1.26 -4.60 113.62 119.74 1mxh n SER 76 Ca 0.01 -1.34 -0.10 0.00 1.01 0.00 0.00 58.87 58.45 1mxh n SER 76 Cb 0.21 0.56 -0.05 0.00 -1.01 0.00 0.00 64.21 63.92 1mxh n SER 76 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1mxh h LEU 77 N 1.81 -0.26 -0.45 -3.43 5.85 -1.77 -0.93 115.31 116.11 1mxh h LEU 77 Ca 0.00 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.85 1mxh h LEU 77 Cb 0.68 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.76 1mxh h LEU 77 CO 0.00 -0.12 0.02 0.25 -0.34 0.00 0.00 178.44 178.24 1mxh h LEU 78 N -0.13 -0.15 -0.45 2.25 6.46 -1.81 0.26 115.31 121.74 1mxh h LEU 78 Ca 0.05 0.10 -0.14 0.00 -0.12 0.00 0.00 57.88 57.77 1mxh h LEU 78 Cb 0.20 0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 1mxh h LEU 78 CO -0.13 -0.04 -0.26 0.44 -0.62 0.00 0.00 178.44 177.83 1mxh h ASP 79 N 0.13 1.01 -0.66 1.25 3.32 -1.83 -2.37 116.42 117.28 1mxh h ASP 79 Ca 0.23 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1mxh h ASP 79 Cb 0.32 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1mxh h ASP 79 CO -0.36 1.21 0.42 0.00 -1.72 0.00 0.00 179.24 178.79 1mxh h GLU 82 N 0.84 0.91 -0.14 0.00 4.39 -0.79 -2.52 114.58 117.27 1mxh h GLU 82 Ca 0.17 -0.07 -0.10 0.00 0.34 0.00 0.00 59.36 59.70 1mxh h GLU 82 Cb 0.40 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1mxh h GLU 82 CO 0.01 0.64 -0.35 -0.44 -1.16 0.00 0.00 179.01 177.71 1mxh h ASP 83 N 0.92 0.29 -0.54 1.42 3.32 -0.50 0.17 116.42 121.50 1mxh h ASP 83 Ca 0.25 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 57.13 1mxh h ASP 83 Cb -0.05 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1mxh h ASP 83 CO -0.05 0.63 0.10 0.40 -1.72 0.00 0.00 179.24 178.60 1mxh h ILE 84 N 0.25 1.25 -0.13 0.35 2.04 -0.88 0.19 117.51 120.58 1mxh h ILE 84 Ca 0.03 -0.93 -0.12 0.00 1.00 0.00 0.00 64.86 64.83 1mxh h ILE 84 Cb 0.74 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1mxh h ILE 84 CO 0.06 0.34 -0.40 0.40 0.00 0.00 0.00 178.15 178.54 1mxh h ILE 85 N 0.78 1.37 -0.04 -0.67 1.08 -1.31 -2.81 117.51 115.90 1mxh h ILE 85 Ca 0.17 -1.71 0.01 0.00 -0.39 0.00 0.00 64.86 62.94 1mxh h ILE 85 Cb 0.39 2.11 -0.00 0.00 -3.07 0.00 0.00 36.82 36.24 1mxh h ILE 85 CO 0.01 0.51 0.09 -0.78 -0.69 0.00 0.00 178.15 177.29 1mxh h ASP 86 N 0.10 0.00 -0.26 1.72 1.82 -0.43 -0.72 116.42 118.66 1mxh h ASP 86 Ca -0.02 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.49 1mxh h ASP 86 Cb 1.03 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.03 1mxh h ASP 86 CO 0.09 0.00 -0.33 0.00 -1.61 0.00 0.00 179.24 177.39 1mxh h SER 88 N 0.65 0.66 0.24 0.00 0.87 -1.15 -2.38 113.55 112.44 1mxh h SER 88 Ca 0.07 -0.23 -0.08 0.00 -1.23 0.00 0.00 61.79 60.32 1mxh h SER 88 Cb 0.87 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.64 1mxh h SER 88 CO 0.08 0.73 -0.32 -0.26 -0.53 0.00 0.00 176.83 176.53 1mxh h PHE 89 N 0.57 0.13 -0.07 2.24 0.04 -1.47 0.14 116.94 118.53 1mxh h PHE 89 Ca 0.14 -0.03 -0.23 0.00 2.80 0.00 0.00 57.97 60.65 1mxh h PHE 89 Cb 0.32 -0.03 0.02 0.00 2.20 0.00 0.00 35.95 38.45 1mxh h PHE 89 CO 0.02 0.43 -0.85 0.00 -0.60 0.00 0.00 178.31 177.30 1mxh h ARG 90 N 0.11 0.70 0.24 1.51 3.08 -1.25 0.21 114.38 118.97 1mxh h ARG 90 Ca 0.01 -0.66 -0.32 0.00 0.07 0.00 0.00 59.98 59.08 1mxh h ARG 90 Cb 0.62 0.17 0.04 0.00 0.08 0.00 0.00 29.97 30.87 1mxh h ARG 90 CO 0.04 1.26 -1.41 0.00 -1.07 0.00 0.00 179.97 178.80 1mxh h ALA 91 N 0.45 -0.15 -0.00 0.04 0.00 -1.34 -3.40 119.26 114.87 1mxh h ALA 91 Ca -0.09 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 53.98 1mxh h ALA 91 Cb 1.50 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1mxh h ALA 91 CO 0.17 0.66 -0.02 1.19 0.00 0.00 0.00 179.25 181.25 1mxh n PHE 92 N -3.77 0.00 -1.11 0.00 3.72 0.49 -5.00 117.46 111.79 1mxh n PHE 92 Ca -0.16 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.20 1mxh n PHE 92 Cb 1.07 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.60 1mxh n PHE 92 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1mxh n GLY 93 N 0.56 0.60 3.60 1.37 0.00 0.74 -4.95 105.19 107.10 1mxh n GLY 93 Ca 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 1mxh n GLY 93 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1mxh s ARG 94 N -1.65 0.81 -0.25 1.61 1.70 -1.25 -4.90 118.95 115.01 1mxh s ARG 94 Ca 0.00 -0.37 -0.02 0.00 -0.47 0.00 0.00 55.73 54.87 1mxh s ARG 94 Cb 0.00 0.33 0.13 0.00 -0.57 0.00 0.00 34.95 34.83 1mxh s ARG 94 CO 0.00 -0.36 0.32 0.00 -1.08 0.00 0.00 175.30 174.17 1mxh n ASP 96 N 5.34 0.53 -4.04 0.00 9.92 0.46 -4.95 116.55 123.81 1mxh n ASP 96 Ca -0.03 0.08 -0.22 0.00 -0.53 0.00 0.00 54.79 54.08 1mxh n ASP 96 Cb 0.49 0.52 -0.16 0.00 -0.64 0.00 0.00 41.12 41.33 1mxh n ASP 96 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1mxh s VAL 97 N -2.52 0.98 -0.13 2.53 1.01 -0.58 -2.30 120.40 119.39 1mxh s VAL 97 Ca -0.13 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.40 1mxh s VAL 97 Cb 0.07 -0.86 0.02 0.00 0.00 0.00 0.00 36.38 35.60 1mxh s VAL 97 CO 0.80 0.30 -0.17 -0.22 0.00 0.00 0.00 175.10 175.80 1mxh s LEU 98 N 0.14 1.82 -0.32 3.92 2.96 -0.98 -0.27 118.68 125.95 1mxh s LEU 98 Ca -0.03 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.40 1mxh s LEU 98 Cb -0.09 -1.21 0.08 0.00 0.50 0.00 0.00 46.19 45.46 1mxh s LEU 98 CO 0.01 0.01 0.02 -0.69 -1.32 0.00 0.00 176.35 174.38 1mxh s VAL 99 N 1.08 2.61 -1.07 1.68 1.01 -0.08 -0.72 120.40 124.92 1mxh s VAL 99 Ca -0.03 -1.83 -0.20 0.00 0.00 0.00 0.00 61.98 59.92 1mxh s VAL 99 Cb -0.14 -2.67 0.09 0.00 0.00 0.00 0.00 36.38 33.65 1mxh s VAL 99 CO -0.04 -0.31 1.42 0.20 0.00 0.00 0.00 175.10 176.36 1mxh s ASN 100 N 1.21 6.65 -0.10 3.32 0.02 -0.23 -2.36 114.94 123.45 1mxh s ASN 100 Ca 0.00 -1.93 0.12 0.00 -1.02 0.00 0.00 52.86 50.03 1mxh s ASN 100 Cb -0.20 -2.51 -0.17 0.00 0.02 0.00 0.00 41.25 38.39 1mxh s ASN 100 CO -0.05 -1.26 0.11 -3.20 0.02 0.00 0.00 177.10 172.72 1mxh n ASN 101 N 7.89 1.86 -4.70 -1.22 2.85 -1.25 -1.37 115.26 119.31 1mxh n ASN 101 Ca 0.34 0.00 -0.44 0.00 -0.11 0.00 0.00 54.58 54.37 1mxh n ASN 101 Cb 0.49 1.02 -0.02 0.00 1.24 0.00 0.00 39.78 42.50 1mxh n ASN 101 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1mxh n ALA 102 N -2.35 1.60 -3.63 5.20 0.00 -1.08 -4.88 120.51 115.37 1mxh n ALA 102 Ca -0.16 0.39 -0.11 0.00 0.00 0.00 0.00 53.44 53.57 1mxh n ALA 102 Cb 0.78 -2.33 -0.07 0.00 0.00 0.00 0.00 19.45 17.82 1mxh n ALA 102 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1mxh s SER 103 N 0.30 -0.83 -0.06 0.00 0.15 -1.26 -4.47 113.70 107.53 1mxh s SER 103 Ca 0.65 1.46 -0.16 0.00 0.70 0.00 0.00 55.95 58.61 1mxh s SER 103 Cb -0.59 1.42 -0.05 0.00 -1.71 0.00 0.00 66.02 65.09 1mxh s SER 103 CO 0.51 -0.24 0.42 0.00 1.20 0.00 0.00 173.24 175.12 1mxh s ALA 104 N 0.95 3.60 -0.20 5.45 0.00 -1.26 -5.02 121.76 125.27 1mxh s ALA 104 Ca -0.04 -0.24 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 1mxh s ALA 104 Cb -0.05 -2.48 0.08 0.00 0.00 0.00 0.00 23.12 20.67 1mxh s ALA 104 CO -0.09 0.26 0.16 -0.47 0.00 0.00 0.00 175.76 175.63 1mxh s TYR 105 N -0.27 -0.03 0.03 0.00 5.04 -1.26 -4.81 117.35 116.04 1mxh s TYR 105 Ca 0.24 -0.14 -0.28 0.00 -2.44 0.00 0.00 57.07 54.45 1mxh s TYR 105 Cb -0.16 -0.56 0.10 0.00 0.35 0.00 0.00 41.96 41.69 1mxh s TYR 105 CO 0.11 -0.61 0.83 1.52 -1.34 0.00 0.00 175.55 176.06 1mxh s TYR 106 N 2.23 -0.38 0.77 4.97 -0.85 -1.26 -5.17 117.35 117.66 1mxh s TYR 106 Ca 0.05 0.23 -0.13 0.00 -0.52 0.00 0.00 57.07 56.70 1mxh s TYR 106 Cb -0.16 0.54 0.06 0.00 0.38 0.00 0.00 41.96 42.79 1mxh s TYR 106 CO -0.15 -0.61 1.17 -1.25 -1.52 0.00 0.00 175.55 173.19 1mxh s PRO 107 N -3.25 1.93 -0.44 -3.49 0.04 -1.26 -4.75 135.00 123.79 1mxh s PRO 107 Ca 0.04 1.60 0.08 0.00 0.04 0.00 0.00 61.00 62.76 1mxh s PRO 107 Cb -0.01 -1.83 0.31 0.00 0.04 0.00 0.00 34.50 33.01 1mxh s PRO 107 CO -0.10 -1.96 0.93 0.25 0.04 0.00 0.00 177.00 176.17 1mxh n THR 108 N -3.17 -0.10 -1.64 1.26 -2.24 0.14 -4.97 114.28 103.55 1mxh n THR 108 Ca 0.12 -2.48 -0.45 0.00 -2.27 0.00 0.00 64.05 58.97 1mxh n THR 108 Cb 0.51 0.77 -0.03 0.00 -2.10 0.00 0.00 70.33 69.48 1mxh n THR 108 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1mxh n PRO 109 N 0.66 1.78 -0.22 -0.78 -0.04 -1.19 -4.44 135.00 130.77 1mxh n PRO 109 Ca 0.12 0.63 -0.05 0.00 -0.04 0.00 0.00 63.50 64.16 1mxh n PRO 109 Cb 0.66 -2.22 0.10 0.00 -0.04 0.00 0.00 33.50 32.00 1mxh n PRO 109 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1mxh h LEU 110 N 3.69 0.98 -9.33 1.53 3.38 -2.01 -3.42 115.31 110.13 1mxh h LEU 110 Ca -0.44 -0.18 -0.67 0.00 0.09 0.00 0.00 57.88 56.67 1mxh h LEU 110 Cb 1.30 -0.26 -0.14 0.00 0.09 0.00 0.00 40.66 41.65 1mxh h LEU 110 CO 0.72 0.93 -0.65 -0.76 0.09 0.00 0.00 178.44 178.77 1mxh s LEU 111 N -9.51 3.46 -0.35 1.67 2.01 -1.26 -5.25 118.68 109.45 1mxh s LEU 111 Ca -0.11 -0.01 -0.45 0.00 0.01 0.00 0.00 54.13 53.56 1mxh s LEU 111 Cb 0.15 -1.96 -0.20 0.00 0.01 0.00 0.00 46.19 44.19 1mxh s LEU 111 CO 0.83 0.29 1.44 -2.65 1.01 0.00 0.00 176.35 177.28 1mxh n PRO 112 N 1.51 0.00 -3.06 1.29 -0.02 -1.26 -5.16 135.00 128.31 1mxh n PRO 112 Ca -0.15 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 60.93 1mxh n PRO 112 Cb 0.53 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.46 1mxh n PRO 112 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1mxh s PRO 124 N 2.12 4.44 0.05 0.52 0.04 -1.26 -5.15 135.00 135.77 1mxh s PRO 124 Ca 1.01 0.96 -0.17 0.00 0.04 0.00 0.00 61.00 62.83 1mxh s PRO 124 Cb -1.43 -3.35 -0.07 0.00 0.04 0.00 0.00 34.50 29.69 1mxh s PRO 124 CO 0.75 0.32 1.28 0.97 0.04 0.00 0.00 177.00 180.36 1mxh h ILE 125 N 4.09 0.00 0.00 0.56 6.09 -2.02 -1.90 117.51 124.34 1mxh h ILE 125 Ca -0.44 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.05 1mxh h ILE 125 Cb 1.20 0.00 0.00 0.00 0.47 0.00 0.00 36.82 38.49 1mxh h ILE 125 CO 0.70 0.00 0.11 -2.24 -3.07 0.00 0.00 178.15 173.65 1mxh h ASP 126 N -0.35 0.00 0.86 2.19 3.04 -2.05 0.77 116.42 120.88 1mxh h ASP 126 Ca 0.00 0.00 -0.22 0.00 -3.24 0.00 0.00 57.03 53.58 1mxh h ASP 126 Cb 0.37 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.63 1mxh h ASP 126 CO -0.17 0.00 -1.22 0.00 -2.04 0.00 0.00 179.24 175.81 1mxh h ALA 127 N 1.73 0.58 -0.10 4.15 0.00 -1.87 -2.12 119.26 121.64 1mxh h ALA 127 Ca 0.00 -1.02 -0.21 0.00 0.00 0.00 0.00 54.91 53.69 1mxh h ALA 127 Cb 0.22 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1mxh h ALA 127 CO 0.00 1.23 -0.78 1.96 0.00 0.00 0.00 179.25 181.65 1mxh h GLN 128 N 0.00 0.56 -0.29 0.00 4.20 0.12 -2.23 115.11 117.47 1mxh h GLN 128 Ca -0.12 -0.48 -0.02 0.00 0.06 0.00 0.00 58.65 58.09 1mxh h GLN 128 Cb 1.77 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 29.64 1mxh h GLN 128 CO 0.09 1.10 0.10 0.28 -0.67 0.00 0.00 178.83 179.74 1mxh h VAL 129 N 0.38 1.19 -0.39 -0.54 2.07 -0.90 0.19 116.25 118.25 1mxh h VAL 129 Ca -0.05 -0.61 0.04 0.00 0.82 0.00 0.00 66.70 66.91 1mxh h VAL 129 Cb 1.39 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 1mxh h VAL 129 CO 0.15 0.21 0.15 0.00 0.02 0.00 0.00 177.57 178.09 1mxh h ALA 130 N 0.94 0.46 -0.03 1.67 0.00 -1.30 0.11 119.26 121.11 1mxh h ALA 130 Ca 0.10 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1mxh h ALA 130 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1mxh h ALA 130 CO -0.00 -0.24 -0.13 1.49 0.00 0.00 0.00 179.25 180.36 1mxh h GLU 131 N 0.31 0.14 -0.37 0.00 4.81 -1.22 0.35 114.58 118.61 1mxh h GLU 131 Ca 0.18 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 1mxh h GLU 131 Cb 0.15 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1mxh h GLU 131 CO -0.17 0.77 -0.11 -0.07 -0.73 0.00 0.00 179.01 178.69 1mxh h LEU 132 N -0.45 0.73 -0.17 1.64 3.38 -0.59 -2.01 115.31 117.83 1mxh h LEU 132 Ca -0.01 -0.37 -0.22 0.00 0.09 0.00 0.00 57.88 57.36 1mxh h LEU 132 Cb 0.79 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1mxh h LEU 132 CO 0.03 0.94 -0.95 -0.26 0.09 0.00 0.00 178.44 178.29 1mxh h PHE 133 N 0.52 0.53 0.60 1.13 -1.00 -0.90 -2.70 116.94 115.11 1mxh h PHE 133 Ca 0.09 -0.30 -0.03 0.00 2.81 0.00 0.00 57.97 60.54 1mxh h PHE 133 Cb 0.63 -0.06 0.01 0.00 3.61 0.00 0.00 35.95 40.14 1mxh h PHE 133 CO 0.05 1.12 -0.29 0.78 -1.61 0.00 0.00 178.31 178.37 1mxh h GLY 134 N 1.39 -0.84 1.01 -1.45 0.00 -1.09 0.41 103.07 102.49 1mxh h GLY 134 Ca -0.08 0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 1mxh h GLY 134 CO 0.16 -0.31 0.47 1.48 0.00 0.00 0.00 176.54 178.35 1mxh h SER 135 N -0.87 0.91 1.03 0.19 4.64 -0.92 0.33 113.55 118.86 1mxh h SER 135 Ca -0.08 -0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 61.00 1mxh h SER 135 Cb 0.62 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.45 1mxh h SER 135 CO 0.14 0.69 -1.01 0.78 -0.87 0.00 0.00 176.83 176.56 1mxh h ASN 136 N 1.05 0.00 0.00 4.97 2.35 -1.57 -3.41 115.58 118.97 1mxh h ASN 136 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1mxh h ASN 136 Cb -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 1mxh h ASN 136 CO -0.05 0.81 -0.21 0.00 -1.65 0.00 0.00 177.43 176.33 1mxh n ALA 137 N -2.35 3.00 -0.17 -0.83 0.00 -0.04 -4.51 120.51 115.62 1mxh n ALA 137 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.31 1mxh n ALA 137 Cb 0.89 0.19 0.00 0.00 0.00 0.00 0.00 19.45 20.53 1mxh n ALA 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1mxh h VAL 138 N 0.00 1.26 -0.25 0.00 2.07 -0.95 -1.94 116.25 116.44 1mxh h VAL 138 Ca 0.00 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1mxh h VAL 138 Cb 0.21 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1mxh h VAL 138 CO 0.00 0.36 0.13 0.00 0.02 0.00 0.00 177.57 178.08 1mxh h ALA 139 N 0.94 0.32 -0.89 1.67 0.00 -0.56 -0.67 119.26 120.06 1mxh h ALA 139 Ca 0.14 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.03 1mxh h ALA 139 Cb 0.47 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1mxh h ALA 139 CO 0.02 -0.14 0.58 -1.35 0.00 0.00 0.00 179.25 178.36 1mxh h PRO 140 N 0.28 1.00 -0.12 0.00 0.11 -1.73 0.16 132.00 131.71 1mxh h PRO 140 Ca 0.09 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 1mxh h PRO 140 Cb 0.09 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 1mxh h PRO 140 CO -0.01 0.66 0.05 1.25 -0.21 0.00 0.00 178.00 179.74 1mxh h LEU 141 N 1.03 0.15 -0.87 2.35 5.85 -0.72 -0.86 115.31 122.25 1mxh h LEU 141 Ca 0.37 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.89 1mxh h LEU 141 Cb 0.15 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1mxh h LEU 141 CO -0.13 0.24 0.04 -0.26 -0.34 0.00 0.00 178.44 177.99 1mxh h PHE 142 N 0.05 0.94 -0.47 1.25 0.04 -0.53 -1.09 116.94 117.14 1mxh h PHE 142 Ca 0.04 -0.13 -0.07 0.00 2.80 0.00 0.00 57.97 60.61 1mxh h PHE 142 Cb 0.13 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 1mxh h PHE 142 CO -0.03 0.83 0.01 -0.07 -0.60 0.00 0.00 178.31 178.45 1mxh h LEU 143 N 0.83 0.80 -0.45 1.54 3.38 -0.58 -0.28 115.31 120.56 1mxh h LEU 143 Ca 0.16 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 1mxh h LEU 143 Cb 0.43 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1mxh h LEU 143 CO 0.02 0.91 0.01 0.40 0.09 0.00 0.00 178.44 179.86 1mxh h ILE 144 N 0.67 1.26 0.00 1.22 2.04 -1.01 0.94 117.51 122.63 1mxh h ILE 144 Ca 0.13 -1.03 0.03 0.00 1.00 0.00 0.00 64.86 64.99 1mxh h ILE 144 Cb 0.49 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 1mxh h ILE 144 CO 0.02 0.36 -0.20 -0.09 0.00 0.00 0.00 178.15 178.24 1mxh h ARG 145 N 0.63 -0.31 -0.60 2.37 2.43 -1.03 0.16 114.38 118.03 1mxh h ARG 145 Ca 0.13 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1mxh h ARG 145 Cb 0.49 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1mxh h ARG 145 CO 0.02 -0.21 0.22 0.00 -1.51 0.00 0.00 179.97 178.49 1mxh h ALA 146 N 0.57 0.78 -0.58 2.80 0.00 -0.91 -1.15 119.26 120.77 1mxh h ALA 146 Ca 0.06 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1mxh h ALA 146 Cb 0.40 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1mxh h ALA 146 CO -0.18 0.41 0.37 0.35 0.00 0.00 0.00 179.25 180.20 1mxh h PHE 147 N 0.83 0.71 -0.35 0.00 3.04 -0.35 -1.95 116.94 118.87 1mxh h PHE 147 Ca 0.20 0.02 -0.15 0.00 3.98 0.00 0.00 57.97 62.01 1mxh h PHE 147 Cb 0.24 -0.24 -0.00 0.00 2.56 0.00 0.00 35.95 38.50 1mxh h PHE 147 CO 0.01 0.43 -0.38 0.00 -2.02 0.00 0.00 178.31 176.36 1mxh h ALA 148 N 1.23 0.52 0.00 2.41 0.00 -0.50 -3.10 119.26 119.82 1mxh h ALA 148 Ca 0.22 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1mxh h ALA 148 Cb -0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1mxh h ALA 148 CO -0.07 0.62 -0.17 0.00 0.00 0.00 0.00 179.25 179.63 1mxh h ARG 149 N 0.68 0.00 -0.67 0.00 3.08 -1.01 -2.90 114.38 113.56 1mxh h ARG 149 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1mxh h ARG 149 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1mxh h ARG 149 CO 0.09 0.17 0.00 0.54 -1.07 0.00 0.00 179.97 179.70 1mxh n ARG 150 N -3.49 3.25 -2.53 0.04 1.74 -0.75 -5.09 116.66 109.83 1mxh n ARG 150 Ca -0.01 -2.02 -0.15 0.00 -0.77 0.00 0.00 57.85 54.90 1mxh n ARG 150 Cb 0.33 -1.86 0.05 0.00 -1.02 0.00 0.00 32.46 29.97 1mxh n ARG 150 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1mxh n GLN 151 N 0.55 0.67 -3.78 5.56 1.13 -1.10 -4.98 117.38 115.42 1mxh n GLN 151 Ca 0.18 -2.43 -0.18 0.00 -1.94 0.00 0.00 57.00 52.63 1mxh n GLN 151 Cb 0.77 -0.20 -0.06 0.00 0.11 0.00 0.00 30.24 30.86 1mxh n GLN 151 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1mxh n SER 159 N -2.49 0.52 0.00 1.08 7.64 -1.26 -5.10 113.62 114.01 1mxh n SER 159 Ca 0.13 -2.66 0.00 0.00 1.01 0.00 0.00 58.87 57.35 1mxh n SER 159 Cb 0.47 0.97 0.00 0.00 -1.01 0.00 0.00 64.21 64.64 1mxh n SER 159 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1mxh n ARG 160 N -0.62 3.37 -3.61 1.43 0.00 -1.26 -5.10 116.66 110.86 1mxh n ARG 160 Ca -0.01 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.57 1mxh n ARG 160 Cb 0.46 0.00 -0.11 0.00 -0.00 0.00 0.00 32.46 32.81 1mxh n ARG 160 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1mxh s ASN 161 N 1.00 2.94 -0.12 2.89 3.84 -1.26 -5.10 114.94 119.13 1mxh s ASN 161 Ca 0.00 -3.27 -0.25 0.00 0.21 0.00 0.00 52.86 49.55 1mxh s ASN 161 Cb 0.00 -0.93 -0.02 0.00 -0.55 0.00 0.00 41.25 39.75 1mxh s ASN 161 CO 0.00 -0.16 0.82 -0.76 -2.79 0.00 0.00 177.10 174.21 1mxh s LEU 162 N -0.41 4.24 0.13 3.21 1.43 -1.26 -4.81 118.68 121.20 1mxh s LEU 162 Ca 0.28 1.24 -0.17 0.00 -1.03 0.00 0.00 54.13 54.45 1mxh s LEU 162 Cb -0.03 -3.24 0.04 0.00 0.03 0.00 0.00 46.19 42.98 1mxh s LEU 162 CO -0.16 -0.31 0.42 -0.94 0.23 0.00 0.00 176.35 175.59 1mxh s SER 163 N 1.05 -0.26 -0.03 2.29 1.04 -0.97 -1.57 113.70 115.24 1mxh s SER 163 Ca 0.40 -0.30 0.05 0.00 0.48 0.00 0.00 55.95 56.58 1mxh s SER 163 Cb -0.17 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 1mxh s SER 163 CO 0.16 -0.87 -0.18 -0.69 0.98 0.00 0.00 173.24 172.64 1mxh s VAL 164 N -3.80 1.45 -0.19 5.02 1.01 0.15 -2.31 120.40 121.73 1mxh s VAL 164 Ca 0.03 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1mxh s VAL 164 Cb 0.02 -1.23 0.04 0.00 0.00 0.00 0.00 36.38 35.21 1mxh s VAL 164 CO -0.12 0.42 -0.07 -0.69 0.00 0.00 0.00 175.10 174.64 1mxh s VAL 165 N -0.12 1.32 0.00 2.92 1.01 0.11 -0.65 120.40 124.99 1mxh s VAL 165 Ca -0.00 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 60.99 1mxh s VAL 165 Cb -0.10 -1.49 -0.06 0.00 0.00 0.00 0.00 36.38 34.74 1mxh s VAL 165 CO 0.01 0.11 0.44 0.20 0.00 0.00 0.00 175.10 175.86 1mxh s ASN 166 N 1.53 6.84 -0.44 3.32 0.01 0.50 -1.07 114.94 125.63 1mxh s ASN 166 Ca -0.01 1.00 -0.21 0.00 -0.71 0.00 0.00 52.86 52.93 1mxh s ASN 166 Cb -0.16 -2.27 0.02 0.00 0.41 0.00 0.00 41.25 39.25 1mxh s ASN 166 CO -0.08 0.28 0.69 -0.76 -1.51 0.00 0.00 177.10 175.73 1mxh s LEU 167 N -0.91 4.43 0.00 0.60 2.01 -0.47 -1.17 118.68 123.16 1mxh s LEU 167 Ca 0.25 -0.28 0.00 0.00 0.01 0.00 0.00 54.13 54.11 1mxh s LEU 167 Cb -0.17 -2.80 0.00 0.00 0.01 0.00 0.00 46.19 43.23 1mxh s LEU 167 CO 0.14 -0.83 0.00 0.00 1.01 0.00 0.00 176.35 176.67 1mxh s ASP 169 N -1.00 1.68 0.55 0.00 -1.08 -1.26 -3.97 116.67 111.58 1mxh s ASP 169 Ca 0.00 -0.32 0.22 0.00 -0.52 0.00 0.00 52.55 51.94 1mxh s ASP 169 Cb 0.00 0.14 1.47 0.00 -1.46 0.00 0.00 42.92 43.07 1mxh s ASP 169 CO 0.00 -0.33 2.15 0.00 0.52 0.00 0.00 175.17 177.51 1mxh h ALA 170 N 8.36 1.92 -0.04 3.66 0.00 -1.23 -2.69 119.26 129.25 1mxh h ALA 170 Ca -0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1mxh h ALA 170 Cb 1.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1mxh h ALA 170 CO 0.27 -0.12 0.00 -1.33 0.00 0.00 0.00 179.25 178.07 1mxh n MET 171 N -4.26 1.60 0.00 0.00 2.81 -1.26 -4.14 117.12 111.86 1mxh n MET 171 Ca -0.01 -0.87 0.03 0.00 -1.81 0.00 0.00 57.70 55.04 1mxh n MET 171 Cb 0.18 -1.46 0.17 0.00 -0.71 0.00 0.00 33.22 31.40 1mxh n MET 171 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1mxh n THR 172 N 0.07 1.13 0.09 2.03 -2.24 -1.01 -0.32 114.28 114.02 1mxh n THR 172 Ca 0.19 0.28 -0.02 0.00 -2.27 0.00 0.00 64.05 62.23 1mxh n THR 172 Cb 0.32 -1.16 -0.05 0.00 -2.10 0.00 0.00 70.33 67.33 1mxh n THR 172 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1mxh h ASP 173 N 0.00 0.00 -2.76 3.42 3.32 -1.83 -3.30 116.42 115.26 1mxh h ASP 173 Ca 0.00 0.00 -0.70 0.00 0.02 0.00 0.00 57.03 56.35 1mxh h ASP 173 Cb 0.09 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 39.28 1mxh h ASP 173 CO 0.00 0.74 -0.02 0.18 -1.72 0.00 0.00 179.24 178.42 1mxh n LEU 174 N -3.24 4.71 -4.74 1.55 4.77 0.56 -5.05 117.00 115.56 1mxh n LEU 174 Ca -0.01 -5.28 -0.66 0.00 -0.03 0.00 0.00 56.01 50.03 1mxh n LEU 174 Cb 0.85 -0.98 -0.10 0.00 -2.33 0.00 0.00 43.42 40.86 1mxh n LEU 174 CO 0.44 1.80 1.16 -2.65 -1.33 0.00 0.00 177.39 176.80 1mxh n PRO 175 N 1.43 0.15 -2.14 3.23 -0.02 -1.24 -4.86 135.00 131.56 1mxh n PRO 175 Ca 0.26 0.06 -0.42 0.00 -2.02 0.00 0.00 63.50 61.37 1mxh n PRO 175 Cb 0.37 -1.58 -0.03 0.00 -0.02 0.00 0.00 33.50 32.25 1mxh n PRO 175 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1mxh s LEU 176 N 3.00 4.29 -0.18 2.45 2.96 -1.26 -4.90 118.68 125.04 1mxh s LEU 176 Ca 1.04 2.11 -0.39 0.00 -0.22 0.00 0.00 54.13 56.66 1mxh s LEU 176 Cb -1.44 -3.54 -0.16 0.00 0.50 0.00 0.00 46.19 41.55 1mxh s LEU 176 CO 0.79 -0.84 1.61 -2.65 -1.32 0.00 0.00 176.35 173.95 1mxh n PRO 177 N 6.48 1.08 -0.51 0.98 -0.02 -1.26 -1.99 135.00 139.76 1mxh n PRO 177 Ca 0.15 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1mxh n PRO 177 Cb 0.43 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1mxh n PRO 177 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mxh n GLY 178 N 3.66 0.75 1.67 -1.23 0.00 -1.26 -4.95 105.19 103.83 1mxh n GLY 178 Ca 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 1mxh n GLY 178 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mxh n PHE 179 N -2.50 1.57 -0.20 1.61 3.01 -0.84 0.26 117.46 120.36 1mxh n PHE 179 Ca 0.00 -1.88 -0.00 0.00 1.01 0.00 0.00 57.45 56.58 1mxh n PHE 179 Cb 0.00 -0.29 0.07 0.00 -0.01 0.00 0.00 39.48 39.25 1mxh n PHE 179 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1mxh h VAL 181 N 0.03 1.25 -0.31 0.00 2.07 -1.90 -1.21 116.25 116.17 1mxh h VAL 181 Ca 0.30 -0.92 0.02 0.00 0.82 0.00 0.00 66.70 66.92 1mxh h VAL 181 Cb 0.47 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 1mxh h VAL 181 CO -0.60 0.31 0.17 0.22 0.02 0.00 0.00 177.57 177.68 1mxh h TYR 182 N 0.44 0.31 -0.34 1.57 3.20 -1.75 -0.81 116.97 119.59 1mxh h TYR 182 Ca 0.10 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.00 1mxh h TYR 182 Cb 0.42 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1mxh h TYR 182 CO 0.03 0.17 0.20 1.15 -1.64 0.00 0.00 178.16 178.07 1mxh h THR 183 N 0.34 1.04 -0.73 1.81 2.02 -1.02 -0.35 112.91 116.01 1mxh h THR 183 Ca 0.13 -0.14 0.05 0.00 0.77 0.00 0.00 66.41 67.21 1mxh h THR 183 Cb 0.03 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 1mxh h THR 183 CO -0.08 0.07 0.45 0.24 0.37 0.00 0.00 175.52 176.57 1mxh h MET 184 N 0.41 0.82 -0.29 6.66 2.86 -0.97 -1.03 114.93 123.39 1mxh h MET 184 Ca 0.13 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1mxh h MET 184 Cb 0.00 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 1mxh h MET 184 CO -0.06 0.54 0.16 0.00 1.06 0.00 0.00 176.91 178.61 1mxh h ALA 185 N 1.34 0.38 -0.13 6.32 0.00 -0.43 -1.25 119.26 125.49 1mxh h ALA 185 Ca 0.31 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 1mxh h ALA 185 Cb 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1mxh h ALA 185 CO -0.14 -0.10 -0.25 0.87 0.00 0.00 0.00 179.25 179.63 1mxh h LYS 186 N 0.36 0.23 -0.53 0.00 1.79 -0.67 -1.47 116.57 116.28 1mxh h LYS 186 Ca 0.10 -0.07 -0.10 0.00 -2.18 0.00 0.00 60.65 58.40 1mxh h LYS 186 Cb 0.06 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.67 1mxh h LYS 186 CO -0.02 0.47 -0.07 0.45 -1.08 0.00 0.00 179.45 179.20 1mxh h HIS 187 N 0.21 1.10 -0.96 -1.35 3.86 -0.88 -1.51 115.15 115.62 1mxh h HIS 187 Ca 0.03 -0.22 0.01 0.00 -1.16 0.00 0.00 60.37 59.04 1mxh h HIS 187 Cb 0.56 -0.28 -0.05 0.00 1.06 0.00 0.00 27.41 28.70 1mxh h HIS 187 CO 0.01 1.02 0.64 0.00 0.86 0.00 0.00 177.93 180.46 1mxh h ALA 188 N 0.93 1.23 -0.38 2.45 0.00 -0.61 -0.16 119.26 122.72 1mxh h ALA 188 Ca 0.14 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1mxh h ALA 188 Cb 0.63 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1mxh h ALA 188 CO 0.04 0.61 -0.00 1.25 0.00 0.00 0.00 179.25 181.14 1mxh h LEU 189 N 1.30 0.57 -0.34 0.00 5.85 -0.89 -0.11 115.31 121.69 1mxh h LEU 189 Ca 0.36 -0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.90 1mxh h LEU 189 Cb -0.14 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 1mxh h LEU 189 CO -0.08 0.64 -0.03 1.23 -0.34 0.00 0.00 178.44 179.86 1mxh h GLY 190 N 0.89 0.66 1.41 3.75 0.00 -0.13 -0.19 103.07 109.46 1mxh h GLY 190 Ca 0.12 -0.51 0.01 0.00 0.00 0.00 0.00 47.33 46.96 1mxh h GLY 190 CO 0.01 0.47 0.38 -1.33 0.00 0.00 0.00 176.54 176.06 1mxh h GLY 191 N 0.41 0.78 1.13 4.60 0.00 -0.55 -1.85 103.07 107.60 1mxh h GLY 191 Ca 0.09 -0.28 -0.16 0.00 0.00 0.00 0.00 47.33 46.97 1mxh h GLY 191 CO 0.02 0.27 -0.40 -2.00 0.00 0.00 0.00 176.54 174.43 1mxh h LEU 192 N 0.73 1.01 -0.84 3.11 5.85 -0.62 -1.12 115.31 123.43 1mxh h LEU 192 Ca 0.21 -0.47 0.08 0.00 0.84 0.00 0.00 57.88 58.54 1mxh h LEU 192 Cb -0.03 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 40.65 1mxh h LEU 192 CO -0.05 1.28 0.51 0.74 -0.34 0.00 0.00 178.44 180.57 1mxh h THR 193 N 0.76 0.99 0.19 1.05 2.02 -0.20 -0.92 112.91 116.80 1mxh h THR 193 Ca 0.06 -0.31 -0.27 0.00 0.77 0.00 0.00 66.41 66.66 1mxh h THR 193 Cb 1.00 0.01 0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1mxh h THR 193 CO 0.10 0.16 -1.21 0.03 0.37 0.00 0.00 175.52 174.97 1mxh h ARG 194 N 0.89 0.39 -0.71 6.66 3.08 -1.41 -2.39 114.38 120.89 1mxh h ARG 194 Ca 0.38 -0.67 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 1mxh h ARG 194 Cb 0.25 0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 1mxh h ARG 194 CO -0.20 1.32 0.37 0.00 -1.07 0.00 0.00 179.97 180.38 1mxh h ALA 195 N 0.09 0.91 -0.22 0.04 0.00 -1.12 -2.18 119.26 116.78 1mxh h ALA 195 Ca -0.22 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.41 1mxh h ALA 195 Cb 1.89 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 1mxh h ALA 195 CO 0.19 0.45 -0.48 0.00 0.00 0.00 0.00 179.25 179.41 1mxh h ALA 196 N 1.18 0.76 -0.09 0.00 0.00 -1.28 -1.87 119.26 117.97 1mxh h ALA 196 Ca 0.25 -0.48 0.02 0.00 0.00 0.00 0.00 54.91 54.70 1mxh h ALA 196 Cb 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1mxh h ALA 196 CO -0.04 0.67 -0.05 0.00 0.00 0.00 0.00 179.25 179.83 1mxh h ALA 197 N 1.02 0.02 -0.14 0.00 0.00 -1.04 0.11 119.26 119.24 1mxh h ALA 197 Ca 0.02 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1mxh h ALA 197 Cb 1.00 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1mxh h ALA 197 CO 0.09 -0.52 -0.04 1.25 0.00 0.00 0.00 179.25 180.03 1mxh h LEU 198 N -0.05 0.28 -1.39 0.00 5.85 -1.38 -2.57 115.31 116.05 1mxh h LEU 198 Ca 0.05 -0.38 -0.06 0.00 0.84 0.00 0.00 57.88 58.33 1mxh h LEU 198 Cb 0.13 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1mxh h LEU 198 CO -0.12 0.59 -0.30 -0.08 -0.34 0.00 0.00 178.44 178.19 1mxh h GLU 199 N -0.04 0.00 -0.01 1.25 4.81 -1.20 -3.04 114.58 116.35 1mxh h GLU 199 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1mxh h GLU 199 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1mxh h GLU 199 CO 0.02 0.30 -0.47 1.28 -0.73 0.00 0.00 179.01 179.41 1mxh n LEU 200 N -3.99 1.27 -0.35 1.64 4.32 0.37 -4.36 117.00 115.90 1mxh n LEU 200 Ca -0.02 -0.42 0.07 0.00 -0.02 0.00 0.00 56.01 55.63 1mxh n LEU 200 Cb 0.37 -0.08 0.24 0.00 -1.62 0.00 0.00 43.42 42.32 1mxh n LEU 200 CO 0.37 0.25 1.22 0.00 -1.22 0.00 0.00 177.39 178.01 1mxh h ALA 201 N 3.55 1.50 0.00 -1.18 0.00 -1.33 0.21 119.26 122.01 1mxh h ALA 201 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1mxh h ALA 201 Cb 0.59 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1mxh h ALA 201 CO 0.00 0.17 0.00 -1.35 0.00 0.00 0.00 179.25 178.07 1mxh h PRO 202 N 0.94 0.00 -0.49 0.00 0.11 -1.79 -0.24 132.00 130.53 1mxh h PRO 202 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 1mxh h PRO 202 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 1mxh h PRO 202 CO -0.28 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.05 1mxh n ARG 203 N -2.42 2.55 -2.55 1.05 5.12 0.70 -4.96 116.66 116.15 1mxh n ARG 203 Ca -0.00 -2.37 -0.20 0.00 -1.93 0.00 0.00 57.85 53.35 1mxh n ARG 203 Cb 0.14 -1.51 -0.00 0.00 -1.16 0.00 0.00 32.46 29.93 1mxh n ARG 203 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1mxh n HIS 204 N 1.46 -1.27 -3.75 -1.55 8.25 -0.10 -4.96 115.22 113.30 1mxh n HIS 204 Ca 0.20 0.11 -0.37 0.00 -0.26 0.00 0.00 57.72 57.40 1mxh n HIS 204 Cb 0.59 -3.86 -0.12 0.00 1.12 0.00 0.00 29.99 27.72 1mxh n HIS 204 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1mxh s ILE 205 N -3.00 4.00 0.15 1.59 1.01 -1.13 -4.28 121.20 119.54 1mxh s ILE 205 Ca 0.07 -0.71 -0.23 0.00 0.00 0.00 0.00 60.65 59.78 1mxh s ILE 205 Cb -0.03 -3.08 -0.08 0.00 0.01 0.00 0.00 42.46 39.28 1mxh s ILE 205 CO 0.08 0.05 0.71 -0.13 0.00 0.00 0.00 174.94 175.66 1mxh s ARG 206 N 1.50 4.43 -0.16 2.79 0.52 -0.61 -4.21 118.95 123.20 1mxh s ARG 206 Ca 0.02 1.00 0.00 0.00 -0.52 0.00 0.00 55.73 56.24 1mxh s ARG 206 Cb -0.17 -3.21 0.03 0.00 0.52 0.00 0.00 34.95 32.12 1mxh s ARG 206 CO 0.03 0.57 -0.09 0.08 0.02 0.00 0.00 175.30 175.91 1mxh s VAL 207 N -1.18 1.33 0.35 3.52 1.01 -1.26 0.30 120.40 124.47 1mxh s VAL 207 Ca 0.35 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.70 1mxh s VAL 207 Cb -0.21 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 1mxh s VAL 207 CO 0.24 0.25 0.16 0.59 0.00 0.00 0.00 175.10 176.34 1mxh n ASN 208 N 4.82 0.73 -3.71 3.32 3.02 0.18 0.90 115.26 124.51 1mxh n ASN 208 Ca -0.14 -2.97 -0.13 0.00 -0.03 0.00 0.00 54.58 51.31 1mxh n ASN 208 Cb 0.48 1.08 -0.07 0.00 -0.61 0.00 0.00 39.78 40.66 1mxh n ASN 208 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mxh s ALA 209 N -3.06 -0.89 -0.05 5.41 0.00 -0.44 -0.37 121.76 122.37 1mxh s ALA 209 Ca 0.23 0.30 0.04 0.00 0.00 0.00 0.00 51.96 52.53 1mxh s ALA 209 Cb 0.01 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.33 1mxh s ALA 209 CO 0.16 -0.37 -0.18 0.08 0.00 0.00 0.00 175.76 175.46 1mxh s VAL 210 N -2.00 2.76 -0.37 0.00 1.01 -0.32 0.23 120.40 121.72 1mxh s VAL 210 Ca -0.09 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1mxh s VAL 210 Cb -0.02 -2.06 0.11 0.00 0.00 0.00 0.00 36.38 34.41 1mxh s VAL 210 CO 0.01 0.58 0.12 0.00 0.00 0.00 0.00 175.10 175.81 1mxh s ALA 211 N -0.58 2.32 0.68 5.51 0.00 0.24 0.76 121.76 130.70 1mxh s ALA 211 Ca 0.08 -2.32 -0.13 0.00 0.00 0.00 0.00 51.96 49.59 1mxh s ALA 211 Cb -0.11 -1.85 0.01 0.00 0.00 0.00 0.00 23.12 21.16 1mxh s ALA 211 CO 0.01 -1.78 1.08 -2.14 0.00 0.00 0.00 175.76 172.92 1mxh s PRO 212 N 0.93 2.85 0.00 0.00 0.02 -1.25 -1.02 135.00 136.53 1mxh s PRO 212 Ca 0.12 1.17 0.00 0.00 0.02 0.00 0.00 61.00 62.31 1mxh s PRO 212 Cb -0.20 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.35 1mxh s PRO 212 CO -0.12 -1.18 0.00 0.41 -0.33 0.00 0.00 177.00 175.78 1mxh n GLY 213 N -1.21 -0.10 3.23 0.52 0.00 -0.81 -1.00 105.19 105.82 1mxh n GLY 213 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1mxh n GLY 213 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mxh s LEU 214 N -0.39 3.87 0.00 0.99 2.96 -1.26 -4.80 118.68 120.05 1mxh s LEU 214 Ca 0.00 -1.08 0.00 0.00 -0.22 0.00 0.00 54.13 52.83 1mxh s LEU 214 Cb 0.00 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 44.92 1mxh s LEU 214 CO 0.00 -0.24 0.00 -0.24 -1.32 0.00 0.00 176.35 174.55 1mxh n SER 215 N 4.72 0.73 -3.26 3.68 2.88 -1.26 0.18 113.62 121.29 1mxh n SER 215 Ca -0.14 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.94 1mxh n SER 215 Cb 0.45 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.83 1mxh n SER 215 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1mxh n LEU 216 N 0.00 0.68 -4.85 2.46 4.77 -1.20 -4.67 117.00 114.19 1mxh n LEU 216 Ca 0.00 0.64 -0.31 0.00 -0.03 0.00 0.00 56.01 56.31 1mxh n LEU 216 Cb 0.00 -0.65 0.03 0.00 -2.33 0.00 0.00 43.42 40.46 1mxh n LEU 216 CO 0.00 -0.58 0.71 -0.76 -1.33 0.00 0.00 177.39 175.43 1mxh s LEU 217 N 3.56 3.20 0.38 2.23 1.43 -1.26 -4.98 118.68 123.24 1mxh s LEU 217 Ca 0.84 1.52 -0.27 0.00 -1.03 0.00 0.00 54.13 55.18 1mxh s LEU 217 Cb -1.10 -4.48 -0.11 0.00 0.03 0.00 0.00 46.19 40.53 1mxh s LEU 217 CO 0.53 -1.12 1.40 -2.65 0.23 0.00 0.00 176.35 174.74 1mxh n PRO 218 N -2.87 2.39 0.24 1.29 -0.02 -1.26 -4.87 135.00 129.90 1mxh n PRO 218 Ca 0.07 0.84 0.09 0.00 -2.02 0.00 0.00 63.50 62.48 1mxh n PRO 218 Cb 0.54 -2.53 0.62 0.00 -0.02 0.00 0.00 33.50 32.10 1mxh n PRO 218 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1mxh h PRO 219 N 2.67 0.00 0.09 0.52 0.13 -2.04 -3.01 132.00 130.36 1mxh h PRO 219 Ca -0.49 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.38 1mxh h PRO 219 Cb 1.26 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 1mxh h PRO 219 CO 0.63 0.16 -1.17 0.00 -0.23 0.00 0.00 178.00 177.38 1mxh h ALA 220 N 1.84 0.17 -1.50 -0.56 0.00 -2.05 -3.47 119.26 113.70 1mxh h ALA 220 Ca -0.00 -0.89 -0.72 0.00 0.00 0.00 0.00 54.91 53.30 1mxh h ALA 220 Cb 0.34 -0.04 0.05 0.00 0.00 0.00 0.00 17.79 18.14 1mxh h ALA 220 CO 0.02 1.04 0.46 -0.12 0.00 0.00 0.00 179.25 180.65 1mxh n MET 221 N -3.49 0.87 -1.74 0.00 0.00 -1.14 -4.87 117.12 106.75 1mxh n MET 221 Ca -0.06 0.32 -0.42 0.00 0.00 0.00 0.00 57.70 57.53 1mxh n MET 221 Cb 1.00 -1.93 -0.01 0.00 0.00 0.00 0.00 33.22 32.28 1mxh n MET 221 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1mxh n PRO 222 N 2.83 2.50 -0.13 2.12 -0.02 -1.26 -4.74 135.00 136.30 1mxh n PRO 222 Ca 0.21 0.88 0.27 0.00 -2.02 0.00 0.00 63.50 62.84 1mxh n PRO 222 Cb 0.15 -2.59 0.72 0.00 -0.02 0.00 0.00 33.50 31.76 1mxh n PRO 222 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1mxh h GLN 223 N 3.67 0.00 -0.16 -0.52 4.20 -1.97 0.12 115.11 120.46 1mxh h GLN 223 Ca -0.48 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.22 1mxh h GLN 223 Cb 1.25 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.02 1mxh h GLN 223 CO 0.70 0.00 0.05 0.93 -0.67 0.00 0.00 178.83 179.85 1mxh h GLU 224 N 0.00 0.24 -0.46 1.46 5.08 -1.99 -0.84 114.58 118.07 1mxh h GLU 224 Ca 0.39 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.56 1mxh h GLU 224 Cb 1.62 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.82 1mxh h GLU 224 CO -0.00 0.36 -0.25 1.15 -1.00 0.00 0.00 179.01 179.27 1mxh h THR 225 N 0.08 1.27 -0.63 1.13 2.02 -1.19 -2.42 112.91 113.18 1mxh h THR 225 Ca 0.05 -1.41 0.02 0.00 0.77 0.00 0.00 66.41 65.84 1mxh h THR 225 Cb 0.21 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1mxh h THR 225 CO -0.00 0.48 0.39 1.56 0.37 0.00 0.00 175.52 178.33 1mxh h GLN 226 N 0.83 0.76 -0.09 6.66 4.20 -0.98 -1.81 115.11 124.67 1mxh h GLN 226 Ca 0.10 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 1mxh h GLN 226 Cb 0.83 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 1mxh h GLN 226 CO 0.07 0.50 -0.21 1.49 -0.67 0.00 0.00 178.83 180.01 1mxh h GLU 227 N 0.78 0.15 -0.02 1.46 4.57 -1.01 -0.17 114.58 120.34 1mxh h GLU 227 Ca 0.25 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 58.27 1mxh h GLU 227 Cb -0.00 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 1mxh h GLU 227 CO -0.09 0.36 -0.53 0.93 -1.18 0.00 0.00 179.01 178.50 1mxh h GLU 228 N 0.14 0.05 -0.00 1.92 5.08 -0.85 -2.21 114.58 118.70 1mxh h GLU 228 Ca 0.03 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1mxh h GLU 228 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1mxh h GLU 228 CO 0.03 0.56 -0.08 1.88 -1.00 0.00 0.00 179.01 180.40 1mxh h TYR 229 N 0.04 0.09 -0.33 4.33 -1.99 -0.66 -3.35 116.97 115.09 1mxh h TYR 229 Ca -0.00 -0.05 0.07 0.00 2.00 0.00 0.00 58.73 60.75 1mxh h TYR 229 Cb 0.94 -0.01 -0.08 0.00 2.00 0.00 0.00 36.73 39.59 1mxh h TYR 229 CO 0.00 0.81 -0.18 0.00 -0.00 0.00 0.00 178.16 178.79 1mxh h ARG 230 N -0.66 -0.13 0.00 4.88 3.08 -0.99 -1.77 114.38 118.79 1mxh h ARG 230 Ca -0.01 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1mxh h ARG 230 Cb 0.83 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1mxh h ARG 230 CO 0.02 -0.09 0.08 0.54 -1.07 0.00 0.00 179.97 179.44 1mxh n ARG 231 N -5.35 0.08 0.17 0.04 1.74 -0.84 -1.40 116.66 111.09 1mxh n ARG 231 Ca 0.01 0.56 0.12 0.00 -0.77 0.00 0.00 57.85 57.77 1mxh n ARG 231 Cb 0.27 -1.85 0.24 0.00 -1.02 0.00 0.00 32.46 30.10 1mxh n ARG 231 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1mxh h LYS 232 N 0.00 0.00 -6.25 5.56 1.57 -1.44 -3.45 116.57 112.55 1mxh h LYS 232 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1mxh h LYS 232 Cb 0.15 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 1mxh h LYS 232 CO 0.00 0.00 0.99 0.08 -0.57 0.00 0.00 179.45 179.95 1mxh s VAL 233 N -3.18 4.05 0.30 0.50 1.01 -0.50 -4.86 120.40 117.72 1mxh s VAL 233 Ca 0.08 1.22 -0.00 0.00 0.00 0.00 0.00 61.98 63.28 1mxh s VAL 233 Cb 0.08 -3.94 0.27 0.00 0.00 0.00 0.00 36.38 32.80 1mxh s VAL 233 CO 0.65 -0.27 1.94 -0.65 0.00 0.00 0.00 175.10 176.77 1mxh h PRO 234 N 9.21 1.02 -4.49 2.72 0.11 -1.84 -0.43 132.00 138.30 1mxh h PRO 234 Ca -0.29 -0.06 -0.74 0.00 0.11 0.00 0.00 66.00 65.02 1mxh h PRO 234 Cb 1.12 -0.23 -0.21 0.00 0.11 0.00 0.00 31.00 31.79 1mxh h PRO 234 CO 1.00 0.67 0.61 -1.17 -0.21 0.00 0.00 178.00 178.90 1mxh s LEU 235 N -9.95 5.74 0.00 2.35 2.96 -0.73 -4.46 118.68 114.59 1mxh s LEU 235 Ca -0.11 -2.47 0.00 0.00 -0.22 0.00 0.00 54.13 51.32 1mxh s LEU 235 Cb 0.19 -2.32 0.00 0.00 0.50 0.00 0.00 46.19 44.56 1mxh s LEU 235 CO 0.79 -0.81 0.00 0.61 -1.32 0.00 0.00 176.35 175.63 1mxh n GLY 236 N 4.64 1.01 3.54 7.98 0.00 -1.26 -4.37 105.19 116.74 1mxh n GLY 236 Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 1mxh n GLY 236 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mxh n GLN 237 N -2.00 -5.00 -3.97 1.61 3.00 -0.17 -4.97 117.38 105.88 1mxh n GLN 237 Ca 0.00 0.65 -0.10 0.00 -0.01 0.00 0.00 57.00 57.54 1mxh n GLN 237 Cb 0.00 -5.50 -0.12 0.00 0.00 0.00 0.00 30.24 24.62 1mxh n GLN 237 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1mxh s SER 238 N -3.01 0.28 0.81 1.08 0.15 -1.18 -3.65 113.70 108.19 1mxh s SER 238 Ca 0.51 -0.39 -0.11 0.00 0.70 0.00 0.00 55.95 56.66 1mxh s SER 238 Cb -0.25 0.07 0.08 0.00 -1.71 0.00 0.00 66.02 64.20 1mxh s SER 238 CO 0.63 -0.21 1.09 -1.83 1.20 0.00 0.00 173.24 174.12 1mxh s GLU 239 N -1.13 1.97 0.10 5.44 1.03 -1.26 -4.85 118.70 120.00 1mxh s GLU 239 Ca -0.11 0.72 -0.29 0.00 0.03 0.00 0.00 54.97 55.32 1mxh s GLU 239 Cb -0.08 -1.90 -0.06 0.00 -0.80 0.00 0.00 34.13 31.30 1mxh s GLU 239 CO -0.01 -1.72 0.92 0.00 -1.33 0.00 0.00 175.26 173.12 1mxh s ALA 240 N -3.09 3.27 0.73 -0.84 0.00 0.13 -4.92 121.76 117.04 1mxh s ALA 240 Ca 0.61 0.52 -0.11 0.00 0.00 0.00 0.00 51.96 52.98 1mxh s ALA 240 Cb -0.15 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.78 1mxh s ALA 240 CO 0.55 0.00 1.07 -1.54 0.00 0.00 0.00 175.76 175.84 1mxh s SER 241 N -0.07 5.03 0.34 0.00 1.04 -1.26 -3.27 113.70 115.51 1mxh s SER 241 Ca 0.45 1.65 0.03 0.00 0.48 0.00 0.00 55.95 58.56 1mxh s SER 241 Cb -0.23 -2.46 0.64 0.00 0.10 0.00 0.00 66.02 64.07 1mxh s SER 241 CO 0.28 -1.67 1.96 0.00 0.98 0.00 0.00 173.24 174.79 1mxh h ALA 242 N -0.88 1.60 -0.01 5.32 0.00 -1.96 -2.55 119.26 120.79 1mxh h ALA 242 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1mxh h ALA 242 Cb 1.22 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1mxh h ALA 242 CO 0.55 0.31 0.01 0.00 0.00 0.00 0.00 179.25 180.12 1mxh h ALA 243 N 1.57 0.01 -0.99 0.00 0.00 -1.92 -0.32 119.26 117.61 1mxh h ALA 243 Ca 0.31 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.32 1mxh h ALA 243 Cb 0.13 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.83 1mxh h ALA 243 CO -0.10 -0.47 0.63 1.96 0.00 0.00 0.00 179.25 181.27 1mxh h GLN 244 N -0.01 0.96 -0.40 0.00 4.20 -1.83 0.44 115.11 118.46 1mxh h GLN 244 Ca 0.00 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.51 1mxh h GLN 244 Cb 0.03 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1mxh h GLN 244 CO -0.00 0.63 -0.33 0.82 -0.67 0.00 0.00 178.83 179.28 1mxh h ILE 245 N 0.98 1.27 -0.89 2.54 1.08 -1.33 -2.74 117.51 118.42 1mxh h ILE 245 Ca 0.48 -1.50 0.04 0.00 -0.39 0.00 0.00 64.86 63.49 1mxh h ILE 245 Cb 0.47 1.34 -0.05 0.00 -3.07 0.00 0.00 36.82 35.51 1mxh h ILE 245 CO -0.25 0.50 0.58 0.00 -0.69 0.00 0.00 178.15 178.30 1mxh h ALA 246 N 0.79 1.46 -0.53 1.87 0.00 0.11 -2.14 119.26 120.81 1mxh h ALA 246 Ca 0.07 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.01 1mxh h ALA 246 Cb 0.92 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 1mxh h ALA 246 CO 0.09 0.45 0.21 -0.44 0.00 0.00 0.00 179.25 179.55 1mxh h ASP 247 N 1.09 0.23 -0.30 0.00 3.32 0.03 -0.63 116.42 120.16 1mxh h ASP 247 Ca 0.36 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.46 1mxh h ASP 247 Cb 0.06 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1mxh h ASP 247 CO -0.11 0.15 0.14 0.00 -1.72 0.00 0.00 179.24 177.70 1mxh h ALA 248 N 1.35 0.39 -0.47 3.45 0.00 -1.33 -1.27 119.26 121.37 1mxh h ALA 248 Ca 0.26 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1mxh h ALA 248 Cb 0.27 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1mxh h ALA 248 CO -0.25 -0.05 0.26 0.82 0.00 0.00 0.00 179.25 180.03 1mxh h ILE 249 N 0.35 1.17 -0.68 0.00 2.04 -1.21 -1.05 117.51 118.13 1mxh h ILE 249 Ca 0.10 -0.43 0.05 0.00 1.00 0.00 0.00 64.86 65.59 1mxh h ILE 249 Cb 0.12 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.74 1mxh h ILE 249 CO -0.01 0.18 0.39 0.00 0.00 0.00 0.00 178.15 178.71 1mxh h ALA 250 N 1.10 0.91 -0.04 1.87 0.00 -0.92 -1.04 119.26 121.14 1mxh h ALA 250 Ca 0.17 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1mxh h ALA 250 Cb 0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1mxh h ALA 250 CO -0.03 0.09 0.02 0.35 0.00 0.00 0.00 179.25 179.69 1mxh h PHE 251 N 0.74 0.06 -0.29 0.00 3.57 -0.79 -1.82 116.94 118.41 1mxh h PHE 251 Ca 0.30 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.81 1mxh h PHE 251 Cb 0.15 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1mxh h PHE 251 CO -0.07 0.15 0.20 -0.07 -2.23 0.00 0.00 178.31 176.28 1mxh h LEU 252 N -0.04 0.29 0.00 0.59 3.38 -0.58 -1.97 115.31 116.98 1mxh h LEU 252 Ca 0.02 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1mxh h LEU 252 Cb 0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1mxh h LEU 252 CO -0.00 0.21 -0.41 -0.37 0.09 0.00 0.00 178.44 177.96 1mxh h VAL 253 N 0.34 0.24 -3.84 1.22 -1.51 -1.05 -3.44 116.25 108.20 1mxh h VAL 253 Ca 0.11 -1.35 -0.45 0.00 -1.23 0.00 0.00 66.70 63.78 1mxh h VAL 253 Cb 0.04 2.01 0.16 0.00 -2.13 0.00 0.00 31.29 31.37 1mxh h VAL 253 CO -0.02 0.13 0.18 -0.94 -1.23 0.00 0.00 177.57 175.69 1mxh s SER 254 N -6.08 2.49 0.49 4.19 1.04 -0.70 -4.93 113.70 110.21 1mxh s SER 254 Ca 0.04 1.18 0.26 0.00 0.48 0.00 0.00 55.95 57.91 1mxh s SER 254 Cb 0.07 -1.85 1.27 0.00 0.10 0.00 0.00 66.02 65.61 1mxh s SER 254 CO 0.72 -3.21 1.99 0.50 0.98 0.00 0.00 173.24 174.22 1mxh h LYS 255 N -1.95 0.00 0.00 4.02 1.63 -1.91 -2.51 116.57 115.85 1mxh h LYS 255 Ca -0.55 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.25 1mxh h LYS 255 Cb 1.33 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.96 1mxh h LYS 255 CO 0.57 0.16 0.00 -0.25 -3.45 0.00 0.00 179.45 176.49 1mxh n ASP 256 N -3.58 0.00 -0.58 4.20 9.92 -1.26 -1.69 116.55 123.55 1mxh n ASP 256 Ca -0.01 0.05 0.06 0.00 -0.53 0.00 0.00 54.79 54.35 1mxh n ASP 256 Cb 0.30 -0.24 0.11 0.00 -0.64 0.00 0.00 41.12 40.65 1mxh n ASP 256 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1mxh n ALA 257 N -1.24 2.68 0.21 2.24 0.00 -0.95 -4.85 120.51 118.59 1mxh n ALA 257 Ca 0.06 -2.49 0.14 0.00 0.00 0.00 0.00 53.44 51.15 1mxh n ALA 257 Cb 0.09 -0.46 0.74 0.00 0.00 0.00 0.00 19.45 19.82 1mxh n ALA 257 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1mxh h GLY 258 N 0.50 0.00 -0.94 0.00 0.00 -1.42 -0.62 103.07 100.60 1mxh h GLY 258 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1mxh h GLY 258 CO 0.02 0.00 -0.16 2.98 0.00 0.00 0.00 176.54 179.38 1mxh n TYR 259 N -2.45 0.00 -3.21 5.60 9.36 -1.26 -4.96 117.16 120.23 1mxh n TYR 259 Ca -0.02 0.00 -0.39 0.00 3.32 0.00 0.00 57.90 60.81 1mxh n TYR 259 Cb 0.05 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 38.69 1mxh n TYR 259 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1mxh s ILE 260 N -1.53 5.08 -0.23 2.97 1.01 -0.24 -5.05 121.20 123.21 1mxh s ILE 260 Ca 0.15 1.01 -0.21 0.00 0.00 0.00 0.00 60.65 61.60 1mxh s ILE 260 Cb 0.12 -3.87 0.06 0.00 0.01 0.00 0.00 42.46 38.78 1mxh s ILE 260 CO 0.28 0.15 0.62 0.28 0.00 0.00 0.00 174.94 176.28 1mxh s THR 261 N 1.74 -0.00 -0.00 2.92 -1.32 -1.26 -4.72 115.64 112.99 1mxh s THR 261 Ca 0.25 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.73 1mxh s THR 261 Cb -0.16 -0.87 0.00 0.00 -1.51 0.00 0.00 72.50 69.97 1mxh s THR 261 CO 0.10 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.12 1mxh n GLY 262 N 2.79 0.48 3.78 6.08 0.00 0.26 -4.94 105.19 113.65 1mxh n GLY 262 Ca -0.14 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 1mxh n GLY 262 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mxh s THR 263 N -1.98 4.60 -0.21 2.61 -4.23 -1.26 -4.78 115.64 110.39 1mxh s THR 263 Ca 0.00 -0.70 -0.03 0.00 -1.18 0.00 0.00 61.69 59.78 1mxh s THR 263 Cb 0.00 -3.20 -0.00 0.00 1.34 0.00 0.00 72.50 70.63 1mxh s THR 263 CO 0.00 0.16 -0.07 -0.89 -0.54 0.00 0.00 174.62 173.28 1mxh s THR 264 N -1.37 3.13 -0.41 3.99 2.01 -1.26 -1.32 115.64 120.42 1mxh s THR 264 Ca 0.29 -0.57 -0.17 0.00 0.31 0.00 0.00 61.69 61.54 1mxh s THR 264 Cb -0.12 -2.41 0.02 0.00 0.01 0.00 0.00 72.50 69.99 1mxh s THR 264 CO 0.21 0.45 0.42 -0.22 -0.69 0.00 0.00 174.62 174.79 1mxh s LEU 265 N 1.42 4.81 0.17 4.42 2.96 0.14 -4.94 118.68 127.66 1mxh s LEU 265 Ca 0.05 -0.62 -0.30 0.00 -0.22 0.00 0.00 54.13 53.04 1mxh s LEU 265 Cb -0.14 -2.37 -0.07 0.00 0.50 0.00 0.00 46.19 44.10 1mxh s LEU 265 CO -0.05 -0.54 1.02 -0.75 -1.32 0.00 0.00 176.35 174.71 1mxh s LYS 266 N 2.10 4.68 -0.44 1.98 2.20 -1.26 -0.59 119.74 128.41 1mxh s LYS 266 Ca 0.12 1.59 0.04 0.00 -0.36 0.00 0.00 55.97 57.35 1mxh s LYS 266 Cb -0.17 -3.31 0.17 0.00 -1.51 0.00 0.00 37.83 33.01 1mxh s LYS 266 CO 0.13 0.21 0.35 0.08 -0.36 0.00 0.00 175.35 175.76 1mxh s VAL 267 N -0.36 0.62 -0.01 4.02 1.01 -0.19 -4.90 120.40 120.60 1mxh s VAL 267 Ca 0.47 -2.78 0.01 0.00 0.00 0.00 0.00 61.98 59.67 1mxh s VAL 267 Cb -0.27 -1.43 0.01 0.00 0.00 0.00 0.00 36.38 34.69 1mxh s VAL 267 CO 0.33 -1.20 0.77 -0.90 0.00 0.00 0.00 175.10 174.10 1mxh n ASP 268 N 2.81 0.99 -1.97 3.32 5.75 -1.26 -1.93 116.55 124.26 1mxh n ASP 268 Ca 0.28 -1.58 -0.16 0.00 -0.01 0.00 0.00 54.79 53.32 1mxh n ASP 268 Cb 0.46 -0.03 -0.04 0.00 -1.03 0.00 0.00 41.12 40.48 1mxh n ASP 268 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1mxh n GLY 269 N -0.28 0.46 1.92 6.12 0.00 -1.26 -1.09 105.19 111.06 1mxh n GLY 269 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1mxh n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mxh n GLY 270 N -0.62 0.52 0.19 -0.02 0.00 -1.26 -1.77 105.19 102.24 1mxh n GLY 270 Ca -0.18 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.78 1mxh n GLY 270 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1mxh h LEU 271 N 0.00 0.35 -0.19 0.99 5.85 -1.44 -1.57 115.31 119.30 1mxh h LEU 271 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1mxh h LEU 271 Cb 0.00 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1mxh h LEU 271 CO 0.00 0.25 0.00 0.00 -0.34 0.00 0.00 178.44 178.35 1mxh n ILE 272 N -4.89 1.49 0.51 4.05 3.06 -1.26 -2.61 119.36 119.70 1mxh n ILE 272 Ca 0.03 0.42 0.12 0.00 -2.50 0.00 0.00 62.75 60.83 1mxh n ILE 272 Cb 0.12 -1.34 0.15 0.00 0.54 0.00 0.00 39.64 39.11 1mxh n ILE 272 CO 0.00 0.00 0.00 -0.07 -2.50 0.00 0.00 176.55 173.98 1mxh h LEU 273 N 0.00 0.00 -9.93 9.51 4.07 -1.69 -3.48 115.31 113.80 1mxh h LEU 273 Ca 0.00 -0.19 -0.47 0.00 0.08 0.00 0.00 57.88 57.30 1mxh h LEU 273 Cb 0.11 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1mxh h LEU 273 CO 0.00 0.09 0.37 0.00 -1.08 0.00 0.00 178.44 177.82 1mxh s ALA 274 N -3.19 3.16 0.10 1.53 0.00 -1.07 -5.07 121.76 117.21 1mxh s ALA 274 Ca 0.05 0.58 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 1mxh s ALA 274 Cb 0.13 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 1mxh s ALA 274 CO 0.73 0.03 0.26 1.03 0.00 0.00 0.00 175.76 177.81 1mxh s ARG 275 N -2.30 3.47 0.00 0.00 0.52 -1.26 -5.11 118.95 114.27 1mxh s ARG 275 Ca 0.54 -0.42 0.30 0.00 -0.52 0.00 0.00 55.73 55.63 1mxh s ARG 275 Cb -0.19 -2.98 1.51 0.00 0.52 0.00 0.00 34.95 33.81 1mxh s ARG 275 CO 0.24 0.56 2.01 0.00 0.02 0.00 0.00 175.30 178.13