#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 2.06 -0.06 0.00 0.04 -1.26 -4.72 135.00 131.06 1mxh s PRO 12 Ca 0.00 1.87 0.05 0.00 0.04 0.00 0.00 61.00 62.96 1mxh s PRO 12 Cb 0.00 -1.81 -0.01 0.00 0.04 0.00 0.00 34.50 32.71 1mxh s PRO 12 CO 0.00 -1.92 -0.23 0.00 0.04 0.00 0.00 177.00 174.89 1mxh s ALA 13 N -1.84 2.27 0.11 8.56 0.00 -1.26 -0.14 121.76 129.45 1mxh s ALA 13 Ca 0.77 -1.03 0.10 0.00 0.00 0.00 0.00 51.96 51.79 1mxh s ALA 13 Cb -0.32 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 1mxh s ALA 13 CO 0.46 0.43 -0.24 0.00 0.00 0.00 0.00 175.76 176.40 1mxh s ALA 14 N -0.23 2.11 -0.12 0.00 0.00 0.16 -0.32 121.76 123.37 1mxh s ALA 14 Ca -0.01 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.61 1mxh s ALA 14 Cb -0.13 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 1mxh s ALA 14 CO 0.03 0.46 -0.12 0.08 0.00 0.00 0.00 175.76 176.21 1mxh s VAL 15 N -1.05 3.17 -0.21 0.00 1.01 0.26 0.19 120.40 123.77 1mxh s VAL 15 Ca 0.11 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1mxh s VAL 15 Cb -0.10 -2.32 0.05 0.00 0.00 0.00 0.00 36.38 34.01 1mxh s VAL 15 CO 0.05 0.54 -0.06 -0.63 0.00 0.00 0.00 175.10 174.99 1mxh s ILE 16 N 0.12 1.38 0.33 2.22 1.09 0.34 -0.94 121.20 125.73 1mxh s ILE 16 Ca -0.06 -0.98 -0.27 0.00 -1.10 0.00 0.00 60.65 58.25 1mxh s ILE 16 Cb -0.15 -1.60 -0.09 0.00 -1.06 0.00 0.00 42.46 39.56 1mxh s ILE 16 CO 0.04 0.01 1.01 0.42 -0.10 0.00 0.00 174.94 176.32 1mxh s THR 17 N 1.49 3.89 -1.50 2.92 -4.23 -0.98 -1.50 115.64 115.73 1mxh s THR 17 Ca -0.03 1.64 -0.05 0.00 -1.18 0.00 0.00 61.69 62.07 1mxh s THR 17 Cb -0.17 -3.94 0.02 0.00 1.34 0.00 0.00 72.50 69.74 1mxh s THR 17 CO -0.07 0.20 0.54 0.61 -0.54 0.00 0.00 174.62 175.35 1mxh n GLY 18 N 0.75 -0.52 0.47 3.99 0.00 -0.98 -2.32 105.19 106.59 1mxh n GLY 18 Ca 0.02 0.11 0.06 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.41 0.18 0.18 -0.02 0.00 -0.68 -4.10 105.19 99.34 1mxh n GLY 19 Ca -0.10 -0.30 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 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 3.60 0.55 -2.54 4.61 0.00 -1.85 -2.77 119.26 120.86 1mxh h ALA 20 Ca 0.00 -0.60 -0.24 0.00 0.00 0.00 0.00 54.91 54.07 1mxh h ALA 20 Cb 0.36 -0.05 -0.15 0.00 0.00 0.00 0.00 17.79 17.94 1mxh h ALA 20 CO 0.00 0.75 -0.63 1.03 0.00 0.00 0.00 179.25 180.40 1mxh s ARG 21 N -3.64 1.17 5.51 0.00 0.52 -1.26 -4.52 118.95 116.73 1mxh s ARG 21 Ca -0.06 -1.61 0.00 0.00 -0.52 0.00 0.00 55.73 53.54 1mxh s ARG 21 Cb 0.10 0.21 0.00 0.00 0.52 0.00 0.00 34.95 35.79 1mxh s ARG 21 CO 0.85 -0.36 0.00 0.54 0.02 0.00 0.00 175.30 176.35 1mxh n ARG 22 N -0.25 0.00 -0.13 3.54 1.74 -1.26 -2.45 116.66 117.84 1mxh n ARG 22 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.98 1mxh n ARG 22 Cb 0.66 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 32.08 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 1.27 -0.78 0.55 2.04 -1.92 -2.42 117.51 116.25 1mxh h ILE 23 Ca 0.00 -1.06 -0.00 0.00 1.00 0.00 0.00 64.86 64.80 1mxh h ILE 23 Cb 0.00 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 1mxh h ILE 23 CO 0.00 0.35 0.48 1.23 0.00 0.00 0.00 178.15 180.22 1mxh h GLY 24 N 0.52 1.11 0.95 5.37 0.00 -1.67 -0.46 103.07 108.89 1mxh h GLY 24 Ca 0.11 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1mxh h GLY 24 CO 0.03 0.43 0.17 0.84 0.00 0.00 0.00 176.54 178.01 1mxh h HIS 25 N 1.06 0.51 -0.46 5.60 -0.00 -1.18 -1.48 115.15 119.20 1mxh h HIS 25 Ca 0.28 -0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.54 1mxh h HIS 25 Cb -0.07 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.16 1mxh h HIS 25 CO 0.00 0.43 -0.07 1.03 -0.00 0.00 0.00 177.93 179.32 1mxh h SER 26 N 0.44 0.80 -0.30 3.26 0.87 -1.00 -2.28 113.55 115.34 1mxh h SER 26 Ca 0.12 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.42 1mxh h SER 26 Cb 0.11 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1mxh h SER 26 CO -0.02 0.91 0.04 0.40 -0.53 0.00 0.00 176.83 177.63 1mxh h ILE 27 N 0.74 1.24 -0.54 2.23 2.04 -0.84 -1.12 117.51 121.25 1mxh h ILE 27 Ca 0.13 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 65.17 1mxh h ILE 27 Cb 0.56 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 1mxh h ILE 27 CO 0.03 0.27 0.36 0.00 0.00 0.00 0.00 178.15 178.81 1mxh h ALA 28 N 0.87 0.69 -0.66 1.87 0.00 -1.16 -1.16 119.26 119.71 1mxh h ALA 28 Ca 0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1mxh h ALA 28 Cb 0.36 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1mxh h ALA 28 CO 0.01 0.12 0.26 0.28 0.00 0.00 0.00 179.25 179.92 1mxh h VAL 29 N 0.73 1.24 -0.30 0.00 2.07 -1.32 -1.14 116.25 117.53 1mxh h VAL 29 Ca 0.20 -0.75 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 1mxh h VAL 29 Cb -0.08 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 1mxh h VAL 29 CO -0.05 0.30 0.05 -0.09 0.02 0.00 0.00 177.57 177.80 1mxh h ARG 30 N 0.93 0.50 -0.25 1.57 9.65 -0.84 -0.74 114.38 125.19 1mxh h ARG 30 Ca 0.22 -0.14 -0.10 0.00 -1.10 0.00 0.00 59.98 58.86 1mxh h ARG 30 Cb 0.21 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.72 1mxh h ARG 30 CO -0.02 0.60 -0.27 -0.07 2.80 0.00 0.00 179.97 183.02 1mxh h LEU 31 N 0.32 0.50 -0.70 3.80 3.38 -1.15 -2.69 115.31 118.77 1mxh h LEU 31 Ca 0.09 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1mxh h LEU 31 Cb 0.35 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1mxh h LEU 31 CO 0.01 0.76 0.18 -0.74 0.09 0.00 0.00 178.44 178.73 1mxh h HIS 32 N 0.43 1.17 0.00 1.13 2.76 -0.99 -1.09 115.15 118.55 1mxh h HIS 32 Ca 0.06 -0.14 -0.02 0.00 -2.20 0.00 0.00 60.37 58.07 1mxh h HIS 32 Cb 0.69 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 29.32 1mxh h HIS 32 CO 0.02 0.95 -0.10 1.96 -1.30 0.00 0.00 177.93 179.46 1mxh h GLN 33 N 1.05 0.00 -0.52 5.26 4.20 -0.82 -1.12 115.11 123.16 1mxh h GLN 33 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 1mxh h GLN 33 Cb 0.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1mxh h GLN 33 CO 0.00 0.10 0.00 1.04 -0.67 0.00 0.00 178.83 179.30 1mxh n GLN 34 N -3.73 2.32 -0.08 1.46 6.02 -0.76 -4.89 117.38 117.72 1mxh n GLN 34 Ca -0.02 -1.60 0.00 0.00 -0.01 0.00 0.00 57.00 55.37 1mxh n GLN 34 Cb 0.21 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.97 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 0.95 0.68 3.74 1.08 0.00 -0.43 -5.07 105.19 106.15 1mxh n GLY 35 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.10 3.67 -0.49 1.61 0.08 -0.49 -4.46 117.98 115.80 1mxh s PHE 36 Ca 0.00 1.30 -0.20 0.00 0.12 0.00 0.00 56.93 58.15 1mxh s PHE 36 Cb 0.00 -2.73 0.04 0.00 -0.57 0.00 0.00 43.02 39.76 1mxh s PHE 36 CO 0.00 0.26 0.66 1.03 -0.10 0.00 0.00 175.22 177.07 1mxh s ARG 37 N 0.11 3.19 -0.23 0.44 0.52 0.80 -4.03 118.95 119.76 1mxh s ARG 37 Ca 0.35 -0.67 -0.05 0.00 -0.52 0.00 0.00 55.73 54.84 1mxh s ARG 37 Cb -0.19 -4.05 -0.02 0.00 0.52 0.00 0.00 34.95 31.22 1mxh s ARG 37 CO 0.19 -1.18 0.00 0.14 0.02 0.00 0.00 175.30 174.47 1mxh s VAL 38 N 2.83 3.77 -0.22 3.52 -7.23 -1.09 0.37 120.40 122.36 1mxh s VAL 38 Ca 0.19 -0.36 -0.28 0.00 -1.81 0.00 0.00 61.98 59.73 1mxh s VAL 38 Cb -0.17 -2.73 0.00 0.00 0.56 0.00 0.00 36.38 34.04 1mxh s VAL 38 CO 0.15 0.39 0.97 -0.69 -0.31 0.00 0.00 175.10 175.61 1mxh s VAL 39 N 1.46 4.75 -0.61 1.32 1.01 0.50 -3.65 120.40 125.16 1mxh s VAL 39 Ca 0.05 1.88 -0.17 0.00 0.00 0.00 0.00 61.98 63.74 1mxh s VAL 39 Cb -0.15 -4.25 0.13 0.00 0.00 0.00 0.00 36.38 32.12 1mxh s VAL 39 CO -0.00 -0.12 0.64 -0.69 0.00 0.00 0.00 175.10 174.93 1mxh s VAL 40 N 2.92 5.10 0.37 2.92 1.01 -0.22 -0.51 120.40 131.99 1mxh s VAL 40 Ca 0.42 -1.44 -0.20 0.00 0.00 0.00 0.00 61.98 60.75 1mxh s VAL 40 Cb -0.15 -4.43 -0.10 0.00 0.00 0.00 0.00 36.38 31.69 1mxh s VAL 40 CO 0.08 -1.01 0.88 -2.28 0.00 0.00 0.00 175.10 172.76 1mxh s HIS 41 N 1.86 3.40 0.33 5.22 5.04 -0.56 -1.89 115.29 128.69 1mxh s HIS 41 Ca 0.09 1.51 -0.13 0.00 -1.54 0.00 0.00 55.06 54.99 1mxh s HIS 41 Cb -0.24 -2.76 0.03 0.00 0.04 0.00 0.00 32.58 29.65 1mxh s HIS 41 CO 0.02 0.01 0.65 1.52 -2.34 0.00 0.00 174.74 174.61 1mxh s TYR 42 N -2.01 0.31 0.11 3.88 1.13 -0.58 -1.69 117.35 118.50 1mxh s TYR 42 Ca 0.57 -0.79 0.00 0.00 -1.41 0.00 0.00 57.07 55.44 1mxh s TYR 42 Cb -0.11 0.50 0.00 0.00 -1.10 0.00 0.00 41.96 41.25 1mxh s TYR 42 CO 0.16 -1.31 0.00 -2.13 -2.51 0.00 0.00 175.55 169.76 1mxh n ARG 43 N -0.50 0.00 -0.01 -3.49 0.63 -1.26 -1.32 116.66 110.71 1mxh n ARG 43 Ca -0.04 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.93 1mxh n ARG 43 Cb 0.60 -0.21 -0.08 0.00 0.45 0.00 0.00 32.46 33.22 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 -3.11 0.00 -2.01 -0.14 8.25 -1.26 -4.78 115.22 112.17 1mxh n HIS 44 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.06 1mxh n HIS 44 Cb 0.10 -0.28 -0.00 0.00 1.12 0.00 0.00 29.99 30.93 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 -1.94 7.68 -0.00 0.41 7.64 -1.26 -4.74 113.62 121.41 1mxh n SER 45 Ca -0.04 -3.12 -0.11 0.00 1.01 0.00 0.00 58.87 56.61 1mxh n SER 45 Cb 0.36 -1.38 -0.05 0.00 -1.01 0.00 0.00 64.21 62.12 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 4.77 0.13 -0.04 1.43 4.22 -1.98 -1.44 114.58 121.67 1mxh h GLU 46 Ca 0.67 -0.01 0.04 0.00 0.08 0.00 0.00 59.36 60.14 1mxh h GLU 46 Cb 0.34 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 1mxh h GLU 46 CO 1.51 0.11 -0.29 0.78 -2.18 0.00 0.00 179.01 178.94 1mxh h GLY 47 N 0.11 -0.44 0.67 1.92 0.00 -2.00 -0.36 103.07 102.97 1mxh h GLY 47 Ca 0.03 0.35 0.04 0.00 0.00 0.00 0.00 47.33 47.75 1mxh h GLY 47 CO -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 176.54 176.32 1mxh h ALA 48 N 0.38 0.20 -0.84 3.60 0.00 -1.87 -1.51 119.26 119.21 1mxh h ALA 48 Ca 0.07 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1mxh h ALA 48 Cb 0.52 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 1mxh h ALA 48 CO -0.28 -0.42 0.55 0.00 0.00 0.00 0.00 179.25 179.10 1mxh h ALA 49 N 1.19 1.10 -0.47 0.00 0.00 -0.99 -0.94 119.26 119.15 1mxh h ALA 49 Ca 0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1mxh h ALA 49 Cb 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1mxh h ALA 49 CO -0.17 0.41 0.26 0.37 0.00 0.00 0.00 179.25 180.12 1mxh h GLN 50 N 1.09 0.66 -0.35 0.00 4.15 -0.67 -1.95 115.11 118.02 1mxh h GLN 50 Ca 0.33 -0.08 -0.08 0.00 0.77 0.00 0.00 58.65 59.59 1mxh h GLN 50 Cb -0.04 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.50 1mxh h GLN 50 CO -0.10 0.52 -0.11 0.00 -1.93 0.00 0.00 178.83 177.21 1mxh h ARG 51 N 0.62 0.61 -0.20 1.69 3.08 -0.75 -2.17 114.38 117.25 1mxh h ARG 51 Ca 0.17 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1mxh h ARG 51 Cb 0.06 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 1mxh h ARG 51 CO -0.03 0.71 -0.18 1.25 -1.07 0.00 0.00 179.97 180.65 1mxh h LEU 52 N 0.56 0.52 -0.84 3.04 5.85 -0.96 -1.30 115.31 122.18 1mxh h LEU 52 Ca 0.10 -0.47 -0.05 0.00 0.84 0.00 0.00 57.88 58.31 1mxh h LEU 52 Cb 0.52 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1mxh h LEU 52 CO 0.03 0.87 0.27 0.58 -0.34 0.00 0.00 178.44 179.86 1mxh h VAL 53 N 0.16 1.26 -0.38 1.05 2.07 -1.32 0.09 116.25 119.19 1mxh h VAL 53 Ca 0.03 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 1mxh h VAL 53 Cb 0.72 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1mxh h VAL 53 CO 0.05 0.34 0.08 0.00 0.02 0.00 0.00 177.57 178.05 1mxh h ALA 54 N 1.20 0.50 -0.56 1.67 0.00 -1.36 0.11 119.26 120.81 1mxh h ALA 54 Ca 0.25 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1mxh h ALA 54 Cb 0.25 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1mxh h ALA 54 CO -0.02 0.19 0.33 1.49 0.00 0.00 0.00 179.25 181.24 1mxh h GLU 55 N 0.46 0.63 -0.08 0.00 4.81 -0.80 -0.02 114.58 119.58 1mxh h GLU 55 Ca 0.12 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1mxh h GLU 55 Cb 0.33 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1mxh h GLU 55 CO 0.00 0.42 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.57 1mxh h LEU 56 N 0.65 0.20 -0.97 1.64 3.38 -0.71 -2.94 115.31 116.55 1mxh h LEU 56 Ca 0.23 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1mxh h LEU 56 Cb 0.05 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1mxh h LEU 56 CO -0.11 0.61 0.58 0.78 0.09 0.00 0.00 178.44 180.39 1mxh h ASN 57 N -0.22 1.13 -0.75 -0.43 -0.26 -0.72 -0.85 115.58 113.49 1mxh h ASN 57 Ca 0.02 -0.06 0.16 0.00 -0.56 0.00 0.00 56.30 55.85 1mxh h ASN 57 Cb 0.55 -0.29 -0.05 0.00 -1.06 0.00 0.00 38.32 37.48 1mxh h ASN 57 CO 0.02 0.86 0.50 0.00 -1.06 0.00 0.00 177.43 177.75 1mxh h ALA 58 N 1.33 2.17 0.00 -0.83 0.00 -0.94 0.26 119.26 121.25 1mxh h ALA 58 Ca 0.34 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.18 1mxh h ALA 58 Cb -0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1mxh h ALA 58 CO -0.07 -0.38 -0.74 0.00 0.00 0.00 0.00 179.25 178.07 1mxh h ALA 59 N 1.65 0.69 -1.18 0.00 0.00 -1.03 -3.44 119.26 115.95 1mxh h ALA 59 Ca 0.37 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1mxh h ALA 59 Cb 0.91 0.05 -0.23 0.00 0.00 0.00 0.00 17.79 18.51 1mxh h ALA 59 CO -0.11 0.37 -0.35 1.03 0.00 0.00 0.00 179.25 180.19 1mxh s ARG 60 N -3.13 0.52 0.09 0.00 0.52 0.83 -5.12 118.95 112.67 1mxh s ARG 60 Ca 0.02 0.75 -0.37 0.00 -0.52 0.00 0.00 55.73 55.61 1mxh s ARG 60 Cb 0.08 0.26 -0.17 0.00 0.52 0.00 0.00 34.95 35.64 1mxh s ARG 60 CO 0.76 -0.77 1.30 0.00 0.02 0.00 0.00 175.30 176.60 1mxh n ALA 61 N 5.41 -1.18 -3.10 2.13 0.00 -0.78 -1.87 120.51 121.13 1mxh n ALA 61 Ca 0.00 0.52 -0.23 0.00 0.00 0.00 0.00 53.44 53.74 1mxh n ALA 61 Cb 0.52 -2.04 0.03 0.00 0.00 0.00 0.00 19.45 17.95 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 2.38 -0.52 0.65 0.00 0.00 -1.26 -4.89 105.19 101.56 1mxh n GLY 62 Ca 0.18 0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.41 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 -2.49 2.34 -3.76 1.61 3.41 -0.78 -4.99 113.62 108.96 1mxh n SER 63 Ca -0.09 -1.67 -0.13 0.00 -0.26 0.00 0.00 58.87 56.71 1mxh n SER 63 Cb 0.61 0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.51 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 -1.49 -0.80 0.14 7.33 0.00 -1.26 -2.66 121.76 123.02 1mxh s ALA 64 Ca 0.19 0.68 -0.08 0.00 0.00 0.00 0.00 51.96 52.76 1mxh s ALA 64 Cb 0.14 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 1mxh s ALA 64 CO 0.24 -0.20 0.23 0.54 0.00 0.00 0.00 175.76 176.57 1mxh s VAL 65 N -0.44 0.09 0.29 0.00 0.11 -1.24 -4.86 120.40 114.35 1mxh s VAL 65 Ca -0.06 -1.41 0.11 0.00 -2.93 0.00 0.00 61.98 57.69 1mxh s VAL 65 Cb -0.04 -1.75 -0.05 0.00 -1.53 0.00 0.00 36.38 33.02 1mxh s VAL 65 CO 0.02 -0.41 -0.17 -1.48 -3.33 0.00 0.00 175.10 169.73 1mxh s LEU 66 N -2.95 2.61 -0.15 2.54 2.34 -1.26 -1.06 118.68 120.76 1mxh s LEU 66 Ca 0.15 -1.07 -0.06 0.00 0.06 0.00 0.00 54.13 53.21 1mxh s LEU 66 Cb 0.04 -1.02 0.07 0.00 -0.56 0.00 0.00 46.19 44.72 1mxh s LEU 66 CO -0.02 -0.05 0.31 0.00 -1.06 0.00 0.00 176.35 175.53 1mxh s LYS 68 N 2.22 3.89 -0.29 0.00 2.20 -1.26 -1.53 119.74 124.96 1mxh s LYS 68 Ca -0.02 0.28 -0.16 0.00 -0.36 0.00 0.00 55.97 55.71 1mxh s LYS 68 Cb -0.11 -3.25 0.18 0.00 -1.51 0.00 0.00 37.83 33.14 1mxh s LYS 68 CO -0.10 0.63 1.13 0.20 -0.36 0.00 0.00 175.35 176.85 1mxh s GLY 69 N -0.81 0.34 0.01 5.54 0.00 -0.44 -4.94 107.32 107.02 1mxh s GLY 69 Ca 0.21 3.51 -0.28 0.00 0.00 0.00 0.00 44.72 48.16 1mxh s GLY 69 CO 0.11 2.66 0.90 -0.35 0.00 0.00 0.00 173.10 176.42 1mxh s ASP 70 N 1.15 7.30 -0.12 1.64 2.15 -1.26 -4.50 116.67 123.03 1mxh s ASP 70 Ca -0.08 1.57 0.16 0.00 0.43 0.00 0.00 52.55 54.63 1mxh s ASP 70 Cb -0.03 -2.53 0.62 0.00 -0.30 0.00 0.00 42.92 40.68 1mxh s ASP 70 CO -0.12 -0.17 1.53 0.18 -0.17 0.00 0.00 175.17 176.42 1mxh n LEU 71 N 3.56 4.33 -4.79 -1.34 4.77 -1.26 -4.84 117.00 117.42 1mxh n LEU 71 Ca 0.03 -2.52 -0.31 0.00 -0.03 0.00 0.00 56.01 53.18 1mxh n LEU 71 Cb 0.51 -0.52 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1mxh n LEU 71 CO 0.50 0.76 0.70 -0.44 -1.33 0.00 0.00 177.39 177.59 1mxh s SER 72 N -1.14 4.91 0.21 -1.43 0.01 -1.26 -2.19 113.70 112.81 1mxh s SER 72 Ca 0.45 1.72 -0.30 0.00 1.31 0.00 0.00 55.95 59.13 1mxh s SER 72 Cb 0.30 -2.51 -0.10 0.00 0.21 0.00 0.00 66.02 63.93 1mxh s SER 72 CO 0.19 -1.76 1.43 -0.76 0.41 0.00 0.00 173.24 172.75 1mxh s LEU 73 N -5.75 4.39 0.05 2.44 1.43 0.55 -4.62 118.68 117.17 1mxh s LEU 73 Ca 0.60 2.57 -0.27 0.00 -1.03 0.00 0.00 54.13 55.99 1mxh s LEU 73 Cb -0.16 -3.61 0.10 0.00 0.03 0.00 0.00 46.19 42.55 1mxh s LEU 73 CO 0.56 -0.68 1.19 -0.94 0.23 0.00 0.00 176.35 176.70 1mxh s SER 74 N 0.56 -0.04 0.56 2.29 1.04 -1.26 -4.89 113.70 111.96 1mxh s SER 74 Ca 0.61 -0.32 0.34 0.00 0.48 0.00 0.00 55.95 57.07 1mxh s SER 74 Cb -0.41 0.28 1.49 0.00 0.10 0.00 0.00 66.02 67.48 1mxh s SER 74 CO 0.39 -0.53 2.03 0.77 0.98 0.00 0.00 173.24 176.88 1mxh h SER 75 N 2.00 0.00 0.85 7.02 4.64 -2.04 -2.99 113.55 123.03 1mxh h SER 75 Ca -0.27 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.00 1mxh h SER 75 Cb 1.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1mxh h SER 75 CO 0.31 0.03 -1.18 -1.20 -0.87 0.00 0.00 176.83 173.91 1mxh n SER 76 N -3.15 0.81 -0.28 4.97 7.64 -1.26 -4.50 113.62 117.85 1mxh n SER 76 Ca -0.00 0.33 -0.01 0.00 1.01 0.00 0.00 58.87 60.20 1mxh n SER 76 Cb 0.28 0.44 0.06 0.00 -1.01 0.00 0.00 64.21 63.97 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 0.00 -1.03 -0.31 -3.43 5.85 -1.78 0.74 115.31 115.35 1mxh h LEU 77 Ca -0.05 0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.98 1mxh h LEU 77 Cb 1.18 0.58 -0.06 0.00 0.37 0.00 0.00 40.66 42.73 1mxh h LEU 77 CO 0.01 -0.29 -0.10 0.25 -0.34 0.00 0.00 178.44 177.98 1mxh h LEU 78 N -0.06 -0.36 -0.42 2.25 6.46 -1.79 0.81 115.31 122.21 1mxh h LEU 78 Ca 0.33 0.10 -0.05 0.00 -0.12 0.00 0.00 57.88 58.14 1mxh h LEU 78 Cb 0.58 0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.71 1mxh h LEU 78 CO -0.81 -0.13 0.08 0.44 -0.62 0.00 0.00 178.44 177.40 1mxh h ASP 79 N -0.04 0.66 -0.10 1.25 3.32 -1.54 -2.27 116.42 117.70 1mxh h ASP 79 Ca 0.15 -0.25 0.03 0.00 0.02 0.00 0.00 57.03 56.98 1mxh h ASP 79 Cb 0.27 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 1mxh h ASP 79 CO -0.34 0.74 -0.09 0.00 -1.72 0.00 0.00 179.24 177.83 1mxh h GLU 82 N 0.90 0.95 -0.11 0.00 4.39 -0.76 -2.59 114.58 117.36 1mxh h GLU 82 Ca 0.32 -0.12 -0.10 0.00 0.34 0.00 0.00 59.36 59.81 1mxh h GLU 82 Cb 0.14 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1mxh h GLU 82 CO -0.10 0.72 -0.38 -0.44 -1.16 0.00 0.00 179.01 177.65 1mxh h ASP 83 N 0.92 0.24 -0.46 1.42 3.32 -0.33 0.53 116.42 122.06 1mxh h ASP 83 Ca 0.24 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1mxh h ASP 83 Cb 0.06 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 1mxh h ASP 83 CO -0.04 0.61 0.20 0.40 -1.72 0.00 0.00 179.24 178.69 1mxh h ILE 84 N 0.20 1.20 -0.23 0.35 2.04 -0.85 0.29 117.51 120.51 1mxh h ILE 84 Ca 0.02 -0.59 -0.18 0.00 1.00 0.00 0.00 64.86 65.12 1mxh h ILE 84 Cb 0.76 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1mxh h ILE 84 CO 0.06 0.22 -0.57 0.40 0.00 0.00 0.00 178.15 178.26 1mxh h ILE 85 N 0.60 1.30 -0.61 -0.67 1.08 -1.31 -2.94 117.51 114.95 1mxh h ILE 85 Ca 0.16 -1.80 0.02 0.00 -0.39 0.00 0.00 64.86 62.85 1mxh h ILE 85 Cb 0.16 1.74 -0.03 0.00 -3.07 0.00 0.00 36.82 35.61 1mxh h ILE 85 CO -0.02 0.57 0.41 -0.78 -0.69 0.00 0.00 178.15 177.64 1mxh h ASP 86 N 0.54 0.67 -0.73 1.72 3.58 -0.46 -2.21 116.42 119.53 1mxh h ASP 86 Ca 0.00 -0.01 0.07 0.00 0.42 0.00 0.00 57.03 57.52 1mxh h ASP 86 Cb 1.16 -0.16 -0.06 0.00 1.72 0.00 0.00 39.33 41.98 1mxh h ASP 86 CO 0.12 0.47 0.40 0.00 -2.88 0.00 0.00 179.24 177.35 1mxh h SER 88 N 0.71 0.62 1.18 0.00 0.87 -1.45 -1.23 113.55 114.24 1mxh h SER 88 Ca 0.34 -0.09 -0.10 0.00 -1.23 0.00 0.00 61.79 60.72 1mxh h SER 88 Cb 0.27 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1mxh h SER 88 CO -0.22 0.60 -0.46 -0.26 -0.53 0.00 0.00 176.83 175.97 1mxh h PHE 89 N 0.66 0.00 0.20 2.24 0.04 -1.10 -0.78 116.94 118.20 1mxh h PHE 89 Ca 0.15 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.61 1mxh h PHE 89 Cb 0.21 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.38 1mxh h PHE 89 CO 0.01 0.46 -1.40 0.00 -0.60 0.00 0.00 178.31 176.78 1mxh h ARG 90 N 0.00 0.42 0.00 1.51 3.08 -0.47 -1.21 114.38 117.70 1mxh h ARG 90 Ca -0.00 -0.71 -0.06 0.00 0.07 0.00 0.00 59.98 59.27 1mxh h ARG 90 Cb 1.17 0.27 -0.01 0.00 0.08 0.00 0.00 29.97 31.47 1mxh h ARG 90 CO 0.06 1.34 -1.36 0.00 -1.07 0.00 0.00 179.97 178.94 1mxh n ALA 91 N -2.65 2.37 -0.45 0.04 0.00 -0.51 -4.55 120.51 114.76 1mxh n ALA 91 Ca -0.14 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1mxh n ALA 91 Cb 1.07 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1mxh n ALA 91 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1mxh n PHE 92 N -2.66 0.00 -1.53 0.00 3.72 -0.31 -5.02 117.46 111.66 1mxh n PHE 92 Ca -0.05 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.19 1mxh n PHE 92 Cb 0.66 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 39.13 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 0.11 1.47 3.62 1.37 0.00 -0.46 -4.92 105.19 106.37 1mxh n GLY 93 Ca 0.00 -0.26 -0.01 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 -3.47 0.42 -0.26 1.61 1.70 -1.23 -4.92 118.95 112.80 1mxh s ARG 94 Ca 0.00 -0.21 -0.03 0.00 -0.47 0.00 0.00 55.73 55.02 1mxh s ARG 94 Cb 0.00 0.16 0.14 0.00 -0.57 0.00 0.00 34.95 34.68 1mxh s ARG 94 CO 0.00 -0.19 0.46 0.00 -1.08 0.00 0.00 175.30 174.49 1mxh n ASP 96 N 5.39 1.01 -3.91 0.00 9.92 0.57 -4.94 116.55 124.58 1mxh n ASP 96 Ca -0.04 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 54.07 1mxh n ASP 96 Cb 0.50 1.48 -0.15 0.00 -0.64 0.00 0.00 41.12 42.31 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 -2.92 0.29 -0.12 2.53 1.01 -0.97 -1.82 120.40 118.40 1mxh s VAL 97 Ca -0.07 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1mxh s VAL 97 Cb 0.09 -0.27 0.02 0.00 0.00 0.00 0.00 36.38 36.21 1mxh s VAL 97 CO 0.70 0.10 -0.14 -0.22 0.00 0.00 0.00 175.10 175.55 1mxh s LEU 98 N 0.14 1.63 -0.31 3.92 2.96 -0.99 -0.57 118.68 125.46 1mxh s LEU 98 Ca -0.01 -0.42 -0.00 0.00 -0.22 0.00 0.00 54.13 53.48 1mxh s LEU 98 Cb -0.04 -1.07 0.06 0.00 0.50 0.00 0.00 46.19 45.64 1mxh s LEU 98 CO -0.00 -0.02 0.00 -0.69 -1.32 0.00 0.00 176.35 174.31 1mxh s VAL 99 N 1.22 2.76 -1.26 1.68 1.01 -0.11 -0.64 120.40 125.07 1mxh s VAL 99 Ca -0.02 -1.61 -0.16 0.00 0.00 0.00 0.00 61.98 60.19 1mxh s VAL 99 Cb -0.14 -2.68 0.11 0.00 0.00 0.00 0.00 36.38 33.68 1mxh s VAL 99 CO -0.05 -0.20 1.62 0.59 0.00 0.00 0.00 175.10 177.06 1mxh n ASN 100 N 4.54 5.05 -0.10 3.32 5.03 -0.35 -2.31 115.26 130.43 1mxh n ASN 100 Ca -0.10 -2.95 -0.13 0.00 0.87 0.00 0.00 54.58 52.27 1mxh n ASN 100 Cb 0.43 -1.67 -0.15 0.00 -1.02 0.00 0.00 39.78 37.37 1mxh n ASN 100 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1mxh n ASN 101 N 7.17 0.75 -4.59 6.41 2.85 -1.25 -1.74 115.26 124.85 1mxh n ASN 101 Ca 0.44 -0.01 -0.47 0.00 -0.11 0.00 0.00 54.58 54.43 1mxh n ASN 101 Cb 0.44 0.43 -0.03 0.00 1.24 0.00 0.00 39.78 41.86 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 -2.91 -0.41 -3.64 5.20 0.00 -0.98 -4.89 120.51 112.89 1mxh n ALA 102 Ca -0.36 0.44 -0.04 0.00 0.00 0.00 0.00 53.44 53.47 1mxh n ALA 102 Cb 1.10 -2.05 -0.07 0.00 0.00 0.00 0.00 19.45 18.43 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 -0.11 -0.74 0.22 0.00 0.15 -1.26 -4.45 113.70 107.51 1mxh s SER 103 Ca 0.69 1.18 -0.15 0.00 0.70 0.00 0.00 55.95 58.37 1mxh s SER 103 Cb -0.79 1.35 -0.08 0.00 -1.71 0.00 0.00 66.02 64.79 1mxh s SER 103 CO 0.54 -0.18 0.63 0.00 1.20 0.00 0.00 173.24 175.43 1mxh s ALA 104 N 1.57 3.48 -0.24 5.45 0.00 -1.26 -5.03 121.76 125.72 1mxh s ALA 104 Ca -0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 51.96 51.78 1mxh s ALA 104 Cb -0.05 -2.63 0.13 0.00 0.00 0.00 0.00 23.12 20.58 1mxh s ALA 104 CO -0.18 0.41 0.42 -0.47 0.00 0.00 0.00 175.76 175.94 1mxh s TYR 105 N -1.68 -0.93 -0.04 0.00 5.04 -1.26 -4.89 117.35 113.60 1mxh s TYR 105 Ca 0.45 1.09 -0.30 0.00 -2.44 0.00 0.00 57.07 55.87 1mxh s TYR 105 Cb -0.13 0.15 0.11 0.00 0.35 0.00 0.00 41.96 42.43 1mxh s TYR 105 CO 0.20 -0.70 0.94 1.52 -1.34 0.00 0.00 175.55 176.17 1mxh s TYR 106 N 2.60 -0.31 0.56 4.97 -0.85 -1.26 -5.17 117.35 117.89 1mxh s TYR 106 Ca 0.11 0.19 -0.20 0.00 -0.52 0.00 0.00 57.07 56.66 1mxh s TYR 106 Cb -0.15 0.53 -0.05 0.00 0.38 0.00 0.00 41.96 42.68 1mxh s TYR 106 CO -0.16 -0.49 1.18 -1.25 -1.52 0.00 0.00 175.55 173.31 1mxh s PRO 107 N -3.00 3.22 -0.41 -3.49 0.04 -1.26 -4.74 135.00 125.35 1mxh s PRO 107 Ca 0.06 1.75 0.08 0.00 0.04 0.00 0.00 61.00 62.93 1mxh s PRO 107 Cb -0.01 -2.02 0.27 0.00 0.04 0.00 0.00 34.50 32.78 1mxh s PRO 107 CO -0.08 -0.99 0.70 0.25 0.04 0.00 0.00 177.00 176.92 1mxh n THR 108 N -1.33 -0.37 -1.72 1.26 -2.24 0.10 -5.00 114.28 104.98 1mxh n THR 108 Ca 0.12 -3.34 -0.42 0.00 -2.27 0.00 0.00 64.05 58.14 1mxh n THR 108 Cb 0.50 -0.52 -0.01 0.00 -2.10 0.00 0.00 70.33 68.20 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 1.13 2.36 0.07 -0.78 -0.04 -1.17 -4.35 135.00 132.22 1mxh n PRO 109 Ca 0.18 0.83 -0.05 0.00 -0.04 0.00 0.00 63.50 64.42 1mxh n PRO 109 Cb 0.59 -2.50 0.14 0.00 -0.04 0.00 0.00 33.50 31.70 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 3.20 0.34 -8.92 1.53 3.38 -2.01 -3.43 115.31 109.40 1mxh h LEU 110 Ca -0.47 -0.17 -0.69 0.00 0.09 0.00 0.00 57.88 56.64 1mxh h LEU 110 Cb 1.26 -0.10 -0.23 0.00 0.09 0.00 0.00 40.66 41.69 1mxh h LEU 110 CO 0.67 0.80 -0.76 -0.76 0.09 0.00 0.00 178.44 178.48 1mxh s LEU 111 N -8.13 2.81 0.16 1.67 2.01 -1.26 -5.24 118.68 110.71 1mxh s LEU 111 Ca -0.05 -0.17 -0.34 0.00 0.01 0.00 0.00 54.13 53.58 1mxh s LEU 111 Cb 0.12 -1.58 -0.15 0.00 0.01 0.00 0.00 46.19 44.59 1mxh s LEU 111 CO 0.80 0.33 1.33 -2.65 1.01 0.00 0.00 176.35 177.17 1mxh n PRO 112 N 2.40 1.51 -2.93 1.29 -0.02 -1.26 -5.16 135.00 130.82 1mxh n PRO 112 Ca -0.17 0.54 -0.40 0.00 -2.02 0.00 0.00 63.50 61.45 1mxh n PRO 112 Cb 0.52 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 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 0.04 4.52 0.11 0.52 0.04 -1.26 -5.13 135.00 133.84 1mxh s PRO 124 Ca 0.76 1.13 -0.33 0.00 0.04 0.00 0.00 61.00 62.59 1mxh s PRO 124 Cb -0.81 -3.38 -0.12 0.00 0.04 0.00 0.00 34.50 30.23 1mxh s PRO 124 CO 0.48 0.23 1.57 0.97 0.04 0.00 0.00 177.00 180.29 1mxh h ILE 125 N 4.21 0.07 0.00 0.56 6.09 -2.03 -0.73 117.51 125.68 1mxh h ILE 125 Ca -0.43 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.05 1mxh h ILE 125 Cb 1.21 0.07 -0.00 0.00 0.47 0.00 0.00 36.82 38.56 1mxh h ILE 125 CO 0.72 0.00 -0.03 -2.24 -3.07 0.00 0.00 178.15 173.53 1mxh h ASP 126 N -0.72 0.00 0.91 2.19 3.04 -2.05 0.45 116.42 120.24 1mxh h ASP 126 Ca 0.01 0.00 -0.12 0.00 -3.24 0.00 0.00 57.03 53.68 1mxh h ASP 126 Cb 0.73 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.01 1mxh h ASP 126 CO -0.27 0.03 -0.57 0.00 -2.04 0.00 0.00 179.24 176.39 1mxh h ALA 127 N 1.97 0.82 -0.06 4.15 0.00 -1.79 0.16 119.26 124.52 1mxh h ALA 127 Ca -0.00 -0.52 -0.22 0.00 0.00 0.00 0.00 54.91 54.17 1mxh h ALA 127 Cb 0.08 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.79 1mxh h ALA 127 CO 0.00 0.72 -0.82 1.96 0.00 0.00 0.00 179.25 181.11 1mxh h GLN 128 N 0.00 0.66 -0.86 0.00 4.20 0.12 -2.40 115.11 116.82 1mxh h GLN 128 Ca -0.01 -0.63 0.01 0.00 0.06 0.00 0.00 58.65 58.08 1mxh h GLN 128 Cb 1.19 0.16 -0.04 0.00 0.30 0.00 0.00 27.48 29.08 1mxh h GLN 128 CO 0.07 1.24 0.56 0.28 -0.67 0.00 0.00 178.83 180.32 1mxh h VAL 129 N 0.32 1.22 -0.69 -0.54 2.07 -0.39 0.18 116.25 118.42 1mxh h VAL 129 Ca -0.09 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 66.95 1mxh h VAL 129 Cb 1.48 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1mxh h VAL 129 CO 0.16 0.22 0.18 0.00 0.02 0.00 0.00 177.57 178.15 1mxh h ALA 130 N 1.45 1.00 0.19 1.67 0.00 -0.83 -0.86 119.26 121.88 1mxh h ALA 130 Ca 0.32 -0.24 -0.31 0.00 0.00 0.00 0.00 54.91 54.68 1mxh h ALA 130 Cb -0.12 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 17.42 1mxh h ALA 130 CO -0.07 0.65 -1.38 1.49 0.00 0.00 0.00 179.25 179.94 1mxh h GLU 131 N 1.05 0.39 -0.04 0.00 4.81 -0.87 0.17 114.58 120.09 1mxh h GLU 131 Ca 0.22 -0.67 -0.08 0.00 -0.13 0.00 0.00 59.36 58.70 1mxh h GLU 131 Cb 0.35 0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.99 1mxh h GLU 131 CO -0.00 1.32 -0.27 -0.07 -0.73 0.00 0.00 179.01 179.26 1mxh h LEU 132 N 0.11 0.31 -0.39 1.64 3.38 -0.65 -3.02 115.31 116.69 1mxh h LEU 132 Ca -0.20 -0.68 -0.18 0.00 0.09 0.00 0.00 57.88 56.91 1mxh h LEU 132 Cb 2.07 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.71 1mxh h LEU 132 CO 0.23 0.94 -0.80 -0.26 0.09 0.00 0.00 178.44 178.64 1mxh h PHE 133 N -0.30 0.23 0.75 1.13 -1.00 -1.31 -2.66 116.94 113.78 1mxh h PHE 133 Ca -0.02 -0.12 -0.04 0.00 2.81 0.00 0.00 57.97 60.60 1mxh h PHE 133 Cb 0.94 -0.03 0.01 0.00 3.61 0.00 0.00 35.95 40.48 1mxh h PHE 133 CO 0.14 0.89 -0.36 0.78 -1.61 0.00 0.00 178.31 178.16 1mxh h GLY 134 N 1.88 -1.05 1.01 -1.45 0.00 -1.53 0.19 103.07 102.13 1mxh h GLY 134 Ca -0.03 0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.68 1mxh h GLY 134 CO 0.12 -0.38 0.45 1.48 0.00 0.00 0.00 176.54 178.21 1mxh h SER 135 N -1.21 0.99 1.19 0.19 4.64 -1.30 0.18 113.55 118.22 1mxh h SER 135 Ca -0.10 -0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.10 1mxh h SER 135 Cb 0.77 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 1mxh h SER 135 CO 0.17 0.79 -0.83 0.78 -0.87 0.00 0.00 176.83 176.86 1mxh h ASN 136 N 1.10 0.00 0.00 4.97 2.35 -1.58 -3.42 115.58 119.01 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 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1mxh h ASN 136 CO -0.05 0.12 -0.08 0.00 -1.65 0.00 0.00 177.43 175.77 1mxh n ALA 137 N -2.20 3.00 -0.13 -0.83 0.00 -0.74 -4.50 120.51 115.12 1mxh n ALA 137 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.32 1mxh n ALA 137 Cb 0.60 0.06 -0.02 0.00 0.00 0.00 0.00 19.45 20.09 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 1.28 -0.04 0.00 2.07 -0.54 -2.22 116.25 116.80 1mxh h VAL 138 Ca 0.00 -1.19 -0.00 0.00 0.82 0.00 0.00 66.70 66.33 1mxh h VAL 138 Cb 0.08 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1mxh h VAL 138 CO 0.00 0.40 0.02 0.00 0.02 0.00 0.00 177.57 178.01 1mxh h ALA 139 N 0.83 0.05 -0.89 1.67 0.00 -0.86 0.01 119.26 120.08 1mxh h ALA 139 Ca 0.10 -0.04 0.15 0.00 0.00 0.00 0.00 54.91 55.11 1mxh h ALA 139 Cb 0.63 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.31 1mxh h ALA 139 CO 0.04 -0.41 0.48 -1.35 0.00 0.00 0.00 179.25 178.01 1mxh h PRO 140 N -0.02 0.66 0.38 0.00 0.11 -1.75 0.79 132.00 132.18 1mxh h PRO 140 Ca 0.01 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 1mxh h PRO 140 Cb 0.08 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.04 1mxh h PRO 140 CO -0.00 0.44 -0.18 1.25 -0.21 0.00 0.00 178.00 179.29 1mxh h LEU 141 N 0.68 -0.43 -1.39 2.35 5.85 -0.87 0.23 115.31 121.72 1mxh h LEU 141 Ca 0.48 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.18 1mxh h LEU 141 Cb 0.67 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 1mxh h LEU 141 CO -0.36 -0.29 0.11 -0.26 -0.34 0.00 0.00 178.44 177.30 1mxh h PHE 142 N -0.53 0.51 -0.25 1.25 0.04 0.21 -0.80 116.94 117.38 1mxh h PHE 142 Ca -0.05 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.60 1mxh h PHE 142 Cb 0.40 -0.16 -0.00 0.00 2.20 0.00 0.00 35.95 38.39 1mxh h PHE 142 CO -0.04 0.44 -0.21 -0.07 -0.60 0.00 0.00 178.31 177.82 1mxh h LEU 143 N 0.51 0.61 -0.82 1.54 3.38 0.89 -1.32 115.31 120.10 1mxh h LEU 143 Ca 0.12 -0.46 -0.08 0.00 0.09 0.00 0.00 57.88 57.56 1mxh h LEU 143 Cb 0.17 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1mxh h LEU 143 CO -0.01 0.95 0.05 0.40 0.09 0.00 0.00 178.44 179.92 1mxh h ILE 144 N 0.29 1.25 0.03 1.22 2.04 -0.30 0.29 117.51 122.33 1mxh h ILE 144 Ca 0.04 -1.01 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 1mxh h ILE 144 Cb 0.76 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1mxh h ILE 144 CO 0.05 0.37 -0.01 -0.09 0.00 0.00 0.00 178.15 178.47 1mxh h ARG 145 N 0.88 -0.04 -0.09 2.37 2.43 -1.05 -0.42 114.38 118.46 1mxh h ARG 145 Ca 0.17 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1mxh h ARG 145 Cb 0.44 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1mxh h ARG 145 CO 0.02 0.02 0.04 0.00 -1.51 0.00 0.00 179.97 178.54 1mxh h ALA 146 N 0.87 0.12 -0.32 2.80 0.00 -1.09 -2.31 119.26 119.33 1mxh h ALA 146 Ca -0.00 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.89 1mxh h ALA 146 Cb 0.08 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 1mxh h ALA 146 CO 0.01 -0.31 -0.18 0.35 0.00 0.00 0.00 179.25 179.11 1mxh h PHE 147 N 0.00 -0.46 -0.57 0.00 3.04 -0.78 -1.85 116.94 116.32 1mxh h PHE 147 Ca 0.03 0.04 -0.07 0.00 3.98 0.00 0.00 57.97 61.95 1mxh h PHE 147 Cb 0.14 0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.88 1mxh h PHE 147 CO -0.02 -0.26 0.08 0.00 -2.02 0.00 0.00 178.31 176.08 1mxh h ALA 148 N 1.06 1.06 0.00 2.41 0.00 -1.04 -2.88 119.26 119.86 1mxh h ALA 148 Ca 0.16 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1mxh h ALA 148 Cb 0.40 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1mxh h ALA 148 CO -0.41 0.60 -0.25 0.00 0.00 0.00 0.00 179.25 179.20 1mxh h ARG 149 N 0.87 0.00 -0.01 0.00 3.08 -0.88 -2.97 114.38 114.47 1mxh h ARG 149 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1mxh h ARG 149 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1mxh h ARG 149 CO 0.01 0.25 -0.08 0.54 -1.07 0.00 0.00 179.97 179.62 1mxh n ARG 150 N -3.67 1.31 -0.77 0.04 1.74 -0.74 -5.11 116.66 109.46 1mxh n ARG 150 Ca -0.01 -0.71 -0.12 0.00 -0.77 0.00 0.00 57.85 56.24 1mxh n ARG 150 Cb 0.37 -1.49 0.08 0.00 -1.02 0.00 0.00 32.46 30.40 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 -0.22 -0.48 0.00 5.56 1.13 -1.13 -5.03 117.38 117.21 1mxh n GLN 151 Ca 0.17 -0.82 0.00 0.00 -1.94 0.00 0.00 57.00 54.41 1mxh n GLN 151 Cb 0.33 -0.53 0.00 0.00 0.11 0.00 0.00 30.24 30.15 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 -3.33 0.00 0.00 1.08 7.64 -1.26 -5.08 113.62 112.68 1mxh n SER 159 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1mxh n SER 159 Cb 0.23 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 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 0.00 3.99 -3.48 1.43 1.85 -1.26 -5.12 116.66 114.07 1mxh n ARG 160 Ca 0.00 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.57 1mxh n ARG 160 Cb 0.00 0.00 -0.11 0.00 -1.05 0.00 0.00 32.46 31.30 1mxh n ARG 160 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1mxh s ASN 161 N 0.91 2.57 0.01 2.89 3.84 -1.26 -5.12 114.94 118.77 1mxh s ASN 161 Ca 0.00 -2.61 -0.21 0.00 0.21 0.00 0.00 52.86 50.25 1mxh s ASN 161 Cb 0.00 -0.53 -0.05 0.00 -0.55 0.00 0.00 41.25 40.12 1mxh s ASN 161 CO 0.00 -0.25 0.63 -0.76 -2.79 0.00 0.00 177.10 173.93 1mxh s LEU 162 N 0.54 4.43 0.05 3.21 1.43 -1.26 -4.78 118.68 122.29 1mxh s LEU 162 Ca 0.23 1.22 -0.27 0.00 -1.03 0.00 0.00 54.13 54.28 1mxh s LEU 162 Cb -0.13 -2.98 0.08 0.00 0.03 0.00 0.00 46.19 43.19 1mxh s LEU 162 CO -0.07 0.09 0.68 -0.94 0.23 0.00 0.00 176.35 176.34 1mxh s SER 163 N -0.20 -0.57 0.05 2.29 1.04 -0.76 -2.04 113.70 113.52 1mxh s SER 163 Ca 0.32 0.29 0.09 0.00 0.48 0.00 0.00 55.95 57.13 1mxh s SER 163 Cb -0.19 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.44 1mxh s SER 163 CO 0.18 -0.76 -0.25 -0.69 0.98 0.00 0.00 173.24 172.70 1mxh s VAL 164 N -2.58 2.01 -0.08 5.02 1.01 0.21 -2.35 120.40 123.63 1mxh s VAL 164 Ca -0.03 -1.38 -0.01 0.00 0.00 0.00 0.00 61.98 60.56 1mxh s VAL 164 Cb -0.01 -1.73 0.03 0.00 0.00 0.00 0.00 36.38 34.67 1mxh s VAL 164 CO -0.03 0.28 -0.02 -0.69 0.00 0.00 0.00 175.10 174.64 1mxh s VAL 165 N -0.84 0.50 -0.11 2.92 1.01 0.19 -1.33 120.40 122.75 1mxh s VAL 165 Ca 0.11 0.03 -0.09 0.00 0.00 0.00 0.00 61.98 62.03 1mxh s VAL 165 Cb -0.10 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 1mxh s VAL 165 CO 0.02 0.28 0.19 0.20 0.00 0.00 0.00 175.10 175.79 1mxh s ASN 166 N 1.84 6.45 -0.33 3.32 0.01 0.44 -1.21 114.94 125.45 1mxh s ASN 166 Ca 0.04 0.54 -0.22 0.00 -0.71 0.00 0.00 52.86 52.50 1mxh s ASN 166 Cb -0.12 -2.10 0.00 0.00 0.41 0.00 0.00 41.25 39.43 1mxh s ASN 166 CO -0.05 0.37 0.71 -0.76 -1.51 0.00 0.00 177.10 175.86 1mxh s LEU 167 N -0.89 4.15 0.00 0.60 2.01 -0.71 -1.16 118.68 122.68 1mxh s LEU 167 Ca 0.16 0.39 0.00 0.00 0.01 0.00 0.00 54.13 54.70 1mxh s LEU 167 Cb -0.13 -2.93 0.00 0.00 0.01 0.00 0.00 46.19 43.14 1mxh s LEU 167 CO 0.05 -0.61 0.00 0.00 1.01 0.00 0.00 176.35 176.80 1mxh s ASP 169 N -0.75 0.34 0.48 0.00 -1.08 -1.26 -4.04 116.67 110.36 1mxh s ASP 169 Ca 0.00 0.11 0.18 0.00 -0.52 0.00 0.00 52.55 52.31 1mxh s ASP 169 Cb 0.00 1.07 1.18 0.00 -1.46 0.00 0.00 42.92 43.71 1mxh s ASP 169 CO 0.00 -0.31 2.00 0.00 0.52 0.00 0.00 175.17 177.38 1mxh h ALA 170 N 8.19 2.18 0.00 3.66 0.00 -1.21 -2.62 119.26 129.45 1mxh h ALA 170 Ca -0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1mxh h ALA 170 Cb 1.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1mxh h ALA 170 CO 0.27 -0.30 0.00 -1.33 0.00 0.00 0.00 179.25 177.89 1mxh n MET 171 N -4.45 0.09 0.00 0.00 2.81 -1.26 -4.00 117.12 110.30 1mxh n MET 171 Ca 0.08 0.01 0.01 0.00 -1.81 0.00 0.00 57.70 55.99 1mxh n MET 171 Cb 0.42 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.50 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 -1.46 0.54 0.30 2.03 -2.24 -0.99 0.32 114.28 112.79 1mxh n THR 172 Ca 0.08 0.14 0.12 0.00 -2.27 0.00 0.00 64.05 62.12 1mxh n THR 172 Cb 0.31 -1.10 0.15 0.00 -2.10 0.00 0.00 70.33 67.60 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 -2.35 3.42 3.32 -1.83 -3.32 116.42 115.65 1mxh h ASP 173 Ca 0.00 -0.04 -0.63 0.00 0.02 0.00 0.00 57.03 56.39 1mxh h ASP 173 Cb 0.01 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.16 1mxh h ASP 173 CO 0.00 0.02 -0.43 0.18 -1.72 0.00 0.00 179.24 177.28 1mxh n LEU 174 N -2.68 4.02 -4.27 1.55 4.77 0.15 -5.06 117.00 115.47 1mxh n LEU 174 Ca 0.03 -5.40 -0.61 0.00 -0.03 0.00 0.00 56.01 50.00 1mxh n LEU 174 Cb 0.51 -0.75 -0.11 0.00 -2.33 0.00 0.00 43.42 40.74 1mxh n LEU 174 CO 0.36 1.99 1.50 -2.65 -1.33 0.00 0.00 177.39 177.25 1mxh n PRO 175 N 1.00 0.00 -1.92 3.23 -0.02 -1.25 -4.84 135.00 131.20 1mxh n PRO 175 Ca 0.29 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 1mxh n PRO 175 Cb 0.40 -1.45 -0.03 0.00 -0.02 0.00 0.00 33.50 32.40 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 4.88 4.29 0.14 2.45 2.96 -1.26 -4.89 118.68 127.24 1mxh s LEU 176 Ca 1.12 2.28 -0.35 0.00 -0.22 0.00 0.00 54.13 56.96 1mxh s LEU 176 Cb -1.45 -3.53 -0.16 0.00 0.50 0.00 0.00 46.19 41.55 1mxh s LEU 176 CO 0.69 -1.02 1.26 -2.65 -1.32 0.00 0.00 176.35 173.32 1mxh n PRO 177 N 7.32 1.21 -0.25 0.98 -0.02 -1.26 -1.56 135.00 141.43 1mxh n PRO 177 Ca 0.18 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1mxh n PRO 177 Cb 0.43 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 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 2.29 1.08 1.78 -1.23 0.00 -1.26 -4.93 105.19 102.92 1mxh n GLY 178 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.00 2.25 -0.14 1.61 3.01 -0.60 0.02 117.46 121.61 1mxh n PHE 179 Ca 0.00 -2.18 -0.12 0.00 1.01 0.00 0.00 57.45 56.15 1mxh n PHE 179 Cb 0.00 -0.60 -0.08 0.00 -0.01 0.00 0.00 39.48 38.79 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 -0.37 1.20 -0.65 0.00 2.07 -1.89 0.79 116.25 117.40 1mxh h VAL 181 Ca 0.10 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1mxh h VAL 181 Cb 0.59 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1mxh h VAL 181 CO -0.60 0.20 0.37 0.22 0.02 0.00 0.00 177.57 177.78 1mxh h TYR 182 N 1.01 0.88 -0.26 1.57 3.20 -1.77 -0.98 116.97 120.61 1mxh h TYR 182 Ca 0.27 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.12 1mxh h TYR 182 Cb -0.08 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 37.89 1mxh h TYR 182 CO -0.02 0.61 0.13 1.15 -1.64 0.00 0.00 178.16 178.39 1mxh h THR 183 N 0.89 1.14 -0.75 1.81 2.02 -0.28 -1.74 112.91 116.00 1mxh h THR 183 Ca 0.23 -0.40 0.04 0.00 0.77 0.00 0.00 66.41 67.05 1mxh h THR 183 Cb 0.01 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 1mxh h THR 183 CO -0.04 0.14 0.46 0.24 0.37 0.00 0.00 175.52 176.69 1mxh h MET 184 N 0.29 0.85 -0.45 6.66 2.86 -0.64 -1.51 114.93 122.99 1mxh h MET 184 Ca 0.09 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1mxh h MET 184 Cb 0.11 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 1mxh h MET 184 CO -0.01 0.56 0.19 0.00 1.06 0.00 0.00 176.91 178.71 1mxh h ALA 185 N 1.34 0.59 -0.70 6.32 0.00 -0.80 -1.12 119.26 124.88 1mxh h ALA 185 Ca 0.31 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1mxh h ALA 185 Cb 0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1mxh h ALA 185 CO -0.14 0.18 0.25 0.87 0.00 0.00 0.00 179.25 180.41 1mxh h LYS 186 N 0.59 1.05 -0.85 0.00 1.79 -1.01 -0.99 116.57 117.14 1mxh h LYS 186 Ca 0.15 -0.20 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 1mxh h LYS 186 Cb 0.17 -0.17 -0.04 0.00 -1.58 0.00 0.00 32.23 30.61 1mxh h LYS 186 CO -0.01 0.88 0.51 0.45 -1.08 0.00 0.00 179.45 180.19 1mxh h HIS 187 N 1.02 1.13 -0.65 -1.35 3.86 -0.95 -0.82 115.15 117.39 1mxh h HIS 187 Ca 0.23 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.40 1mxh h HIS 187 Cb 0.24 -0.37 -0.03 0.00 1.06 0.00 0.00 27.41 28.31 1mxh h HIS 187 CO 0.02 0.76 0.28 0.00 0.86 0.00 0.00 177.93 179.84 1mxh h ALA 188 N 1.28 1.25 -0.65 2.45 0.00 -0.49 -1.39 119.26 121.71 1mxh h ALA 188 Ca 0.31 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1mxh h ALA 188 Cb -0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1mxh h ALA 188 CO -0.06 0.55 0.19 1.25 0.00 0.00 0.00 179.25 181.19 1mxh h LEU 189 N 0.94 0.96 -0.91 0.00 5.85 -0.21 0.52 115.31 122.44 1mxh h LEU 189 Ca 0.22 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1mxh h LEU 189 Cb 0.16 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 1mxh h LEU 189 CO -0.02 0.92 0.55 1.23 -0.34 0.00 0.00 178.44 180.78 1mxh h GLY 190 N 0.95 1.33 1.00 3.75 0.00 -0.62 0.11 103.07 109.59 1mxh h GLY 190 Ca 0.21 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1mxh h GLY 190 CO -0.00 0.53 0.35 -1.33 0.00 0.00 0.00 176.54 176.09 1mxh h GLY 191 N 1.26 1.04 0.99 4.60 0.00 -0.55 -2.65 103.07 107.75 1mxh h GLY 191 Ca 0.33 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1mxh h GLY 191 CO -0.06 0.47 0.32 -2.00 0.00 0.00 0.00 176.54 175.27 1mxh h LEU 192 N 0.94 0.67 -0.55 3.11 5.85 -0.06 -0.55 115.31 124.73 1mxh h LEU 192 Ca 0.24 -0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.98 1mxh h LEU 192 Cb 0.08 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 40.87 1mxh h LEU 192 CO -0.03 0.54 0.15 0.74 -0.34 0.00 0.00 178.44 179.50 1mxh h THR 193 N 0.74 0.73 0.10 1.05 2.02 -0.47 0.14 112.91 117.22 1mxh h THR 193 Ca 0.20 -0.10 -0.29 0.00 0.77 0.00 0.00 66.41 66.98 1mxh h THR 193 Cb 0.01 0.41 0.02 0.00 -1.74 0.00 0.00 68.15 66.85 1mxh h THR 193 CO -0.03 0.05 -1.20 0.03 0.37 0.00 0.00 175.52 174.74 1mxh h ARG 194 N 0.30 0.60 -0.08 6.66 3.08 -1.27 -2.08 114.38 121.58 1mxh h ARG 194 Ca 0.28 -0.77 -0.01 0.00 0.07 0.00 0.00 59.98 59.54 1mxh h ARG 194 Cb 0.36 0.25 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 1mxh h ARG 194 CO -0.33 1.34 0.01 0.00 -1.07 0.00 0.00 179.97 179.93 1mxh h ALA 195 N 0.36 0.11 -0.69 0.04 0.00 -0.90 -2.40 119.26 115.77 1mxh h ALA 195 Ca -0.17 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1mxh h ALA 195 Cb 1.87 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.60 1mxh h ALA 195 CO 0.23 -0.24 0.34 0.00 0.00 0.00 0.00 179.25 179.58 1mxh h ALA 196 N 0.76 0.89 -0.18 0.00 0.00 -0.83 -1.17 119.26 118.73 1mxh h ALA 196 Ca 0.02 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.84 1mxh h ALA 196 Cb 0.30 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1mxh h ALA 196 CO 0.00 0.45 -0.09 0.00 0.00 0.00 0.00 179.25 179.61 1mxh h ALA 197 N 1.16 0.06 0.03 0.00 0.00 -1.28 0.16 119.26 119.39 1mxh h ALA 197 Ca 0.24 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 1mxh h ALA 197 Cb 0.11 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1mxh h ALA 197 CO -0.03 -0.53 -0.02 1.25 0.00 0.00 0.00 179.25 179.93 1mxh h LEU 198 N -0.08 -0.04 -1.20 0.00 5.85 -1.26 -2.49 115.31 116.09 1mxh h LEU 198 Ca 0.10 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.58 1mxh h LEU 198 Cb 0.23 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1mxh h LEU 198 CO -0.23 0.17 -0.03 -0.08 -0.34 0.00 0.00 178.44 177.92 1mxh h GLU 199 N -0.24 0.51 -0.02 1.25 4.81 -0.96 -2.98 114.58 116.95 1mxh h GLU 199 Ca -0.00 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1mxh h GLU 199 Cb 0.23 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1mxh h GLU 199 CO 0.01 0.56 -0.08 1.28 -0.73 0.00 0.00 179.01 180.05 1mxh n LEU 200 N -4.26 1.62 -0.22 1.64 4.32 0.52 -4.38 117.00 116.25 1mxh n LEU 200 Ca 0.01 -0.53 -0.00 0.00 -0.02 0.00 0.00 56.01 55.47 1mxh n LEU 200 Cb 0.26 -0.03 0.11 0.00 -1.62 0.00 0.00 43.42 42.14 1mxh n LEU 200 CO 0.39 0.28 1.03 0.00 -1.22 0.00 0.00 177.39 177.87 1mxh h ALA 201 N 4.23 0.85 0.00 -1.18 0.00 -1.28 -0.93 119.26 120.95 1mxh h ALA 201 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1mxh h ALA 201 Cb 0.58 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1mxh h ALA 201 CO 0.00 -0.10 -0.03 -1.35 0.00 0.00 0.00 179.25 177.77 1mxh h PRO 202 N 0.52 0.00 -0.08 0.00 0.11 -1.80 0.55 132.00 131.30 1mxh h PRO 202 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1mxh h PRO 202 Cb 0.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.43 1mxh h PRO 202 CO -0.26 0.03 0.00 0.54 -0.21 0.00 0.00 178.00 178.10 1mxh n ARG 203 N -4.12 1.61 -2.04 1.05 5.12 -0.39 -4.94 116.66 112.94 1mxh n ARG 203 Ca -0.03 -0.90 -0.14 0.00 -1.93 0.00 0.00 57.85 54.85 1mxh n ARG 203 Cb 0.11 -1.44 -0.02 0.00 -1.16 0.00 0.00 32.46 29.96 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 0.10 -0.49 -3.78 -1.55 8.25 0.18 -5.01 115.22 112.93 1mxh n HIS 204 Ca 0.18 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.28 1mxh n HIS 204 Cb 0.31 -2.84 -0.13 0.00 1.12 0.00 0.00 29.99 28.46 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 -2.64 4.10 0.04 1.59 1.01 -0.97 -4.33 121.20 119.99 1mxh s ILE 205 Ca 0.00 -0.28 -0.21 0.00 0.00 0.00 0.00 60.65 60.16 1mxh s ILE 205 Cb 0.00 -2.93 -0.06 0.00 0.01 0.00 0.00 42.46 39.48 1mxh s ILE 205 CO 0.00 0.33 0.61 -0.13 0.00 0.00 0.00 174.94 175.76 1mxh s ARG 206 N 1.58 4.31 -0.16 2.79 0.52 -0.86 -4.18 118.95 122.94 1mxh s ARG 206 Ca 0.06 0.80 0.00 0.00 -0.52 0.00 0.00 55.73 56.07 1mxh s ARG 206 Cb -0.15 -3.30 0.03 0.00 0.52 0.00 0.00 34.95 32.05 1mxh s ARG 206 CO 0.02 0.48 -0.12 0.08 0.02 0.00 0.00 175.30 175.78 1mxh s VAL 207 N -0.61 1.51 0.35 3.52 1.01 -1.26 0.63 120.40 125.56 1mxh s VAL 207 Ca 0.31 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.68 1mxh s VAL 207 Cb -0.19 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 1mxh s VAL 207 CO 0.19 0.37 0.25 0.20 0.00 0.00 0.00 175.10 176.11 1mxh s ASN 208 N 1.50 1.99 0.05 3.32 0.01 -0.44 0.45 114.94 121.81 1mxh s ASN 208 Ca 0.03 -1.76 -0.04 0.00 -0.71 0.00 0.00 52.86 50.39 1mxh s ASN 208 Cb -0.14 0.57 -0.02 0.00 0.41 0.00 0.00 41.25 42.07 1mxh s ASN 208 CO -0.10 -1.05 0.06 0.00 -1.51 0.00 0.00 177.10 174.50 1mxh s ALA 209 N -3.37 0.14 -0.11 0.60 0.00 -0.63 -0.42 121.76 117.96 1mxh s ALA 209 Ca 0.36 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.54 1mxh s ALA 209 Cb 0.02 0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.44 1mxh s ALA 209 CO 0.25 -0.36 -0.20 0.08 0.00 0.00 0.00 175.76 175.53 1mxh s VAL 210 N -3.23 1.80 -0.45 0.00 1.01 -0.31 -0.36 120.40 118.86 1mxh s VAL 210 Ca 0.00 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 1mxh s VAL 210 Cb 0.03 -1.59 0.12 0.00 0.00 0.00 0.00 36.38 34.93 1mxh s VAL 210 CO -0.07 0.50 0.25 0.00 0.00 0.00 0.00 175.10 175.77 1mxh s ALA 211 N 0.71 3.23 0.64 5.51 0.00 0.09 -0.39 121.76 131.56 1mxh s ALA 211 Ca -0.11 -2.71 -0.15 0.00 0.00 0.00 0.00 51.96 48.99 1mxh s ALA 211 Cb -0.16 -2.43 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 1mxh s ALA 211 CO 0.02 -1.86 1.08 -2.14 0.00 0.00 0.00 175.76 172.86 1mxh s PRO 212 N 0.83 3.00 0.00 0.00 0.02 -1.26 -1.49 135.00 136.11 1mxh s PRO 212 Ca 0.10 1.28 0.00 0.00 0.02 0.00 0.00 61.00 62.40 1mxh s PRO 212 Cb -0.22 -1.98 0.00 0.00 0.02 0.00 0.00 34.50 32.31 1mxh s PRO 212 CO -0.04 -1.08 0.00 0.41 -0.33 0.00 0.00 177.00 175.96 1mxh n GLY 213 N -0.83 0.15 3.45 0.52 0.00 -1.01 -1.01 105.19 106.46 1mxh n GLY 213 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 4.27 0.00 0.99 2.96 -1.26 -4.82 118.68 120.81 1mxh s LEU 214 Ca 0.00 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 53.35 1mxh s LEU 214 Cb 0.00 -2.03 0.00 0.00 0.50 0.00 0.00 46.19 44.66 1mxh s LEU 214 CO 0.00 -0.23 0.00 -0.24 -1.32 0.00 0.00 176.35 174.56 1mxh n SER 215 N 5.01 0.00 -4.67 3.68 2.88 -1.26 -0.49 113.62 118.78 1mxh n SER 215 Ca -0.13 0.00 -0.58 0.00 -1.33 0.00 0.00 58.87 56.82 1mxh n SER 215 Cb 0.49 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.87 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 2.13 -4.82 2.46 4.77 -1.24 -4.65 117.00 115.65 1mxh n LEU 216 Ca 0.00 1.00 -0.31 0.00 -0.03 0.00 0.00 56.01 56.67 1mxh n LEU 216 Cb 0.00 -1.11 0.03 0.00 -2.33 0.00 0.00 43.42 40.02 1mxh n LEU 216 CO 0.00 -0.52 0.71 -0.76 -1.33 0.00 0.00 177.39 175.49 1mxh s LEU 217 N 4.01 3.23 0.16 2.23 1.43 -1.26 -4.97 118.68 123.53 1mxh s LEU 217 Ca 1.02 1.62 -0.32 0.00 -1.03 0.00 0.00 54.13 55.42 1mxh s LEU 217 Cb -1.13 -4.50 -0.12 0.00 0.03 0.00 0.00 46.19 40.48 1mxh s LEU 217 CO 0.66 -1.28 1.76 -2.65 0.23 0.00 0.00 176.35 175.08 1mxh n PRO 218 N -2.81 2.73 0.02 1.29 -0.02 -1.26 -4.86 135.00 130.09 1mxh n PRO 218 Ca 0.07 0.99 0.19 0.00 -2.02 0.00 0.00 63.50 62.73 1mxh n PRO 218 Cb 0.53 -2.85 0.68 0.00 -0.02 0.00 0.00 33.50 31.84 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 7.50 0.02 -0.00 0.52 0.13 -2.04 -1.42 132.00 136.71 1mxh h PRO 219 Ca -0.45 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1mxh h PRO 219 Cb 1.22 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1mxh h PRO 219 CO 0.95 0.01 -0.21 0.00 -0.23 0.00 0.00 178.00 178.52 1mxh n ALA 220 N -2.63 2.89 -1.99 -0.56 0.00 -1.26 -4.89 120.51 112.07 1mxh n ALA 220 Ca 0.08 -0.24 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 1mxh n ALA 220 Cb 0.54 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.66 1mxh n ALA 220 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1mxh s MET 221 N -2.87 4.27 0.47 0.00 0.00 -0.54 -4.96 119.30 115.68 1mxh s MET 221 Ca 0.17 2.24 -0.24 0.00 0.00 0.00 0.00 55.69 57.85 1mxh s MET 221 Cb 0.19 -3.17 -0.08 0.00 0.00 0.00 0.00 34.83 31.77 1mxh s MET 221 CO 0.58 -0.48 1.38 -2.30 0.00 0.00 0.00 175.02 174.20 1mxh n PRO 222 N 3.39 2.04 -0.34 4.11 -0.02 -1.26 -4.75 135.00 138.16 1mxh n PRO 222 Ca 0.11 0.73 0.06 0.00 -2.02 0.00 0.00 63.50 62.37 1mxh n PRO 222 Cb 0.40 -2.56 0.23 0.00 -0.02 0.00 0.00 33.50 31.56 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 2.03 1.00 -0.10 -0.52 4.20 -1.97 0.12 115.11 119.87 1mxh h GLN 223 Ca -0.50 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.19 1mxh h GLN 223 Cb 1.28 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 28.80 1mxh h GLN 223 CO 0.60 0.66 -0.15 0.93 -0.67 0.00 0.00 178.83 180.20 1mxh h GLU 224 N 1.03 -0.19 -0.68 1.46 5.08 -1.99 0.49 114.58 119.77 1mxh h GLU 224 Ca 0.45 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.83 1mxh h GLU 224 Cb 0.35 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 1mxh h GLU 224 CO -0.21 -0.13 0.45 1.15 -1.00 0.00 0.00 179.01 179.27 1mxh h THR 225 N -0.20 1.18 -0.92 1.13 2.02 -1.69 -1.41 112.91 113.02 1mxh h THR 225 Ca 0.08 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1mxh h THR 225 Cb 0.32 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.86 1mxh h THR 225 CO -0.22 0.17 0.55 1.56 0.37 0.00 0.00 175.52 177.95 1mxh h GLN 226 N 0.93 1.25 -0.56 6.66 4.20 -0.05 -2.27 115.11 125.27 1mxh h GLN 226 Ca 0.25 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 1mxh h GLN 226 Cb -0.10 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 27.39 1mxh h GLN 226 CO -0.05 0.88 0.18 1.49 -0.67 0.00 0.00 178.83 180.65 1mxh h GLU 227 N 1.27 0.88 -0.78 1.46 4.57 0.46 -1.38 114.58 121.07 1mxh h GLU 227 Ca 0.33 -0.19 0.06 0.00 -1.18 0.00 0.00 59.36 58.39 1mxh h GLU 227 Cb -0.05 -0.13 -0.06 0.00 -0.16 0.00 0.00 28.75 28.36 1mxh h GLU 227 CO -0.06 0.80 0.46 0.93 -1.18 0.00 0.00 179.01 179.95 1mxh h GLU 228 N 0.79 0.81 -0.24 1.92 5.08 -0.72 -0.92 114.58 121.30 1mxh h GLU 228 Ca 0.18 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1mxh h GLU 228 Cb 0.28 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1mxh h GLU 228 CO -0.01 0.54 0.02 1.88 -1.00 0.00 0.00 179.01 180.44 1mxh h TYR 229 N 0.83 0.44 -0.73 4.33 -1.99 -1.14 -3.22 116.97 115.50 1mxh h TYR 229 Ca 0.35 -0.07 0.03 0.00 2.00 0.00 0.00 58.73 61.04 1mxh h TYR 229 Cb 0.20 -0.12 -0.05 0.00 2.00 0.00 0.00 36.73 38.77 1mxh h TYR 229 CO -0.05 0.56 0.46 0.00 -0.00 0.00 0.00 178.16 179.12 1mxh h ARG 230 N 0.20 0.87 0.00 4.88 3.08 -0.67 -2.29 114.38 120.45 1mxh h ARG 230 Ca 0.07 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1mxh h ARG 230 Cb 0.37 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1mxh h ARG 230 CO 0.01 0.57 0.00 0.00 -1.07 0.00 0.00 179.97 179.48 1mxh h ARG 231 N 0.89 0.00 0.00 0.04 3.08 -1.19 -2.21 114.38 114.99 1mxh h ARG 231 Ca 0.29 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.26 1mxh h ARG 231 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1mxh h ARG 231 CO -0.11 0.00 -0.40 0.87 -1.07 0.00 0.00 179.97 179.26 1mxh h LYS 232 N 0.00 0.00 -6.24 0.04 1.57 -1.49 -3.45 116.57 107.00 1mxh h LYS 232 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 1mxh h LYS 232 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1mxh h LYS 232 CO 0.00 0.40 1.07 0.08 -0.57 0.00 0.00 179.45 180.42 1mxh s VAL 233 N -3.03 3.73 0.31 0.50 1.01 -0.84 -4.84 120.40 117.24 1mxh s VAL 233 Ca 0.04 0.87 -0.01 0.00 0.00 0.00 0.00 61.98 62.89 1mxh s VAL 233 Cb 0.07 -3.61 0.25 0.00 0.00 0.00 0.00 36.38 33.10 1mxh s VAL 233 CO 0.73 -0.13 1.97 -0.65 0.00 0.00 0.00 175.10 177.02 1mxh h PRO 234 N 9.59 0.98 -4.59 2.72 0.11 -1.84 -1.63 132.00 137.34 1mxh h PRO 234 Ca -0.36 -0.07 -0.72 0.00 0.11 0.00 0.00 66.00 64.96 1mxh h PRO 234 Cb 1.16 -0.22 -0.21 0.00 0.11 0.00 0.00 31.00 31.85 1mxh h PRO 234 CO 0.97 0.67 0.30 -1.17 -0.21 0.00 0.00 178.00 178.56 1mxh s LEU 235 N -9.81 5.60 0.00 2.35 2.96 -0.54 -4.48 118.68 114.76 1mxh s LEU 235 Ca -0.11 -1.87 0.00 0.00 -0.22 0.00 0.00 54.13 51.93 1mxh s LEU 235 Cb 0.18 -2.31 0.00 0.00 0.50 0.00 0.00 46.19 44.56 1mxh s LEU 235 CO 0.78 -0.99 0.00 0.61 -1.32 0.00 0.00 176.35 175.44 1mxh n GLY 236 N 5.04 1.07 4.00 7.98 0.00 -1.26 -4.30 105.19 117.72 1mxh n GLY 236 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.29 -3.77 1.61 3.00 -0.61 -4.95 117.38 107.37 1mxh n GLN 237 Ca 0.00 0.40 -0.13 0.00 -0.01 0.00 0.00 57.00 57.26 1mxh n GLN 237 Cb 0.00 -4.61 -0.09 0.00 0.00 0.00 0.00 30.24 25.54 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 -4.20 -0.17 0.69 1.08 0.15 -1.19 -4.33 113.70 105.73 1mxh s SER 238 Ca 0.12 0.05 -0.11 0.00 0.70 0.00 0.00 55.95 56.71 1mxh s SER 238 Cb -0.07 0.31 0.01 0.00 -1.71 0.00 0.00 66.02 64.57 1mxh s SER 238 CO 0.89 -0.46 1.07 -1.83 1.20 0.00 0.00 173.24 174.12 1mxh s GLU 239 N -1.43 2.85 0.32 5.44 1.03 -1.26 -4.84 118.70 120.80 1mxh s GLU 239 Ca -0.13 0.39 -0.27 0.00 0.03 0.00 0.00 54.97 55.00 1mxh s GLU 239 Cb -0.05 -2.05 -0.10 0.00 -0.80 0.00 0.00 34.13 31.13 1mxh s GLU 239 CO 0.04 -1.00 0.97 0.00 -1.33 0.00 0.00 175.26 173.93 1mxh s ALA 240 N -3.32 3.22 0.52 -0.84 0.00 0.36 -4.94 121.76 116.77 1mxh s ALA 240 Ca 0.58 0.59 -0.11 0.00 0.00 0.00 0.00 51.96 53.01 1mxh s ALA 240 Cb -0.11 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.75 1mxh s ALA 240 CO 0.51 0.10 0.92 -1.54 0.00 0.00 0.00 175.76 175.74 1mxh s SER 241 N -1.50 6.41 0.41 0.00 1.04 -1.26 -3.64 113.70 115.16 1mxh s SER 241 Ca 0.50 1.31 0.11 0.00 0.48 0.00 0.00 55.95 58.34 1mxh s SER 241 Cb -0.21 -2.41 0.92 0.00 0.10 0.00 0.00 66.02 64.42 1mxh s SER 241 CO 0.27 -0.64 1.98 0.00 0.98 0.00 0.00 173.24 175.83 1mxh h ALA 242 N 0.46 1.88 -0.19 5.32 0.00 -1.96 -1.50 119.26 123.27 1mxh h ALA 242 Ca -0.46 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 1mxh h ALA 242 Cb 1.19 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1mxh h ALA 242 CO 0.62 0.01 -0.28 0.00 0.00 0.00 0.00 179.25 179.60 1mxh h ALA 243 N 1.68 1.17 -0.17 0.00 0.00 -1.93 0.22 119.26 120.23 1mxh h ALA 243 Ca 0.27 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 1mxh h ALA 243 Cb 0.38 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1mxh h ALA 243 CO -0.08 0.53 -0.54 1.96 0.00 0.00 0.00 179.25 181.12 1mxh h GLN 244 N 0.32 0.50 -0.32 0.00 4.20 -1.66 0.02 115.11 118.17 1mxh h GLN 244 Ca 0.05 -0.31 -0.13 0.00 0.06 0.00 0.00 58.65 58.31 1mxh h GLN 244 Cb 0.66 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.47 1mxh h GLN 244 CO 0.05 0.91 -0.33 0.82 -0.67 0.00 0.00 178.83 179.61 1mxh h ILE 245 N 0.38 1.29 -0.12 2.54 1.08 -1.02 -2.92 117.51 118.75 1mxh h ILE 245 Ca 0.01 -1.50 -0.01 0.00 -0.39 0.00 0.00 64.86 62.97 1mxh h ILE 245 Cb 1.07 1.53 -0.01 0.00 -3.07 0.00 0.00 36.82 36.34 1mxh h ILE 245 CO 0.10 0.49 0.02 0.00 -0.69 0.00 0.00 178.15 178.07 1mxh h ALA 246 N 0.72 1.83 -0.43 1.87 0.00 -0.33 -2.27 119.26 120.65 1mxh h ALA 246 Ca 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1mxh h ALA 246 Cb 0.91 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1mxh h ALA 246 CO 0.08 0.14 0.19 -0.44 0.00 0.00 0.00 179.25 179.22 1mxh h ASP 247 N 0.16 0.58 -0.64 0.00 3.32 -0.80 -0.33 116.42 118.70 1mxh h ASP 247 Ca 0.04 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1mxh h ASP 247 Cb 0.07 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1mxh h ASP 247 CO -0.00 0.56 0.32 0.00 -1.72 0.00 0.00 179.24 178.41 1mxh h ALA 248 N 1.04 0.83 -0.41 3.45 0.00 -1.34 -1.57 119.26 121.26 1mxh h ALA 248 Ca 0.15 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1mxh h ALA 248 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1mxh h ALA 248 CO -0.02 0.38 -0.25 0.82 0.00 0.00 0.00 179.25 180.18 1mxh h ILE 249 N 0.88 1.27 -0.24 0.00 2.04 -1.31 -2.16 117.51 118.00 1mxh h ILE 249 Ca 0.22 -1.39 -0.05 0.00 1.00 0.00 0.00 64.86 64.64 1mxh h ILE 249 Cb 0.09 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1mxh h ILE 249 CO -0.03 0.47 -0.09 0.00 0.00 0.00 0.00 178.15 178.50 1mxh h ALA 250 N 0.98 1.40 0.01 1.87 0.00 -0.75 -1.96 119.26 120.83 1mxh h ALA 250 Ca 0.09 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1mxh h ALA 250 Cb 0.79 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1mxh h ALA 250 CO 0.07 0.41 -0.00 0.35 0.00 0.00 0.00 179.25 180.07 1mxh h PHE 251 N 0.37 -0.01 0.00 0.00 3.57 -1.04 -2.24 116.94 117.59 1mxh h PHE 251 Ca 0.08 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1mxh h PHE 251 Cb 0.38 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 1mxh h PHE 251 CO 0.01 0.43 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.39 1mxh h LEU 252 N -0.46 0.00 0.00 0.59 3.38 -1.17 -1.53 115.31 116.12 1mxh h LEU 252 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1mxh h LEU 252 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1mxh h LEU 252 CO 0.00 0.06 -1.02 -0.37 0.09 0.00 0.00 178.44 177.20 1mxh h VAL 253 N 0.00 0.41 -3.58 1.22 -1.51 -1.34 -3.45 116.25 108.01 1mxh h VAL 253 Ca -0.00 -1.72 -0.43 0.00 -1.23 0.00 0.00 66.70 63.31 1mxh h VAL 253 Cb 0.13 1.98 0.18 0.00 -2.13 0.00 0.00 31.29 31.45 1mxh h VAL 253 CO 0.01 0.24 0.11 -0.94 -1.23 0.00 0.00 177.57 175.76 1mxh s SER 254 N -5.85 1.50 0.49 4.19 1.04 -0.58 -4.92 113.70 109.57 1mxh s SER 254 Ca -0.00 1.06 0.28 0.00 0.48 0.00 0.00 55.95 57.78 1mxh s SER 254 Cb 0.08 -1.63 1.09 0.00 0.10 0.00 0.00 66.02 65.66 1mxh s SER 254 CO 0.78 -3.82 1.88 0.50 0.98 0.00 0.00 173.24 173.57 1mxh h LYS 255 N -2.36 0.00 0.00 4.02 1.63 -1.91 -2.77 116.57 115.18 1mxh h LYS 255 Ca -0.53 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 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 0.48 0.10 0.00 -0.25 -3.45 0.00 0.00 179.45 176.34 1mxh n ASP 256 N -3.23 0.00 -0.43 4.20 9.92 -1.26 -1.85 116.55 123.91 1mxh n ASP 256 Ca 0.01 -0.07 0.06 0.00 -0.53 0.00 0.00 54.79 54.26 1mxh n ASP 256 Cb 0.38 -0.19 0.12 0.00 -0.64 0.00 0.00 41.12 40.79 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 -1.19 2.54 0.34 2.24 0.00 -1.05 -4.83 120.51 118.56 1mxh n ALA 257 Ca 0.07 -2.43 0.21 0.00 0.00 0.00 0.00 53.44 51.30 1mxh n ALA 257 Cb 0.08 -0.43 1.12 0.00 0.00 0.00 0.00 19.45 20.22 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 0.33 0.00 -1.20 0.00 0.00 -1.48 0.18 103.07 100.90 1mxh h GLY 258 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1mxh h GLY 258 CO 0.01 0.00 -0.34 2.98 0.00 0.00 0.00 176.54 179.19 1mxh n TYR 259 N -3.06 0.00 -3.16 5.60 9.36 -1.26 -4.92 117.16 119.72 1mxh n TYR 259 Ca -0.03 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.79 1mxh n TYR 259 Cb 0.15 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 38.79 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 -2.28 4.99 -0.15 2.97 1.01 0.05 -5.04 121.20 122.74 1mxh s ILE 260 Ca 0.20 0.85 -0.13 0.00 0.00 0.00 0.00 60.65 61.58 1mxh s ILE 260 Cb 0.18 -3.94 0.04 0.00 0.01 0.00 0.00 42.46 38.75 1mxh s ILE 260 CO 0.48 -0.06 0.39 0.28 0.00 0.00 0.00 174.94 176.03 1mxh s THR 261 N 2.49 -0.00 0.00 2.92 -1.32 -1.26 -4.72 115.64 113.75 1mxh s THR 261 Ca 0.24 0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.73 1mxh s THR 261 Cb -0.15 -0.55 0.00 0.00 -1.51 0.00 0.00 72.50 70.29 1mxh s THR 261 CO 0.11 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.13 1mxh n GLY 262 N 3.02 0.50 3.68 6.08 0.00 0.17 -4.94 105.19 113.71 1mxh n GLY 262 Ca -0.14 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.00 4.24 -0.29 2.61 -4.23 -1.26 -4.78 115.64 109.93 1mxh s THR 263 Ca 0.00 -0.42 -0.09 0.00 -1.18 0.00 0.00 61.69 60.00 1mxh s THR 263 Cb 0.00 -2.84 -0.01 0.00 1.34 0.00 0.00 72.50 70.99 1mxh s THR 263 CO 0.00 0.49 0.13 -0.89 -0.54 0.00 0.00 174.62 173.81 1mxh s THR 264 N -0.99 4.51 -0.51 3.99 2.01 -1.26 -1.60 115.64 121.78 1mxh s THR 264 Ca 0.17 -0.35 -0.20 0.00 0.31 0.00 0.00 61.69 61.62 1mxh s THR 264 Cb -0.11 -3.25 0.06 0.00 0.01 0.00 0.00 72.50 69.21 1mxh s THR 264 CO 0.06 0.15 0.66 -0.22 -0.69 0.00 0.00 174.62 174.58 1mxh s LEU 265 N 1.61 4.87 0.23 4.42 2.96 0.52 -4.91 118.68 128.37 1mxh s LEU 265 Ca 0.05 -0.86 -0.30 0.00 -0.22 0.00 0.00 54.13 52.81 1mxh s LEU 265 Cb -0.16 -2.49 -0.09 0.00 0.50 0.00 0.00 46.19 43.95 1mxh s LEU 265 CO 0.05 -0.93 1.12 -0.75 -1.32 0.00 0.00 176.35 174.52 1mxh s LYS 266 N 2.78 4.60 -0.41 1.98 2.20 -1.26 -0.73 119.74 128.90 1mxh s LYS 266 Ca 0.17 1.78 0.03 0.00 -0.36 0.00 0.00 55.97 57.59 1mxh s LYS 266 Cb -0.18 -3.23 0.16 0.00 -1.51 0.00 0.00 37.83 33.07 1mxh s LYS 266 CO 0.13 0.11 0.32 0.08 -0.36 0.00 0.00 175.35 175.63 1mxh s VAL 267 N -0.65 0.42 0.00 4.02 1.01 -0.56 -4.88 120.40 119.76 1mxh s VAL 267 Ca 0.48 -2.54 0.00 0.00 0.00 0.00 0.00 61.98 59.91 1mxh s VAL 267 Cb -0.31 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 34.76 1mxh s VAL 267 CO 0.38 -1.18 0.54 -0.90 0.00 0.00 0.00 175.10 173.94 1mxh n ASP 268 N 3.04 0.70 -1.96 3.32 5.75 -1.26 -2.40 116.55 123.74 1mxh n ASP 268 Ca 0.26 -1.28 -0.19 0.00 -0.01 0.00 0.00 54.79 53.57 1mxh n ASP 268 Cb 0.45 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.50 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 -0.14 0.69 2.52 6.12 0.00 -1.26 -1.71 105.19 111.41 1mxh n GLY 269 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.64 0.92 0.27 -0.02 0.00 -1.26 -1.47 105.19 102.99 1mxh n GLY 270 Ca -0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.86 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 0.29 -1.29 0.99 5.85 -1.65 -1.18 115.31 118.31 1mxh h LEU 271 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1mxh h LEU 271 Cb 0.00 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1mxh h LEU 271 CO 0.00 0.13 0.00 -0.29 -0.34 0.00 0.00 178.44 177.94 1mxh h ILE 272 N 0.45 0.00 0.00 4.05 2.10 -1.93 -2.74 117.51 119.45 1mxh h ILE 272 Ca 0.39 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 66.25 1mxh h ILE 272 Cb 0.56 0.68 0.00 0.00 -1.09 0.00 0.00 36.82 36.97 1mxh h ILE 272 CO -0.37 0.00 -0.45 0.18 -1.08 0.00 0.00 178.15 176.42 1mxh n LEU 273 N -2.31 0.56 -4.76 2.19 4.32 -0.45 -4.92 117.00 111.63 1mxh n LEU 273 Ca -0.00 0.22 -0.40 0.00 -0.02 0.00 0.00 56.01 55.81 1mxh n LEU 273 Cb 0.10 -0.26 -0.05 0.00 -1.62 0.00 0.00 43.42 41.59 1mxh n LEU 273 CO 0.14 -0.00 0.46 0.00 -1.22 0.00 0.00 177.39 176.76 1mxh s ALA 274 N -3.09 3.41 0.36 -1.18 0.00 -1.04 -5.06 121.76 115.18 1mxh s ALA 274 Ca 0.09 0.29 -0.14 0.00 0.00 0.00 0.00 51.96 52.20 1mxh s ALA 274 Cb 0.15 -2.95 -0.08 0.00 0.00 0.00 0.00 23.12 20.24 1mxh s ALA 274 CO 0.68 0.17 0.77 1.03 0.00 0.00 0.00 175.76 178.41 1mxh s ARG 275 N -0.51 3.94 0.00 0.00 1.81 -1.26 -5.10 118.95 117.82 1mxh s ARG 275 Ca 0.37 0.64 0.08 0.00 -1.72 0.00 0.00 55.73 55.10 1mxh s ARG 275 Cb -0.21 -2.39 0.51 0.00 -0.45 0.00 0.00 34.95 32.40 1mxh s ARG 275 CO 0.24 0.06 0.96 0.00 -0.68 0.00 0.00 175.30 175.88