#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xwo s ASP 18 N 0.00 6.60 0.16 1.09 2.15 -1.26 -5.02 116.67 120.39 1xwo s ASP 18 Ca 0.00 0.73 0.03 0.00 0.43 0.00 0.00 52.55 53.75 1xwo s ASP 18 Cb 0.00 -2.15 -0.02 0.00 -0.30 0.00 0.00 42.92 40.44 1xwo s ASP 18 CO 0.00 0.16 1.37 1.55 -0.17 0.00 0.00 175.17 178.08 1xwo h PRO 19 N 3.61 0.15 0.15 4.34 0.13 -2.06 -3.21 132.00 135.12 1xwo h PRO 19 Ca -0.49 -0.18 -0.30 0.00 -0.87 0.00 0.00 66.00 64.17 1xwo h PRO 19 Cb 1.19 0.05 0.02 0.00 0.13 0.00 0.00 31.00 32.40 1xwo h PRO 19 CO 0.67 0.95 -1.29 0.82 -0.23 0.00 0.00 178.00 178.92 1xwo h ILE 20 N 0.08 1.34 -0.37 -3.56 2.04 -1.99 -3.22 117.51 111.84 1xwo h ILE 20 Ca -0.04 -2.67 -0.02 0.00 1.00 0.00 0.00 64.86 63.13 1xwo h ILE 20 Cb 1.54 2.83 -0.02 0.00 -0.74 0.00 0.00 36.82 40.43 1xwo h ILE 20 CO 0.13 0.80 0.15 -0.03 0.00 0.00 0.00 178.15 179.21 1xwo h MET 21 N 0.19 0.52 0.00 2.37 4.05 -1.99 -1.22 114.93 118.84 1xwo h MET 21 Ca -0.19 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.16 1xwo h MET 21 Cb 1.98 -0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 32.67 1xwo h MET 21 CO 0.24 0.43 -0.05 1.96 0.23 0.00 0.00 176.91 179.72 1xwo h GLN 22 N 0.52 0.00 -1.00 0.39 4.20 -1.56 -2.71 115.11 114.96 1xwo h GLN 22 Ca 0.13 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 1xwo h GLN 22 Cb 0.10 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1xwo h GLN 22 CO -0.01 0.05 0.02 -1.33 -0.67 0.00 0.00 178.83 176.89 1xwo n MET 23 N -3.29 1.08 0.00 1.46 2.81 -0.46 -2.26 117.12 116.45 1xwo n MET 23 Ca -0.01 -0.13 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 1xwo n MET 23 Cb 0.22 -1.14 0.00 0.00 -0.71 0.00 0.00 33.22 31.58 1xwo n MET 23 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1xwo n LEU 24 N 0.35 0.00 -1.43 4.03 4.77 -1.02 -4.90 117.00 118.79 1xwo n LEU 24 Ca 0.02 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.90 1xwo n LEU 24 Cb 0.50 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.76 1xwo n LEU 24 CO 0.02 0.00 0.72 -1.54 -1.33 0.00 0.00 177.39 175.27 1xwo n SER 25 N -1.01 3.25 -3.13 -1.43 3.41 -1.21 -4.80 113.62 108.69 1xwo n SER 25 Ca 0.00 -3.79 0.01 0.00 -0.26 0.00 0.00 58.87 54.83 1xwo n SER 25 Cb 0.00 -0.64 -0.01 0.00 -0.26 0.00 0.00 64.21 63.30 1xwo n SER 25 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1xwo s THR 26 N -3.56 -0.93 -0.51 6.66 2.01 -0.96 -4.87 115.64 113.49 1xwo s THR 26 Ca 0.48 -0.09 0.06 0.00 0.31 0.00 0.00 61.69 62.44 1xwo s THR 26 Cb 0.42 0.00 0.21 0.00 0.01 0.00 0.00 72.50 73.14 1xwo s THR 26 CO 0.01 0.00 0.50 -1.20 -0.69 0.00 0.00 174.62 173.23 1xwo n SER 27 N 4.21 1.17 0.22 3.53 7.64 -1.22 -4.73 113.62 124.43 1xwo n SER 27 Ca 0.11 -2.82 0.15 0.00 1.01 0.00 0.00 58.87 57.32 1xwo n SER 27 Cb 0.58 -0.64 0.74 0.00 -1.01 0.00 0.00 64.21 63.87 1xwo n SER 27 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1xwo h MET 28 N 4.85 0.00 0.01 1.43 2.86 -1.85 -0.93 114.93 121.30 1xwo h MET 28 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1xwo h MET 28 Cb 0.82 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.48 1xwo h MET 28 CO 0.55 0.00 -0.03 0.66 1.06 0.00 0.00 176.91 179.15 1xwo h SER 29 N 0.00 -0.10 0.36 1.22 4.64 -1.93 -2.36 113.55 115.38 1xwo h SER 29 Ca 0.00 0.01 -0.30 0.00 -0.47 0.00 0.00 61.79 61.03 1xwo h SER 29 Cb 0.17 0.04 0.02 0.00 -0.31 0.00 0.00 62.40 62.32 1xwo h SER 29 CO 0.00 -0.03 -1.29 0.71 -0.87 0.00 0.00 176.83 175.35 1xwo h THR 30 N -0.04 1.37 -0.32 2.95 1.35 -1.92 -3.34 112.91 112.96 1xwo h THR 30 Ca -0.00 -2.74 0.08 0.00 -0.55 0.00 0.00 66.41 63.20 1xwo h THR 30 Cb 0.05 2.86 -0.01 0.00 -1.73 0.00 0.00 68.15 69.31 1xwo h THR 30 CO -0.02 0.81 0.22 -0.33 -0.25 0.00 0.00 175.52 175.96 1xwo h GLU 31 N 0.16 0.08 -0.52 4.72 4.39 -1.23 -2.86 114.58 119.32 1xwo h GLU 31 Ca -0.18 -0.00 0.15 0.00 0.34 0.00 0.00 59.36 59.67 1xwo h GLU 31 Cb 1.98 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 30.59 1xwo h GLU 31 CO 0.23 0.05 0.44 1.96 -1.16 0.00 0.00 179.01 180.53 1xwo h GLN 32 N 0.08 0.00 0.00 2.33 4.20 -1.55 -1.55 115.11 118.62 1xwo h GLN 32 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1xwo h GLN 32 Cb 0.49 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1xwo h GLN 32 CO -0.01 0.00 0.00 2.89 -0.67 0.00 0.00 178.83 181.04 1xwo n ARG 33 N -4.06 0.73 -0.25 1.46 1.85 -1.08 -1.87 116.66 113.45 1xwo n ARG 33 Ca 0.10 0.00 0.10 0.00 -1.00 0.00 0.00 57.85 57.05 1xwo n ARG 33 Cb 0.65 -1.42 0.23 0.00 -1.05 0.00 0.00 32.46 30.88 1xwo n ARG 33 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1xwo n LEU 34 N -0.92 3.45 -0.32 2.89 4.77 -0.58 -4.55 117.00 121.73 1xwo n LEU 34 Ca 0.15 -1.81 -0.01 0.00 -0.03 0.00 0.00 56.01 54.31 1xwo n LEU 34 Cb 0.07 -0.33 0.12 0.00 -2.33 0.00 0.00 43.42 40.95 1xwo n LEU 34 CO 0.11 0.82 1.22 0.77 -1.33 0.00 0.00 177.39 178.99 1xwo h SER 35 N 3.63 0.94 0.33 -1.43 4.64 -1.54 -1.14 113.55 118.97 1xwo h SER 35 Ca 0.00 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1xwo h SER 35 Cb 0.89 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1xwo h SER 35 CO 0.00 0.63 -0.16 -0.08 -0.87 0.00 0.00 176.83 176.35 1xwo h GLU 36 N 1.09 -0.43 -0.86 4.77 4.57 -1.83 -2.31 114.58 119.58 1xwo h GLU 36 Ca 0.36 0.03 0.15 0.00 -1.18 0.00 0.00 59.36 58.72 1xwo h GLU 36 Cb 0.05 0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 28.67 1xwo h GLU 36 CO -0.13 -0.28 0.56 -0.39 -1.18 0.00 0.00 179.01 177.59 1xwo h VAL 37 N -0.50 0.81 -0.78 0.32 -1.51 -1.88 0.18 116.25 112.89 1xwo h VAL 37 Ca -0.05 -0.21 -0.03 0.00 -1.23 0.00 0.00 66.70 65.19 1xwo h VAL 37 Cb 0.34 0.15 -0.04 0.00 -2.13 0.00 0.00 31.29 29.62 1xwo h VAL 37 CO 0.07 0.11 0.37 -0.78 -1.23 0.00 0.00 177.57 176.11 1xwo h ASP 38 N 0.60 1.02 -0.19 4.19 -0.00 -1.20 0.03 116.42 120.87 1xwo h ASP 38 Ca 0.43 -0.12 -0.09 0.00 -0.00 0.00 0.00 57.03 57.25 1xwo h ASP 38 Cb 0.80 -0.26 -0.00 0.00 -0.00 0.00 0.00 39.33 39.87 1xwo h ASP 38 CO -0.19 0.87 -0.23 0.40 -0.00 0.00 0.00 179.24 180.09 1xwo h ILE 39 N 1.12 1.34 -0.63 2.25 2.04 -0.13 -1.08 117.51 122.41 1xwo h ILE 39 Ca 0.27 -1.42 0.07 0.00 1.00 0.00 0.00 64.86 64.78 1xwo h ILE 39 Cb 0.12 1.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.98 1xwo h ILE 39 CO -0.03 0.43 0.42 1.56 0.00 0.00 0.00 178.15 180.52 1xwo h GLN 40 N 0.15 0.55 0.05 2.37 1.08 -0.59 -0.55 115.11 118.18 1xwo h GLN 40 Ca 0.02 -0.03 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 1xwo h GLN 40 Cb 0.79 -0.12 0.02 0.00 -0.05 0.00 0.00 27.48 28.12 1xwo h GLN 40 CO 0.06 0.36 -0.80 0.00 -0.95 0.00 0.00 178.83 177.50 1xwo h ALA 41 N 1.67 0.03 -0.42 3.87 0.00 -0.87 -2.73 119.26 120.80 1xwo h ALA 41 Ca 0.28 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1xwo h ALA 41 Cb 0.36 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1xwo h ALA 41 CO -0.08 0.44 0.24 0.77 0.00 0.00 0.00 179.25 180.61 1xwo h SER 42 N -0.06 0.51 -0.03 0.00 0.02 -0.44 -0.64 113.55 112.91 1xwo h SER 42 Ca -0.11 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1xwo h SER 42 Cb 1.52 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.93 1xwo h SER 42 CO 0.15 0.41 0.01 0.40 -1.14 0.00 0.00 176.83 176.66 1xwo h ILE 43 N 0.58 1.18 -0.67 3.27 2.04 -1.14 0.09 117.51 122.86 1xwo h ILE 43 Ca 0.15 -0.53 0.07 0.00 1.00 0.00 0.00 64.86 65.55 1xwo h ILE 43 Cb 0.01 1.49 -0.06 0.00 -0.74 0.00 0.00 36.82 37.51 1xwo h ILE 43 CO -0.03 0.14 0.36 0.00 0.00 0.00 0.00 178.15 178.62 1xwo h ALA 44 N 0.79 0.90 -0.10 1.87 0.00 -1.07 -1.14 119.26 120.51 1xwo h ALA 44 Ca 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1xwo h ALA 44 Cb 0.22 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1xwo h ALA 44 CO -0.00 0.01 0.02 -0.92 0.00 0.00 0.00 179.25 178.36 1xwo h TYR 45 N 0.65 0.18 -0.48 0.00 3.20 -0.96 -2.10 116.97 117.46 1xwo h TYR 45 Ca 0.31 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 62.24 1xwo h TYR 45 Cb 0.23 -0.05 -0.10 0.00 1.54 0.00 0.00 36.73 38.35 1xwo h TYR 45 CO -0.09 0.37 -0.36 0.00 -1.64 0.00 0.00 178.16 176.44 1xwo h ALA 46 N 0.79 -0.21 -0.47 1.82 0.00 -0.56 0.46 119.26 121.09 1xwo h ALA 46 Ca 0.03 0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.15 1xwo h ALA 46 Cb 0.29 0.80 -0.09 0.00 0.00 0.00 0.00 17.79 18.78 1xwo h ALA 46 CO 0.00 -0.75 -0.16 0.87 0.00 0.00 0.00 179.25 179.21 1xwo h LYS 47 N -0.24 -0.05 0.00 0.00 1.57 -1.01 0.36 116.57 117.19 1xwo h LYS 47 Ca 0.18 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.92 1xwo h LYS 47 Cb 0.56 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 1xwo h LYS 47 CO -0.61 -0.03 -0.25 0.00 -0.57 0.00 0.00 179.45 177.99 1xwo h ALA 48 N 1.36 1.18 -0.31 3.86 0.00 -0.31 -2.68 119.26 122.37 1xwo h ALA 48 Ca 0.23 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1xwo h ALA 48 Cb 0.40 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1xwo h ALA 48 CO -0.52 0.31 -0.01 -0.07 0.00 0.00 0.00 179.25 178.96 1xwo h LEU 49 N 0.00 0.55 -0.64 0.00 3.38 0.19 -2.26 115.31 116.53 1xwo h LEU 49 Ca -0.00 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.69 1xwo h LEU 49 Cb 0.61 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 1xwo h LEU 49 CO 0.03 0.74 0.38 -0.08 0.09 0.00 0.00 178.44 179.60 1xwo h GLU 50 N 0.35 0.72 0.00 1.13 4.22 -0.98 0.27 114.58 120.29 1xwo h GLU 50 Ca 0.09 -0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.44 1xwo h GLU 50 Cb 0.46 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1xwo h GLU 50 CO 0.02 0.48 -0.20 -0.22 -2.18 0.00 0.00 179.01 176.90 1xwo h LYS 51 N 0.74 0.00 -0.00 1.92 3.64 -1.41 -2.07 116.57 119.39 1xwo h LYS 51 Ca 0.27 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1xwo h LYS 51 Cb 0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1xwo h LYS 51 CO -0.12 0.20 -0.23 0.00 -2.27 0.00 0.00 179.45 177.03 1xwo n ALA 52 N -2.31 3.00 0.00 5.00 0.00 -0.04 -4.95 120.51 121.21 1xwo n ALA 52 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1xwo n ALA 52 Cb 0.33 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1xwo n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xwo n GLY 53 N 1.35 3.14 0.33 0.00 0.00 -0.45 -4.92 105.19 104.63 1xwo n GLY 53 Ca 0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 1xwo n GLY 53 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xwo h ILE 54 N 0.00 0.85 -2.31 -0.61 5.03 -1.68 -3.42 117.51 115.37 1xwo h ILE 54 Ca 0.00 -0.28 -0.54 0.00 -0.12 0.00 0.00 64.86 63.92 1xwo h ILE 54 Cb 0.00 -0.04 -0.08 0.00 -3.03 0.00 0.00 36.82 33.68 1xwo h ILE 54 CO 0.00 0.15 -0.59 -0.76 -0.68 0.00 0.00 178.15 176.27 1xwo s LEU 55 N -10.28 3.50 0.08 1.44 1.43 -1.21 -4.95 118.68 108.69 1xwo s LEU 55 Ca -0.12 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.61 1xwo s LEU 55 Cb 0.21 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 1xwo s LEU 55 CO 0.79 0.00 -0.02 0.42 0.23 0.00 0.00 176.35 177.77 1xwo s THR 56 N -2.14 3.90 0.23 5.49 -4.23 -1.26 -4.36 115.64 113.27 1xwo s THR 56 Ca 0.31 -1.01 -0.15 0.00 -1.18 0.00 0.00 61.69 59.67 1xwo s THR 56 Cb -0.08 -2.84 0.27 0.00 1.34 0.00 0.00 72.50 71.19 1xwo s THR 56 CO 0.22 0.14 1.57 0.50 -0.54 0.00 0.00 174.62 176.51 1xwo h LYS 57 N 3.55 -0.04 0.00 3.99 1.63 -1.99 0.81 116.57 124.53 1xwo h LYS 57 Ca -0.48 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 1xwo h LYS 57 Cb 1.17 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.80 1xwo h LYS 57 CO 0.58 -0.02 0.00 1.79 -3.45 0.00 0.00 179.45 178.35 1xwo h THR 58 N -0.04 0.00 0.00 1.00 1.35 -2.00 -2.79 112.91 110.43 1xwo h THR 58 Ca 0.35 -0.32 -0.06 0.00 -0.55 0.00 0.00 66.41 65.83 1xwo h THR 58 Cb 0.61 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 68.29 1xwo h THR 58 CO -0.89 0.00 -0.33 -0.08 -0.25 0.00 0.00 175.52 173.98 1xwo h GLU 59 N 0.00 0.00 -0.67 4.72 4.81 0.13 -3.21 114.58 120.35 1xwo h GLU 59 Ca 0.00 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.37 1xwo h GLU 59 Cb 0.33 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 29.60 1xwo h GLU 59 CO 0.00 0.86 0.03 1.25 -0.73 0.00 0.00 179.01 180.42 1xwo h LEU 60 N -1.00 -0.26 -1.33 1.64 5.85 -0.72 0.19 115.31 119.68 1xwo h LEU 60 Ca -0.09 0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1xwo h LEU 60 Cb 0.95 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 1xwo h LEU 60 CO -0.05 -0.12 0.08 -0.33 -0.34 0.00 0.00 178.44 177.68 1xwo h GLU 61 N 0.13 0.53 -0.24 1.25 5.08 -1.65 0.36 114.58 120.05 1xwo h GLU 61 Ca 0.36 -0.09 -0.13 0.00 -1.00 0.00 0.00 59.36 58.51 1xwo h GLU 61 Cb 0.60 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1xwo h GLU 61 CO -0.57 0.50 -0.38 0.87 -1.00 0.00 0.00 179.01 178.43 1xwo h LYS 62 N 0.52 0.54 -0.13 2.33 1.57 -0.74 -2.63 116.57 118.03 1xwo h LYS 62 Ca 0.12 -0.26 -0.15 0.00 -1.87 0.00 0.00 60.65 58.49 1xwo h LYS 62 Cb 0.21 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.53 1xwo h LYS 62 CO -0.00 0.83 -0.50 0.82 -0.57 0.00 0.00 179.45 180.03 1xwo h ILE 63 N 0.45 1.35 -0.12 1.86 2.04 0.43 -2.98 117.51 120.53 1xwo h ILE 63 Ca 0.04 -1.79 -0.01 0.00 1.00 0.00 0.00 64.86 64.11 1xwo h ILE 63 Cb 0.86 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 39.03 1xwo h ILE 63 CO 0.07 0.54 0.05 -0.07 0.00 0.00 0.00 178.15 178.75 1xwo h LEU 64 N 0.20 0.17 -0.30 1.44 3.38 -0.34 0.19 115.31 120.05 1xwo h LEU 64 Ca -0.03 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 57.85 1xwo h LEU 64 Cb 1.13 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.78 1xwo h LEU 64 CO 0.11 0.28 -0.07 -1.28 0.09 0.00 0.00 178.44 177.57 1xwo h SER 65 N 0.04 -0.26 -0.52 -0.43 0.87 -1.57 0.45 113.55 112.13 1xwo h SER 65 Ca 0.04 0.09 -0.09 0.00 -1.23 0.00 0.00 61.79 60.60 1xwo h SER 65 Cb 0.16 0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 1xwo h SER 65 CO -0.00 -0.09 -0.02 1.23 -0.53 0.00 0.00 176.83 177.42 1xwo h GLY 66 N 0.01 1.05 1.05 5.77 0.00 -1.38 -1.80 103.07 107.75 1xwo h GLY 66 Ca 0.14 -0.76 -0.04 0.00 0.00 0.00 0.00 47.33 46.67 1xwo h GLY 66 CO -0.30 0.70 0.34 1.41 0.00 0.00 0.00 176.54 178.69 1xwo h LEU 67 N 0.89 1.10 -0.50 3.11 3.38 0.23 -2.44 115.31 121.08 1xwo h LEU 67 Ca 0.16 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1xwo h LEU 67 Cb 0.54 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1xwo h LEU 67 CO 0.03 0.96 -0.03 -0.33 0.09 0.00 0.00 178.44 179.16 1xwo h GLU 68 N 1.17 0.90 -0.38 1.13 5.08 0.19 -2.72 114.58 119.96 1xwo h GLU 68 Ca 0.27 -0.30 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1xwo h GLU 68 Cb 0.19 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1xwo h GLU 68 CO -0.03 0.95 0.26 0.87 -1.00 0.00 0.00 179.01 180.06 1xwo h LYS 69 N 0.77 0.45 0.00 2.33 1.57 -1.03 0.15 116.57 120.81 1xwo h LYS 69 Ca 0.14 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1xwo h LYS 69 Cb 0.56 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1xwo h LYS 69 CO 0.03 0.30 -0.31 0.82 -0.57 0.00 0.00 179.45 179.72 1xwo h ILE 70 N 0.47 1.18 0.14 1.86 2.04 -1.13 -2.26 117.51 119.82 1xwo h ILE 70 Ca 0.15 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 1xwo h ILE 70 Cb 0.02 1.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1xwo h ILE 70 CO -0.03 0.31 -0.07 0.28 0.00 0.00 0.00 178.15 178.64 1xwo h SER 71 N 0.00 -0.16 -1.00 1.72 0.02 -0.57 -3.03 113.55 110.53 1xwo h SER 71 Ca -0.00 -0.32 0.23 0.00 -0.84 0.00 0.00 61.79 60.86 1xwo h SER 71 Cb 0.57 0.04 -0.10 0.00 0.14 0.00 0.00 62.40 63.05 1xwo h SER 71 CO 0.04 0.26 0.63 -0.33 -1.14 0.00 0.00 176.83 176.29 1xwo h GLU 72 N -0.62 0.52 -0.65 3.45 4.39 -1.16 -0.73 114.58 119.77 1xwo h GLU 72 Ca -0.02 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.59 1xwo h GLU 72 Cb 0.47 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 1xwo h GLU 72 CO 0.03 0.34 0.17 0.93 -1.16 0.00 0.00 179.01 179.32 1xwo h GLU 73 N 0.53 1.02 -0.01 2.33 5.08 -1.33 -1.42 114.58 120.78 1xwo h GLU 73 Ca 0.57 -0.23 -0.04 0.00 -1.00 0.00 0.00 59.36 58.67 1xwo h GLU 73 Cb 1.23 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1xwo h GLU 73 CO -0.32 0.90 -0.15 -1.49 -1.00 0.00 0.00 179.01 176.96 1xwo h TRP 74 N 0.98 0.17 -0.26 4.33 4.06 -1.05 0.40 115.95 124.57 1xwo h TRP 74 Ca 0.21 -0.08 0.02 0.00 2.06 0.00 0.00 58.89 61.10 1xwo h TRP 74 Cb 0.33 -0.02 -0.01 0.00 -1.00 0.00 0.00 29.16 28.46 1xwo h TRP 74 CO 0.02 0.84 0.17 0.66 -3.56 0.00 0.00 178.44 176.58 1xwo h SER 75 N -0.55 0.23 0.85 -3.49 4.64 -1.33 0.04 113.55 113.93 1xwo h SER 75 Ca -0.02 -0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.07 1xwo h SER 75 Cb 0.87 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.88 1xwo h SER 75 CO 0.03 0.16 -1.17 0.11 -0.87 0.00 0.00 176.83 175.09 1xwo h LYS 76 N 0.27 0.04 0.00 4.77 1.57 -1.24 -3.48 116.57 118.50 1xwo h LYS 76 Ca 0.10 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1xwo h LYS 76 Cb 0.09 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1xwo h LYS 76 CO -0.02 0.94 0.00 0.41 -0.57 0.00 0.00 179.45 180.21 1xwo n GLY 77 N 1.42 0.56 0.05 3.86 0.00 0.10 -4.92 105.19 106.26 1xwo n GLY 77 Ca -0.05 -0.75 0.11 0.00 0.00 0.00 0.00 46.02 45.34 1xwo n GLY 77 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1xwo n VAL 78 N -2.71 0.25 -1.63 1.61 3.14 0.80 -4.94 118.33 114.84 1xwo n VAL 78 Ca 0.00 -0.29 -0.50 0.00 -2.96 0.00 0.00 64.34 60.59 1xwo n VAL 78 Cb 0.00 0.07 -0.05 0.00 -1.06 0.00 0.00 33.84 32.80 1xwo n VAL 78 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 1xwo n PHE 79 N -2.07 1.87 -3.67 1.45 7.35 -0.73 -4.95 117.46 116.71 1xwo n PHE 79 Ca 0.02 0.46 -0.37 0.00 -0.76 0.00 0.00 57.45 56.80 1xwo n PHE 79 Cb 0.45 -2.44 -0.11 0.00 0.35 0.00 0.00 39.48 37.73 1xwo n PHE 79 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1xwo s VAL 80 N 1.12 4.96 -0.29 -2.13 0.11 -1.26 -5.01 120.40 117.90 1xwo s VAL 80 Ca 0.84 0.05 -0.20 0.00 -2.93 0.00 0.00 61.98 59.74 1xwo s VAL 80 Cb -0.85 -3.34 -0.01 0.00 -1.53 0.00 0.00 36.38 30.64 1xwo s VAL 80 CO 0.46 0.30 0.60 -0.69 -3.33 0.00 0.00 175.10 172.43 1xwo s VAL 81 N 1.58 4.98 0.92 2.04 1.01 -1.26 -5.06 120.40 124.61 1xwo s VAL 81 Ca 0.07 0.88 -0.11 0.00 0.00 0.00 0.00 61.98 62.82 1xwo s VAL 81 Cb -0.15 -3.95 0.15 0.00 0.00 0.00 0.00 36.38 32.43 1xwo s VAL 81 CO 0.07 -0.06 1.09 -0.89 0.00 0.00 0.00 175.10 175.31 1xwo s THR 82 N 2.51 2.54 -0.96 3.92 2.01 -1.26 -4.93 115.64 119.47 1xwo s THR 82 Ca 0.24 0.18 0.28 0.00 0.31 0.00 0.00 61.69 62.70 1xwo s THR 82 Cb -0.15 -2.53 0.20 0.00 0.01 0.00 0.00 72.50 70.03 1xwo s THR 82 CO 0.11 -0.23 1.82 1.67 -0.69 0.00 0.00 174.62 177.30 1xwo n GLN 83 N -4.05 0.03 -0.30 4.92 7.27 -1.26 -2.99 117.38 121.01 1xwo n GLN 83 Ca 0.07 0.02 0.11 0.00 0.07 0.00 0.00 57.00 57.28 1xwo n GLN 83 Cb 0.54 -1.54 0.28 0.00 2.41 0.00 0.00 30.24 31.94 1xwo n GLN 83 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1xwo n SER 84 N -1.60 3.53 -4.60 1.69 3.41 -1.26 -4.90 113.62 109.90 1xwo n SER 84 Ca 0.07 -1.99 -0.43 0.00 -0.26 0.00 0.00 58.87 56.26 1xwo n SER 84 Cb 0.35 -0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 1xwo n SER 84 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1xwo s ASP 85 N -1.14 6.67 -0.20 4.04 1.01 -1.16 -4.94 116.67 120.94 1xwo s ASP 85 Ca 0.43 0.57 -0.16 0.00 0.71 0.00 0.00 52.55 54.10 1xwo s ASP 85 Cb 0.23 -2.46 -0.12 0.00 1.01 0.00 0.00 42.92 41.59 1xwo s ASP 85 CO 0.31 -0.84 -0.10 -1.84 0.21 0.00 0.00 175.17 172.91 1xwo n GLU 86 N 6.74 0.54 -4.55 8.23 0.28 -1.26 -4.74 120.64 125.88 1xwo n GLU 86 Ca 0.07 0.44 -0.26 0.00 -0.16 0.00 0.00 57.16 57.25 1xwo n GLU 86 Cb 0.48 -1.63 -0.11 0.00 1.43 0.00 0.00 31.44 31.61 1xwo n GLU 86 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 1xwo s ASP 87 N -6.59 3.67 0.56 -1.84 3.84 -1.26 -3.40 116.67 111.66 1xwo s ASP 87 Ca -0.28 -1.23 0.25 0.00 -0.00 0.00 0.00 52.55 51.30 1xwo s ASP 87 Cb 0.07 -0.34 1.62 0.00 -1.38 0.00 0.00 42.92 42.89 1xwo s ASP 87 CO 0.45 -0.26 2.21 0.40 -0.00 0.00 0.00 175.17 177.97 1xwo h ILE 88 N 2.00 0.68 -0.51 2.11 5.03 -1.94 -1.56 117.51 123.31 1xwo h ILE 88 Ca -0.42 -0.06 -0.05 0.00 -0.12 0.00 0.00 64.86 64.21 1xwo h ILE 88 Cb 1.25 1.03 -0.02 0.00 -3.03 0.00 0.00 36.82 36.05 1xwo h ILE 88 CO 0.72 0.01 0.12 0.45 -0.68 0.00 0.00 178.15 178.77 1xwo h HIS 89 N 0.00 0.86 -0.21 1.37 3.86 -1.95 -1.36 115.15 117.72 1xwo h HIS 89 Ca -0.00 -0.11 -0.13 0.00 -1.16 0.00 0.00 60.37 58.98 1xwo h HIS 89 Cb 0.03 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.26 1xwo h HIS 89 CO 0.00 0.77 -0.36 1.15 0.86 0.00 0.00 177.93 180.34 1xwo h THR 90 N 0.71 1.33 0.61 2.45 2.02 -1.71 -1.20 112.91 117.11 1xwo h THR 90 Ca 0.16 -1.58 -0.02 0.00 0.77 0.00 0.00 66.41 65.73 1xwo h THR 90 Cb 0.34 1.83 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 1xwo h THR 90 CO 0.00 0.49 -0.51 0.00 0.37 0.00 0.00 175.52 175.88 1xwo h ALA 91 N 0.61 -1.20 -0.24 6.16 0.00 -1.33 0.14 119.26 123.39 1xwo h ALA 91 Ca 0.01 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1xwo h ALA 91 Cb 0.96 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1xwo h ALA 91 CO 0.08 -1.21 0.16 -0.91 0.00 0.00 0.00 179.25 177.37 1xwo h ASN 92 N -1.09 0.24 -0.11 0.00 4.21 -1.31 -0.24 115.58 117.28 1xwo h ASN 92 Ca -0.08 -0.01 -0.04 0.00 1.21 0.00 0.00 56.30 57.38 1xwo h ASN 92 Cb 0.92 -0.06 -0.00 0.00 -1.12 0.00 0.00 38.32 38.06 1xwo h ASN 92 CO -0.00 0.17 -0.09 -0.08 -1.29 0.00 0.00 177.43 176.14 1xwo h GLU 93 N 0.28 0.26 -0.08 0.81 4.81 -0.84 -2.01 114.58 117.81 1xwo h GLU 93 Ca 0.09 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1xwo h GLU 93 Cb 0.03 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.35 1xwo h GLU 93 CO -0.02 0.65 -0.38 -0.09 -0.73 0.00 0.00 179.01 178.44 1xwo h ARG 94 N -0.12 -0.47 0.22 1.92 2.43 -0.04 -0.20 114.38 118.13 1xwo h ARG 94 Ca 0.02 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1xwo h ARG 94 Cb 0.59 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.21 1xwo h ARG 94 CO 0.02 -0.31 -0.48 -0.09 -1.51 0.00 0.00 179.97 177.60 1xwo h ARG 95 N -0.49 -0.75 -0.94 0.20 9.65 -1.07 -1.66 114.38 119.33 1xwo h ARG 95 Ca 0.07 0.05 0.21 0.00 -1.10 0.00 0.00 59.98 59.21 1xwo h ARG 95 Cb 0.60 0.17 -0.12 0.00 -1.39 0.00 0.00 29.97 29.24 1xwo h ARG 95 CO -0.35 -0.50 0.50 1.25 2.80 0.00 0.00 179.97 183.67 1xwo h LEU 96 N -0.78 0.54 -0.51 3.80 5.85 -0.88 0.18 115.31 123.51 1xwo h LEU 96 Ca -0.01 0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 1xwo h LEU 96 Cb 0.76 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 1xwo h LEU 96 CO -0.21 0.11 -0.08 0.50 -0.34 0.00 0.00 178.44 178.42 1xwo h LYS 97 N 0.55 0.96 0.00 1.25 3.64 -0.66 0.15 116.57 122.45 1xwo h LYS 97 Ca 0.57 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1xwo h LYS 97 Cb 1.02 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1xwo h LYS 97 CO -0.46 1.01 0.00 1.05 -2.27 0.00 0.00 179.45 178.78 1xwo h GLU 98 N 0.82 0.00 0.00 1.90 4.11 0.03 1.56 114.58 123.00 1xwo h GLU 98 Ca 0.13 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.30 1xwo h GLU 98 Cb 0.63 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 1xwo h GLU 98 CO 0.04 0.00 -1.62 1.25 0.07 0.00 0.00 179.01 178.75 1xwo h LEU 99 N 0.00 0.00 0.00 3.06 5.85 -0.23 -3.41 115.31 120.57 1xwo h LEU 99 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1xwo h LEU 99 Cb 0.64 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1xwo h LEU 99 CO 0.00 0.93 -0.41 -0.38 -0.34 0.00 0.00 178.44 178.23 1xwo n ILE 100 N -3.03 0.00 -1.55 4.05 5.41 0.47 -5.02 119.36 119.69 1xwo n ILE 100 Ca -0.15 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.52 1xwo n ILE 100 Cb 1.01 0.48 0.00 0.00 -0.71 0.00 0.00 39.64 40.42 1xwo n ILE 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xwo n GLY 101 N 1.19 0.79 0.20 7.39 0.00 0.53 -4.40 105.19 110.90 1xwo n GLY 101 Ca 0.00 -1.37 -0.08 0.00 0.00 0.00 0.00 46.02 44.57 1xwo n GLY 101 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xwo h ASP 102 N 3.48 0.55 -0.99 1.61 3.32 -1.94 -3.13 116.42 119.31 1xwo h ASP 102 Ca 0.00 -0.08 0.26 0.00 0.02 0.00 0.00 57.03 57.23 1xwo h ASP 102 Cb 0.00 -0.14 -0.19 0.00 0.22 0.00 0.00 39.33 39.22 1xwo h ASP 102 CO 0.00 0.47 -0.03 0.40 -1.72 0.00 0.00 179.24 178.37 1xwo h ILE 103 N 0.59 0.01 -0.62 0.35 2.04 -1.96 0.73 117.51 118.65 1xwo h ILE 103 Ca 0.16 -0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.19 1xwo h ILE 103 Cb 0.04 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.10 1xwo h ILE 103 CO -0.03 0.00 0.45 0.00 0.00 0.00 0.00 178.15 178.57 1xwo h ALA 104 N 1.99 2.56 -0.77 1.87 0.00 -1.83 -1.97 119.26 121.11 1xwo h ALA 104 Ca 0.58 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.52 1xwo h ALA 104 Cb 1.14 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.92 1xwo h ALA 104 CO -0.95 -0.74 0.47 0.78 0.00 0.00 0.00 179.25 178.82 1xwo h GLY 105 N 0.02 1.14 1.84 0.00 0.00 0.32 -1.99 103.07 104.40 1xwo h GLY 105 Ca 0.30 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1xwo h GLY 105 CO -0.01 0.25 0.07 0.50 0.00 0.00 0.00 176.54 177.36 1xwo h LYS 106 N 0.89 0.00 0.00 4.80 1.57 -1.47 -2.49 116.57 119.86 1xwo h LYS 106 Ca 0.33 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.10 1xwo h LYS 106 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 1xwo h LYS 106 CO -0.15 0.00 -0.04 1.25 -0.57 0.00 0.00 179.45 179.94 1xwo h LEU 107 N 0.00 0.00 -0.02 2.94 5.85 -1.49 -2.44 115.31 120.15 1xwo h LEU 107 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1xwo h LEU 107 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1xwo h LEU 107 CO 0.00 0.04 -0.40 0.59 -0.34 0.00 0.00 178.44 178.33 1xwo n ASN 108 N -3.63 0.42 -4.66 1.25 3.02 -0.94 -4.86 115.26 105.86 1xwo n ASN 108 Ca -0.03 -0.13 -0.55 0.00 -0.03 0.00 0.00 54.58 53.85 1xwo n ASN 108 Cb 0.13 0.10 -0.07 0.00 -0.61 0.00 0.00 39.78 39.34 1xwo n ASN 108 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1xwo n THR 109 N -1.47 0.35 -1.14 3.41 -1.04 -0.92 -1.00 114.28 112.47 1xwo n THR 109 Ca 0.06 -0.09 -0.05 0.00 -2.04 0.00 0.00 64.05 61.93 1xwo n THR 109 Cb 0.34 -1.42 -0.02 0.00 -1.82 0.00 0.00 70.33 67.41 1xwo n THR 109 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xwo n GLY 110 N 4.62 0.74 3.55 3.41 0.00 -1.26 -4.99 105.19 111.26 1xwo n GLY 110 Ca 0.28 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 1xwo n GLY 110 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xwo s ARG 111 N -1.97 1.82 0.03 1.61 3.52 -0.17 -4.54 118.95 119.26 1xwo s ARG 111 Ca 0.00 -1.99 -0.11 0.00 -0.13 0.00 0.00 55.73 53.50 1xwo s ARG 111 Cb 0.00 -1.47 0.01 0.00 -1.56 0.00 0.00 34.95 31.93 1xwo s ARG 111 CO 0.00 -0.01 0.23 -1.54 -0.81 0.00 0.00 175.30 173.17 1xwo s SER 112 N -3.61 -0.03 0.59 -2.12 1.04 -1.26 -4.89 113.70 103.42 1xwo s SER 112 Ca 0.34 -0.27 0.29 0.00 0.48 0.00 0.00 55.95 56.78 1xwo s SER 112 Cb 0.07 0.30 1.63 0.00 0.10 0.00 0.00 66.02 68.13 1xwo s SER 112 CO 0.16 -0.55 2.07 0.03 0.98 0.00 0.00 173.24 175.94 1xwo h ARG 113 N 3.48 0.00 -0.14 4.02 -0.00 -1.99 -2.73 114.38 117.03 1xwo h ARG 113 Ca -0.32 0.00 0.03 0.00 -0.50 0.00 0.00 59.98 59.19 1xwo h ARG 113 Cb 1.19 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 31.13 1xwo h ARG 113 CO 0.46 0.00 -0.04 -0.91 0.00 0.00 0.00 179.97 179.48 1xwo h ASN 114 N 0.00 -0.15 1.42 7.04 -0.26 -1.90 -0.93 115.58 120.79 1xwo h ASN 114 Ca 0.10 0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 1xwo h ASN 114 Cb 0.57 0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.93 1xwo h ASN 114 CO -0.00 -0.06 0.00 1.05 -1.06 0.00 0.00 177.43 177.36 1xwo h GLU 115 N -0.02 0.00 0.00 0.81 4.11 -1.57 -3.17 114.58 114.75 1xwo h GLU 115 Ca 0.07 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.28 1xwo h GLU 115 Cb 0.12 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1xwo h GLU 115 CO -0.15 0.00 -1.13 1.96 0.07 0.00 0.00 179.01 179.76 1xwo h GLN 116 N 0.00 0.00 -0.15 1.06 4.20 -1.32 -2.77 115.11 116.13 1xwo h GLN 116 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1xwo h GLN 116 Cb 0.71 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 1xwo h GLN 116 CO 0.00 0.86 0.05 0.28 -0.67 0.00 0.00 178.83 179.35 1xwo h VAL 117 N 0.00 1.17 -0.10 -0.54 2.07 -1.15 -0.90 116.25 116.79 1xwo h VAL 117 Ca -0.07 -0.53 -0.13 0.00 0.82 0.00 0.00 66.70 66.79 1xwo h VAL 117 Cb 1.80 1.25 0.01 0.00 -1.52 0.00 0.00 31.29 32.82 1xwo h VAL 117 CO 0.11 0.16 -0.45 -0.37 0.02 0.00 0.00 177.57 177.05 1xwo h VAL 118 N 0.07 1.38 -0.78 2.57 -1.51 -1.69 -2.00 116.25 114.29 1xwo h VAL 118 Ca 0.05 -1.78 0.04 0.00 -1.23 0.00 0.00 66.70 63.78 1xwo h VAL 118 Cb 0.21 2.20 -0.05 0.00 -2.13 0.00 0.00 31.29 31.51 1xwo h VAL 118 CO -0.00 0.53 0.49 0.74 -1.23 0.00 0.00 177.57 178.10 1xwo h THR 119 N 0.07 1.08 0.66 7.19 2.02 -1.49 0.13 112.91 122.57 1xwo h THR 119 Ca -0.03 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.80 1xwo h THR 119 Cb 1.09 0.07 0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1xwo h THR 119 CO 0.09 0.17 -0.31 0.44 0.37 0.00 0.00 175.52 176.28 1xwo h ASP 120 N 0.93 -0.75 -0.96 4.18 3.32 -1.17 -1.81 116.42 120.16 1xwo h ASP 120 Ca 0.32 0.03 0.21 0.00 0.02 0.00 0.00 57.03 57.61 1xwo h ASP 120 Cb 0.07 0.19 -0.08 0.00 0.22 0.00 0.00 39.33 39.73 1xwo h ASP 120 CO -0.13 -0.36 0.62 0.25 -1.72 0.00 0.00 179.24 177.90 1xwo h LEU 121 N -1.23 0.52 -0.38 1.55 5.85 -1.26 0.46 115.31 120.83 1xwo h LEU 121 Ca -0.09 0.07 -0.17 0.00 0.84 0.00 0.00 57.88 58.52 1xwo h LEU 121 Cb 0.67 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 1xwo h LEU 121 CO 0.15 0.18 -0.47 0.11 -0.34 0.00 0.00 178.44 178.07 1xwo h LYS 122 N 0.51 0.86 -0.04 1.25 1.57 -0.69 -0.22 116.57 119.81 1xwo h LYS 122 Ca 0.53 -0.50 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1xwo h LYS 122 Cb 1.17 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.51 1xwo h LYS 122 CO -0.26 1.14 0.02 -0.07 -0.57 0.00 0.00 179.45 179.71 1xwo h LEU 123 N 0.68 0.05 -0.72 2.94 3.38 -0.15 0.20 115.31 121.69 1xwo h LEU 123 Ca 0.03 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 57.94 1xwo h LEU 123 Cb 1.07 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.74 1xwo h LEU 123 CO 0.11 0.18 0.38 0.15 0.09 0.00 0.00 178.44 179.35 1xwo h PHE 124 N -0.08 0.69 -0.55 1.13 3.57 -0.96 -1.49 116.94 119.25 1xwo h PHE 124 Ca 0.01 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.44 1xwo h PHE 124 Cb 0.15 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 1xwo h PHE 124 CO -0.03 0.28 -0.06 0.52 -2.23 0.00 0.00 178.31 176.79 1xwo h MET 125 N 0.66 1.00 -0.37 1.11 2.86 -0.42 -1.04 114.93 118.74 1xwo h MET 125 Ca 0.35 -0.34 0.07 0.00 -2.06 0.00 0.00 59.70 57.72 1xwo h MET 125 Cb 0.32 -0.08 -0.09 0.00 0.06 0.00 0.00 31.60 31.81 1xwo h MET 125 CO -0.24 1.02 -0.37 0.87 1.06 0.00 0.00 176.91 179.25 1xwo h LYS 126 N 0.90 -0.29 -0.27 1.72 1.57 0.45 0.48 116.57 121.14 1xwo h LYS 126 Ca 0.15 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 1xwo h LYS 126 Cb 0.61 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 1xwo h LYS 126 CO 0.04 -0.19 -0.03 -0.91 -0.57 0.00 0.00 179.45 177.79 1xwo h ASN 127 N -0.30 0.49 -0.31 0.86 2.35 -1.43 -2.76 115.58 114.48 1xwo h ASN 127 Ca 0.15 -0.34 0.05 0.00 -0.55 0.00 0.00 56.30 55.62 1xwo h ASN 127 Cb 0.56 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.75 1xwo h ASN 127 CO -0.53 0.71 -0.00 0.28 -1.65 0.00 0.00 177.43 176.23 1xwo h SER 128 N 0.26 -0.13 -0.15 5.81 0.02 0.12 0.15 113.55 119.63 1xwo h SER 128 Ca 0.07 0.07 0.04 0.00 -0.84 0.00 0.00 61.79 61.14 1xwo h SER 128 Cb 0.48 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1xwo h SER 128 CO 0.02 -0.03 0.13 -0.07 -1.14 0.00 0.00 176.83 175.74 1xwo h LEU 129 N 0.09 0.00 0.37 5.07 4.07 -0.08 -0.51 115.31 124.32 1xwo h LEU 129 Ca 0.15 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.09 1xwo h LEU 129 Cb 0.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.94 1xwo h LEU 129 CO -0.25 0.00 -0.18 -1.28 -1.08 0.00 0.00 178.44 175.65 1xwo h SER 130 N 0.00 -0.42 -0.64 -0.43 0.87 -0.46 0.09 113.55 112.55 1xwo h SER 130 Ca 0.07 -0.14 0.13 0.00 -1.23 0.00 0.00 61.79 60.62 1xwo h SER 130 Cb 0.33 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.36 1xwo h SER 130 CO -0.00 -0.04 0.43 0.58 -0.53 0.00 0.00 176.83 177.27 1xwo h VAL 131 N -0.86 0.83 -0.20 2.23 2.07 -0.21 -0.24 116.25 119.88 1xwo h VAL 131 Ca -0.05 -0.11 -0.19 0.00 0.82 0.00 0.00 66.70 67.17 1xwo h VAL 131 Cb 0.54 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1xwo h VAL 131 CO 0.08 0.06 -0.63 0.40 0.02 0.00 0.00 177.57 177.51 1xwo h ILE 132 N 0.33 1.30 0.51 4.57 2.04 -0.98 -2.99 117.51 122.29 1xwo h ILE 132 Ca 0.30 -1.86 -0.02 0.00 1.00 0.00 0.00 64.86 64.28 1xwo h ILE 132 Cb 0.73 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 1xwo h ILE 132 CO -0.08 0.59 -0.32 -1.28 0.00 0.00 0.00 178.15 177.06 1xwo h SER 133 N 0.51 -0.82 -0.62 1.72 0.87 0.78 0.29 113.55 116.29 1xwo h SER 133 Ca -0.01 0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.67 1xwo h SER 133 Cb 1.22 0.24 -0.04 0.00 -0.44 0.00 0.00 62.40 63.39 1xwo h SER 133 CO 0.13 -0.50 0.41 0.00 -0.53 0.00 0.00 176.83 176.33 1xwo h THR 134 N -0.79 0.99 -0.17 2.23 1.03 -1.41 -1.12 112.91 113.67 1xwo h THR 134 Ca -0.06 -0.20 -0.20 0.00 -0.01 0.00 0.00 66.41 65.94 1xwo h THR 134 Cb 0.65 0.35 0.00 0.00 -1.07 0.00 0.00 68.15 68.08 1xwo h THR 134 CO 0.05 0.11 -0.69 0.45 -0.01 0.00 0.00 175.52 175.42 1xwo h HIS 135 N 0.59 0.91 -0.05 0.00 -0.00 -1.32 -1.91 115.15 113.36 1xwo h HIS 135 Ca 0.27 -0.38 -0.07 0.00 -0.00 0.00 0.00 60.37 60.19 1xwo h HIS 135 Cb 0.30 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.55 1xwo h HIS 135 CO -0.00 1.18 -0.28 1.25 -0.00 0.00 0.00 177.93 180.08 1xwo h LEU 136 N 0.49 0.09 -0.07 2.43 5.85 -0.19 -2.21 115.31 121.70 1xwo h LEU 136 Ca -0.03 -0.03 -0.19 0.00 0.84 0.00 0.00 57.88 58.48 1xwo h LEU 136 Cb 1.30 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 42.31 1xwo h LEU 136 CO 0.14 0.38 -0.68 -0.07 -0.34 0.00 0.00 178.44 177.87 1xwo h LEU 137 N 0.09 0.72 -1.77 2.25 3.38 -1.15 -2.50 115.31 116.32 1xwo h LEU 137 Ca 0.01 -0.68 -0.02 0.00 0.09 0.00 0.00 57.88 57.28 1xwo h LEU 137 Cb 0.55 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1xwo h LEU 137 CO 0.04 1.30 -0.09 -0.61 0.09 0.00 0.00 178.44 179.17 1xwo h GLN 138 N 0.21 0.03 0.02 1.13 5.75 -1.08 0.53 115.11 121.70 1xwo h GLN 138 Ca -0.06 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1xwo h GLN 138 Cb 1.34 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.88 1xwo h GLN 138 CO 0.14 0.12 -0.01 1.25 -2.65 0.00 0.00 178.83 177.68 1xwo h LEU 139 N 0.03 -0.02 -0.20 -2.39 6.46 -1.38 -0.56 115.31 117.24 1xwo h LEU 139 Ca 0.01 -0.50 -0.00 0.00 -0.12 0.00 0.00 57.88 57.27 1xwo h LEU 139 Cb 0.18 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 1xwo h LEU 139 CO 0.01 0.49 0.12 0.40 -0.62 0.00 0.00 178.44 178.84 1xwo h ILE 140 N -0.55 1.10 -0.56 4.05 2.04 -0.93 0.31 117.51 122.96 1xwo h ILE 140 Ca -0.00 -0.25 0.05 0.00 1.00 0.00 0.00 64.86 65.66 1xwo h ILE 140 Cb 0.52 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 1xwo h ILE 140 CO 0.00 0.09 0.30 0.50 0.00 0.00 0.00 178.15 179.04 1xwo h LYS 141 N 0.24 0.55 -0.81 2.37 3.11 -0.01 -0.09 116.57 121.93 1xwo h LYS 141 Ca 0.07 -0.03 0.01 0.00 -2.81 0.00 0.00 60.65 57.89 1xwo h LYS 141 Cb 0.04 -0.12 -0.04 0.00 -1.00 0.00 0.00 32.23 31.11 1xwo h LYS 141 CO -0.01 0.37 0.53 1.15 -2.81 0.00 0.00 179.45 178.67 1xwo h THR 142 N 0.57 1.19 -0.40 1.00 2.02 -0.56 -1.64 112.91 115.09 1xwo h THR 142 Ca 0.24 -0.37 -0.11 0.00 0.77 0.00 0.00 66.41 66.95 1xwo h THR 142 Cb 0.13 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 1xwo h THR 142 CO -0.16 0.20 -0.20 -0.07 0.37 0.00 0.00 175.52 175.66 1xwo h LEU 143 N 1.07 0.79 -0.37 2.58 3.38 -0.15 -3.07 115.31 119.53 1xwo h LEU 143 Ca 0.30 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 1xwo h LEU 143 Cb -0.09 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 1xwo h LEU 143 CO -0.08 0.97 -0.20 0.58 0.09 0.00 0.00 178.44 179.80 1xwo h VAL 144 N 0.68 1.28 -0.31 1.22 2.07 -0.51 -2.55 116.25 118.14 1xwo h VAL 144 Ca 0.10 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 1xwo h VAL 144 Cb 0.71 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1xwo h VAL 144 CO 0.05 0.44 0.18 -0.33 0.02 0.00 0.00 177.57 177.94 1xwo h GLU 145 N 0.59 0.42 0.00 1.57 5.08 -1.30 -1.27 114.58 119.67 1xwo h GLU 145 Ca 0.08 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 58.22 1xwo h GLU 145 Cb 0.76 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1xwo h GLU 145 CO 0.06 0.30 -0.85 -0.09 -1.00 0.00 0.00 179.01 177.43 1xwo h ARG 146 N 0.43 0.14 0.00 2.33 2.43 -1.43 -2.27 114.38 115.99 1xwo h ARG 146 Ca 0.11 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1xwo h ARG 146 Cb -0.01 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1xwo h ARG 146 CO -0.02 0.90 0.00 0.00 -1.51 0.00 0.00 179.97 179.34 1xwo h ALA 147 N 1.05 1.00 0.05 2.80 0.00 -0.84 -0.50 119.26 122.81 1xwo h ALA 147 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xwo h ALA 147 Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1xwo h ALA 147 CO 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 179.25 179.35 1xwo h ALA 148 N 2.08 -0.15 -0.09 0.00 0.00 -0.96 -3.19 119.26 116.95 1xwo h ALA 148 Ca 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1xwo h ALA 148 Cb 0.42 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1xwo h ALA 148 CO 0.00 -0.15 -0.33 0.82 0.00 0.00 0.00 179.25 179.59 1xwo h ILE 149 N -0.35 0.27 -0.23 0.00 5.03 -1.36 -2.23 117.51 118.66 1xwo h ILE 149 Ca -0.01 0.00 -0.13 0.00 -0.12 0.00 0.00 64.86 64.60 1xwo h ILE 149 Cb 0.05 0.27 -0.07 0.00 -3.03 0.00 0.00 36.82 34.04 1xwo h ILE 149 CO 0.01 0.00 0.17 -0.62 -0.68 0.00 0.00 178.15 177.03 1xwo n GLU 150 N -5.41 1.32 0.27 2.37 1.02 -0.20 -4.52 120.64 115.48 1xwo n GLU 150 Ca -0.04 -0.71 0.12 0.00 -0.02 0.00 0.00 57.16 56.52 1xwo n GLU 150 Cb 0.33 -1.28 0.78 0.00 -0.02 0.00 0.00 31.44 31.25 1xwo n GLU 150 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1xwo h ILE 151 N 0.45 0.71 0.00 -3.67 2.10 -1.38 -2.58 117.51 113.14 1xwo h ILE 151 Ca 0.14 -0.17 -0.11 0.00 1.08 0.00 0.00 64.86 65.80 1xwo h ILE 151 Cb 1.29 1.10 -0.02 0.00 -1.09 0.00 0.00 36.82 38.11 1xwo h ILE 151 CO 0.29 0.04 -0.70 0.44 -1.08 0.00 0.00 178.15 177.14 1xwo h ASP 152 N 0.00 0.00 -3.53 2.19 3.45 -1.86 -3.44 116.42 113.23 1xwo h ASP 152 Ca -0.00 0.00 -0.57 0.00 0.43 0.00 0.00 57.03 56.89 1xwo h ASP 152 Cb 0.10 0.00 0.13 0.00 -0.56 0.00 0.00 39.33 39.00 1xwo h ASP 152 CO 0.01 0.49 0.42 0.52 -1.57 0.00 0.00 179.24 179.11 1xwo n VAL 153 N -3.14 2.80 -3.83 -1.35 0.31 -0.97 -4.89 118.33 107.26 1xwo n VAL 153 Ca -0.00 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 63.70 1xwo n VAL 153 Cb 0.75 -1.48 -0.13 0.00 -0.91 0.00 0.00 33.84 32.06 1xwo n VAL 153 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1xwo s ILE 154 N -1.25 -0.01 0.35 2.52 1.01 -1.26 -0.82 121.20 121.73 1xwo s ILE 154 Ca 0.64 0.03 0.03 0.00 0.00 0.00 0.00 60.65 61.36 1xwo s ILE 154 Cb -0.50 -0.14 -0.01 0.00 0.01 0.00 0.00 42.46 41.82 1xwo s ILE 154 CO 0.56 0.01 0.38 -1.48 0.00 0.00 0.00 174.94 174.41 1xwo s LEU 155 N 0.24 1.44 0.54 2.97 0.05 -0.70 -4.00 118.68 119.22 1xwo s LEU 155 Ca -0.02 -1.66 -0.20 0.00 0.05 0.00 0.00 54.13 52.30 1xwo s LEU 155 Cb -0.03 1.00 -0.05 0.00 -2.05 0.00 0.00 46.19 45.06 1xwo s LEU 155 CO -0.01 -1.20 1.16 -2.84 -0.55 0.00 0.00 176.35 172.91 1xwo s PRO 156 N -3.18 3.31 -0.13 1.48 0.02 -1.26 -1.64 135.00 133.59 1xwo s PRO 156 Ca 0.36 1.70 -0.05 0.00 0.02 0.00 0.00 61.00 63.03 1xwo s PRO 156 Cb 0.01 -2.04 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 1xwo s PRO 156 CO 0.25 -0.90 0.05 0.20 -0.33 0.00 0.00 177.00 176.27 1xwo s GLY 157 N -1.66 1.93 0.06 0.52 0.00 0.15 -4.77 107.32 103.56 1xwo s GLY 157 Ca 0.73 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 44.74 1xwo s GLY 157 CO 0.30 -0.27 -0.01 -0.19 0.00 0.00 0.00 173.10 172.92 1xwo s TYR 158 N -0.39 2.99 -0.11 1.90 1.51 -1.26 -0.36 117.35 121.62 1xwo s TYR 158 Ca 0.09 -0.01 -0.04 0.00 -1.01 0.00 0.00 57.07 56.10 1xwo s TYR 158 Cb -0.12 -1.57 0.06 0.00 -0.11 0.00 0.00 41.96 40.21 1xwo s TYR 158 CO 0.02 0.46 0.23 0.95 -1.11 0.00 0.00 175.55 176.10 1xwo s THR 159 N -1.21 -0.29 -1.55 -0.71 -4.23 -0.03 -4.76 115.64 102.86 1xwo s THR 159 Ca 0.23 0.27 0.00 0.00 -1.18 0.00 0.00 61.69 61.01 1xwo s THR 159 Cb -0.12 -0.38 0.00 0.00 1.34 0.00 0.00 72.50 73.34 1xwo s THR 159 CO 0.15 0.11 0.00 1.41 -0.54 0.00 0.00 174.62 175.75 1xwo n HIS 160 N 5.06 -0.36 -2.02 3.99 8.25 -1.26 -0.63 115.22 128.25 1xwo n HIS 160 Ca -0.11 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.19 1xwo n HIS 160 Cb 0.50 -3.03 -0.03 0.00 1.12 0.00 0.00 29.99 28.56 1xwo n HIS 160 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1xwo n LEU 161 N -2.05 -1.56 -4.45 2.41 7.94 -1.26 -4.99 117.00 113.03 1xwo n LEU 161 Ca -0.18 0.13 -0.29 0.00 -1.11 0.00 0.00 56.01 54.56 1xwo n LEU 161 Cb 0.58 -2.41 -0.12 0.00 0.53 0.00 0.00 43.42 42.00 1xwo n LEU 161 CO 0.23 -0.41 -0.52 -1.10 -1.11 0.00 0.00 177.39 174.48 1xwo s GLN 162 N -4.33 1.64 -0.32 1.96 -1.52 0.20 -5.05 119.66 112.23 1xwo s GLN 162 Ca 0.00 -1.25 -0.28 0.00 -1.95 0.00 0.00 55.36 51.88 1xwo s GLN 162 Cb 0.00 -2.03 -0.02 0.00 -0.22 0.00 0.00 33.01 30.74 1xwo s GLN 162 CO 0.00 0.47 1.88 0.15 -0.25 0.00 0.00 175.29 177.53 1xwo s LYS 163 N -2.13 3.26 -0.23 2.91 1.02 -1.26 -0.85 119.74 122.46 1xwo s LYS 163 Ca 0.17 1.49 -0.17 0.00 0.02 0.00 0.00 55.97 57.48 1xwo s LYS 163 Cb -0.10 -4.24 -0.13 0.00 -0.52 0.00 0.00 37.83 32.84 1xwo s LYS 163 CO 0.09 -1.95 -0.15 0.00 -0.92 0.00 0.00 175.35 172.42 1xwo n ALA 164 N 10.69 0.95 -3.57 5.17 0.00 0.51 -4.96 120.51 129.30 1xwo n ALA 164 Ca 0.24 -0.80 -0.05 0.00 0.00 0.00 0.00 53.44 52.83 1xwo n ALA 164 Cb 0.47 -0.12 -0.02 0.00 0.00 0.00 0.00 19.45 19.77 1xwo n ALA 164 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1xwo s GLN 165 N -2.48 0.55 0.65 0.00 -2.07 -1.21 -4.88 119.66 110.22 1xwo s GLN 165 Ca -0.32 -0.22 -0.18 0.00 -1.82 0.00 0.00 55.36 52.82 1xwo s GLN 165 Cb 0.09 0.24 -0.01 0.00 -1.09 0.00 0.00 33.01 32.25 1xwo s GLN 165 CO 0.49 -0.24 1.26 -2.14 -1.32 0.00 0.00 175.29 173.35 1xwo s PRO 166 N -2.72 2.56 -0.00 9.60 0.02 -1.26 0.33 135.00 143.53 1xwo s PRO 166 Ca 0.08 1.97 -0.27 0.00 0.02 0.00 0.00 61.00 62.80 1xwo s PRO 166 Cb -0.01 -1.86 0.06 0.00 0.02 0.00 0.00 34.50 32.72 1xwo s PRO 166 CO -0.06 -1.56 0.62 0.42 -0.33 0.00 0.00 177.00 176.08 1xwo s ILE 167 N -1.53 0.01 0.13 2.83 1.01 -0.66 -4.74 121.20 118.25 1xwo s ILE 167 Ca 0.80 -0.08 -0.30 0.00 0.00 0.00 0.00 60.65 61.08 1xwo s ILE 167 Cb -0.35 -0.97 -0.07 0.00 0.01 0.00 0.00 42.46 41.09 1xwo s ILE 167 CO 0.39 -0.04 1.11 -0.13 0.00 0.00 0.00 174.94 176.27 1xwo s ARG 168 N -1.73 4.55 0.45 2.79 0.52 -1.26 -1.72 118.95 122.55 1xwo s ARG 168 Ca -0.09 1.69 0.24 0.00 -0.52 0.00 0.00 55.73 57.05 1xwo s ARG 168 Cb -0.01 -3.32 1.26 0.00 0.52 0.00 0.00 34.95 33.40 1xwo s ARG 168 CO 0.05 -0.02 1.81 2.35 0.02 0.00 0.00 175.30 179.51 1xwo h TRP 169 N 5.75 0.39 -0.01 -0.53 2.91 -1.25 0.39 115.95 123.62 1xwo h TRP 169 Ca -0.43 0.01 -0.12 0.00 1.13 0.00 0.00 58.89 59.48 1xwo h TRP 169 Cb 1.21 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.73 1xwo h TRP 169 CO 0.64 0.05 -0.59 0.77 -1.03 0.00 0.00 178.44 178.29 1xwo h SER 170 N 0.25 0.02 -0.37 2.65 0.02 -1.78 -2.64 113.55 111.70 1xwo h SER 170 Ca 0.54 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.42 1xwo h SER 170 Cb 1.65 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 64.16 1xwo h SER 170 CO -0.17 0.60 0.03 -0.61 -1.14 0.00 0.00 176.83 175.55 1xwo h GLN 171 N 0.01 0.72 0.16 3.45 5.75 -0.57 -0.67 115.11 123.96 1xwo h GLN 171 Ca -0.01 -0.17 -0.01 0.00 -0.15 0.00 0.00 58.65 58.32 1xwo h GLN 171 Cb 1.04 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.50 1xwo h GLN 171 CO 0.08 0.71 -0.08 0.35 -2.65 0.00 0.00 178.83 177.23 1xwo h PHE 172 N 0.68 -0.20 -0.99 3.99 3.57 -1.22 -1.85 116.94 120.92 1xwo h PHE 172 Ca 0.14 -0.00 0.26 0.00 3.53 0.00 0.00 57.97 61.90 1xwo h PHE 172 Cb 0.37 0.07 -0.13 0.00 2.79 0.00 0.00 35.95 39.05 1xwo h PHE 172 CO 0.02 -0.13 0.56 -0.07 -2.23 0.00 0.00 178.31 176.46 1xwo h LEU 173 N -0.23 0.58 -1.08 0.59 3.38 -1.45 0.18 115.31 117.28 1xwo h LEU 173 Ca -0.02 0.15 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 1xwo h LEU 173 Cb 0.17 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1xwo h LEU 173 CO 0.04 0.02 -0.32 -0.07 0.09 0.00 0.00 178.44 178.19 1xwo h LEU 174 N 0.48 0.24 -0.78 1.67 3.38 -1.10 0.23 115.31 119.44 1xwo h LEU 174 Ca 0.66 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.49 1xwo h LEU 174 Cb 1.32 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.97 1xwo h LEU 174 CO -0.52 0.56 0.30 0.77 0.09 0.00 0.00 178.44 179.64 1xwo h SER 175 N 0.21 1.09 -0.06 -0.43 4.64 0.25 0.69 113.55 119.94 1xwo h SER 175 Ca 0.03 -0.18 -0.23 0.00 -0.47 0.00 0.00 61.79 60.94 1xwo h SER 175 Cb 0.68 -0.28 0.01 0.00 -0.31 0.00 0.00 62.40 62.50 1xwo h SER 175 CO 0.05 0.97 -0.83 0.45 -0.87 0.00 0.00 176.83 176.61 1xwo h HIS 176 N 1.14 1.00 -0.85 4.77 3.86 -1.25 -2.79 115.15 121.02 1xwo h HIS 176 Ca 0.26 -0.46 -0.02 0.00 -1.16 0.00 0.00 60.37 58.99 1xwo h HIS 176 Cb 0.23 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.52 1xwo h HIS 176 CO 0.02 1.29 0.46 0.00 0.86 0.00 0.00 177.93 180.55 1xwo h ALA 177 N 0.58 1.09 -0.31 2.45 0.00 0.22 -1.39 119.26 121.90 1xwo h ALA 177 Ca -0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1xwo h ALA 177 Cb 1.45 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1xwo h ALA 177 CO 0.16 0.61 0.08 0.28 0.00 0.00 0.00 179.25 180.38 1xwo h VAL 178 N 1.19 1.15 0.00 0.00 2.07 0.44 -1.73 116.25 119.36 1xwo h VAL 178 Ca 0.30 -0.52 -0.23 0.00 0.82 0.00 0.00 66.70 67.07 1xwo h VAL 178 Cb 0.05 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1xwo h VAL 178 CO -0.05 0.19 -1.14 0.00 0.02 0.00 0.00 177.57 176.60 1xwo h ALA 179 N 1.64 0.43 0.00 1.67 0.00 -1.22 -2.96 119.26 118.82 1xwo h ALA 179 Ca 0.11 -1.02 -0.01 0.00 0.00 0.00 0.00 54.91 53.99 1xwo h ALA 179 Cb 0.17 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xwo h ALA 179 CO -0.00 1.31 -0.06 -0.07 0.00 0.00 0.00 179.25 180.43 1xwo h LEU 180 N 0.00 0.00 0.00 0.00 4.07 -0.84 -2.67 115.31 115.87 1xwo h LEU 180 Ca -0.06 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.69 1xwo h LEU 180 Cb 1.82 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.53 1xwo h LEU 180 CO 0.12 0.06 -1.07 0.74 -1.08 0.00 0.00 178.44 177.21 1xwo h THR 181 N 0.00 1.31 0.00 0.22 2.02 -1.29 -3.07 112.91 112.10 1xwo h THR 181 Ca -0.00 -2.97 -0.07 0.00 0.77 0.00 0.00 66.41 64.14 1xwo h THR 181 Cb 0.73 2.63 -0.01 0.00 -1.74 0.00 0.00 68.15 69.77 1xwo h THR 181 CO 0.01 0.75 -0.31 0.03 0.37 0.00 0.00 175.52 176.37 1xwo h ARG 182 N 0.00 0.00 -0.39 6.66 3.08 -1.31 -2.65 114.38 119.77 1xwo h ARG 182 Ca -0.07 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 1xwo h ARG 182 Cb 1.73 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.77 1xwo h ARG 182 CO 0.10 0.31 -0.15 -0.44 -1.07 0.00 0.00 179.97 178.72 1xwo h ASP 183 N 0.00 0.80 -0.72 7.04 3.45 -1.46 -2.25 116.42 123.28 1xwo h ASP 183 Ca -0.00 -0.39 0.02 0.00 0.43 0.00 0.00 57.03 57.09 1xwo h ASP 183 Cb 0.63 -0.22 -0.04 0.00 -0.56 0.00 0.00 39.33 39.14 1xwo h ASP 183 CO 0.04 1.01 0.47 -1.28 -1.57 0.00 0.00 179.24 177.91 1xwo h SER 184 N 0.59 0.77 0.25 6.45 0.87 -1.40 0.44 113.55 121.53 1xwo h SER 184 Ca 0.09 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1xwo h SER 184 Cb 0.69 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1xwo h SER 184 CO 0.05 0.54 -0.12 -0.08 -0.53 0.00 0.00 176.83 176.69 1xwo h GLU 185 N 0.91 -0.32 -0.72 2.24 4.81 -1.23 -1.41 114.58 118.85 1xwo h GLU 185 Ca 0.28 0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.60 1xwo h GLU 185 Cb -0.00 0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.39 1xwo h GLU 185 CO -0.07 -0.09 0.40 0.00 -0.73 0.00 0.00 179.01 178.51 1xwo h ARG 186 N -0.51 0.69 -0.47 1.92 3.08 -0.77 -2.24 114.38 116.08 1xwo h ARG 186 Ca -0.03 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.01 1xwo h ARG 186 Cb 0.38 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 1xwo h ARG 186 CO 0.06 0.46 0.25 1.25 -1.07 0.00 0.00 179.97 180.91 1xwo h LEU 187 N 0.71 0.37 -1.54 3.04 6.46 0.13 -1.51 115.31 122.98 1xwo h LEU 187 Ca 0.33 0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 58.07 1xwo h LEU 187 Cb 0.25 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 1xwo h LEU 187 CO -0.21 0.26 -0.12 1.23 -0.62 0.00 0.00 178.44 178.98 1xwo h GLY 188 N 0.49 0.15 1.18 3.75 0.00 -0.70 -1.09 103.07 106.86 1xwo h GLY 188 Ca 0.20 -0.09 -0.18 0.00 0.00 0.00 0.00 47.33 47.26 1xwo h GLY 188 CO -0.13 0.08 -0.53 0.83 0.00 0.00 0.00 176.54 176.80 1xwo h GLU 189 N 0.14 0.87 -0.15 4.80 5.08 -0.86 -2.17 114.58 122.29 1xwo h GLU 189 Ca 0.03 -0.54 -0.01 0.00 -1.00 0.00 0.00 59.36 57.84 1xwo h GLU 189 Cb 0.31 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1xwo h GLU 189 CO 0.02 1.18 0.04 0.28 -1.00 0.00 0.00 179.01 179.52 1xwo h VAL 190 N 0.67 1.20 -0.95 3.13 2.07 -0.99 -2.63 116.25 118.75 1xwo h VAL 190 Ca 0.02 -0.62 0.18 0.00 0.82 0.00 0.00 66.70 67.10 1xwo h VAL 190 Cb 1.13 1.32 -0.08 0.00 -1.52 0.00 0.00 31.29 32.14 1xwo h VAL 190 CO 0.12 0.19 0.60 0.50 0.02 0.00 0.00 177.57 179.00 1xwo h LYS 191 N 0.06 0.62 -0.80 1.57 3.64 -1.09 -2.17 116.57 118.39 1xwo h LYS 191 Ca 0.05 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1xwo h LYS 191 Cb 0.25 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 1xwo h LYS 191 CO 0.00 0.41 0.43 0.00 -2.27 0.00 0.00 179.45 178.02 1xwo h ARG 192 N 0.64 1.11 0.00 1.90 3.08 -1.00 -0.95 114.38 119.16 1xwo h ARG 192 Ca 0.51 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.43 1xwo h ARG 192 Cb 0.94 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.77 1xwo h ARG 192 CO -0.26 0.82 -0.13 0.54 -1.07 0.00 0.00 179.97 179.87 1xwo n ARG 193 N -4.34 0.27 0.04 0.04 1.74 -0.86 -3.00 116.66 110.54 1xwo n ARG 193 Ca 0.08 0.19 -0.03 0.00 -0.77 0.00 0.00 57.85 57.32 1xwo n ARG 193 Cb 0.10 -1.78 -0.09 0.00 -1.02 0.00 0.00 32.46 29.67 1xwo n ARG 193 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1xwo h ILE 194 N 0.00 0.84 0.00 0.55 2.04 -0.95 -3.35 117.51 116.64 1xwo h ILE 194 Ca 0.00 -2.44 0.00 0.00 1.00 0.00 0.00 64.86 63.42 1xwo h ILE 194 Cb 0.74 2.32 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 1xwo h ILE 194 CO 0.00 0.48 0.00 -3.20 0.00 0.00 0.00 178.15 175.43 1xwo n ASN 195 N -3.06 3.07 -4.13 1.72 5.15 -0.40 -4.71 115.26 112.90 1xwo n ASN 195 Ca -0.08 -1.76 -0.31 0.00 -0.60 0.00 0.00 54.58 51.82 1xwo n ASN 195 Cb 0.90 -0.59 -0.17 0.00 -0.53 0.00 0.00 39.78 39.39 1xwo n ASN 195 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1xwo s VAL 196 N 0.34 1.87 -0.42 3.44 1.01 -1.26 -0.97 120.40 124.41 1xwo s VAL 196 Ca 0.00 -0.86 -0.29 0.00 0.00 0.00 0.00 61.98 60.83 1xwo s VAL 196 Cb 0.00 -1.67 0.01 0.00 0.00 0.00 0.00 36.38 34.72 1xwo s VAL 196 CO 0.00 0.51 1.45 -0.22 0.00 0.00 0.00 175.10 176.85 1xwo s LEU 197 N 0.90 3.56 0.38 3.92 0.20 0.76 -4.79 118.68 123.61 1xwo s LEU 197 Ca -0.06 0.82 0.20 0.00 0.69 0.00 0.00 54.13 55.78 1xwo s LEU 197 Cb -0.15 -3.49 0.31 0.00 -0.43 0.00 0.00 46.19 42.43 1xwo s LEU 197 CO -0.02 -1.49 1.58 1.55 -0.29 0.00 0.00 176.35 177.67 1xwo h PRO 198 N 10.99 0.00 -6.24 0.98 0.13 -1.91 -2.56 132.00 133.39 1xwo h PRO 198 Ca -0.28 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.19 1xwo h PRO 198 Cb 1.11 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.26 1xwo h PRO 198 CO 1.09 0.21 1.00 -0.11 -0.23 0.00 0.00 178.00 179.96 1xwo n LEU 199 N -3.17 3.04 0.00 1.56 0.00 -1.26 -2.51 117.00 114.66 1xwo n LEU 199 Ca 0.03 1.01 0.00 0.00 0.00 0.00 0.00 56.01 57.05 1xwo n LEU 199 Cb 0.59 -1.29 0.00 0.00 0.00 0.00 0.00 43.42 42.72 1xwo n LEU 199 CO 0.36 -0.21 0.00 0.61 0.00 0.00 0.00 177.39 178.15 1xwo n GLY 200 N 4.24 1.62 1.10 -3.96 0.00 -1.26 -4.95 105.19 101.98 1xwo n GLY 200 Ca 0.24 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.35 1xwo n GLY 200 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xwo n SER 201 N 0.00 3.54 0.00 1.61 7.64 -1.05 -2.28 113.62 123.09 1xwo n SER 201 Ca 0.00 -1.98 0.00 0.00 1.01 0.00 0.00 58.87 57.90 1xwo n SER 201 Cb 0.00 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 1xwo n SER 201 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xwo n GLY 202 N 1.27 1.25 0.11 0.23 0.00 -1.20 -0.71 105.19 106.14 1xwo n GLY 202 Ca 0.20 -0.56 -0.00 0.00 0.00 0.00 0.00 46.02 45.65 1xwo n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xwo h ALA 203 N -0.84 0.62 0.00 4.61 0.00 -1.90 -3.30 119.26 118.44 1xwo h ALA 203 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1xwo h ALA 203 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1xwo h ALA 203 CO 0.00 0.86 0.00 1.47 0.00 0.00 0.00 179.25 181.58 1xwo n LEU 204 N -3.13 0.00 -1.32 0.00 -0.00 -1.19 -4.80 117.00 106.57 1xwo n LEU 204 Ca -0.03 0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.09 1xwo n LEU 204 Cb 0.81 0.00 0.31 0.00 -0.00 0.00 0.00 43.42 44.55 1xwo n LEU 204 CO 0.43 0.00 0.77 0.00 -0.00 0.00 0.00 177.39 178.58 1xwo n ALA 205 N -0.01 2.43 0.00 1.47 0.00 -1.25 -2.37 120.51 120.78 1xwo n ALA 205 Ca 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 52.12 1xwo n ALA 205 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1xwo n ALA 205 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xwo n GLY 206 N 1.50 -3.03 3.71 0.00 0.00 0.11 -4.91 105.19 102.56 1xwo n GLY 206 Ca 0.24 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 1xwo n GLY 206 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xwo s ASN 207 N -1.72 7.36 0.13 1.61 3.84 -0.96 -3.23 114.94 121.97 1xwo s ASN 207 Ca 0.00 1.65 0.08 0.00 0.21 0.00 0.00 52.86 54.80 1xwo s ASN 207 Cb 0.00 -2.57 -0.19 0.00 -0.55 0.00 0.00 41.25 37.94 1xwo s ASN 207 CO 0.00 -0.28 1.28 1.55 -2.79 0.00 0.00 177.10 176.87 1xwo h PRO 208 N 6.82 0.00 -0.42 0.43 0.13 -1.91 -3.31 132.00 133.75 1xwo h PRO 208 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1xwo h PRO 208 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1xwo h PRO 208 CO 0.76 0.95 0.00 1.28 -0.23 0.00 0.00 178.00 180.76 1xwo n LEU 209 N -3.33 1.75 -3.53 1.56 4.77 -1.26 -4.90 117.00 112.05 1xwo n LEU 209 Ca -0.00 -0.88 -0.19 0.00 -0.03 0.00 0.00 56.01 54.91 1xwo n LEU 209 Cb 0.92 -0.28 0.07 0.00 -2.33 0.00 0.00 43.42 41.81 1xwo n LEU 209 CO 0.46 0.36 0.09 -0.67 -1.33 0.00 0.00 177.39 176.31 1xwo n ASP 210 N 0.26 -2.57 -4.77 -1.43 2.03 -1.25 -4.93 116.55 103.90 1xwo n ASP 210 Ca 0.09 -0.66 -0.39 0.00 0.52 0.00 0.00 54.79 54.35 1xwo n ASP 210 Cb 0.32 -4.84 -0.00 0.00 -0.72 0.00 0.00 41.12 35.88 1xwo n ASP 210 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1xwo s ILE 211 N -3.42 2.62 -1.04 5.18 1.10 -1.26 -4.91 121.20 119.47 1xwo s ILE 211 Ca 0.11 0.55 -0.22 0.00 -0.51 0.00 0.00 60.65 60.58 1xwo s ILE 211 Cb -0.05 -3.32 0.06 0.00 0.15 0.00 0.00 42.46 39.30 1xwo s ILE 211 CO 0.75 0.07 1.45 -0.62 -2.11 0.00 0.00 174.94 174.48 1xwo s ASP 212 N -0.78 6.55 0.54 4.50 2.15 -1.26 -4.82 116.67 123.55 1xwo s ASP 212 Ca 0.58 -1.63 0.36 0.00 0.43 0.00 0.00 52.55 52.29 1xwo s ASP 212 Cb -0.38 -2.55 1.94 0.00 -0.30 0.00 0.00 42.92 41.64 1xwo s ASP 212 CO 0.48 -1.42 2.11 0.03 -0.17 0.00 0.00 175.17 176.19 1xwo h ARG 213 N 9.45 0.00 0.31 4.34 3.08 -1.92 -2.11 114.38 127.54 1xwo h ARG 213 Ca 0.22 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.26 1xwo h ARG 213 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1xwo h ARG 213 CO 1.40 0.00 -0.15 1.49 -1.07 0.00 0.00 179.97 181.64 1xwo h GLU 214 N 0.00 -0.40 -0.79 0.04 4.57 -1.98 -0.56 114.58 115.46 1xwo h GLU 214 Ca 0.00 0.03 0.16 0.00 -1.18 0.00 0.00 59.36 58.37 1xwo h GLU 214 Cb 0.03 0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.66 1xwo h GLU 214 CO 0.00 -0.09 0.53 1.98 -1.18 0.00 0.00 179.01 180.24 1xwo h MET 215 N -0.74 0.39 -0.15 1.92 4.05 -1.80 -0.45 114.93 118.15 1xwo h MET 215 Ca -0.04 -0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.31 1xwo h MET 215 Cb 0.50 -0.09 -0.00 0.00 -0.80 0.00 0.00 31.60 31.21 1xwo h MET 215 CO 0.07 0.25 -0.08 -0.07 0.23 0.00 0.00 176.91 177.31 1xwo h LEU 216 N 0.40 0.33 -1.43 3.39 4.07 -1.38 0.61 115.31 121.31 1xwo h LEU 216 Ca 0.39 -0.42 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 1xwo h LEU 216 Cb 0.95 -0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.57 1xwo h LEU 216 CO -0.13 0.69 0.31 -0.09 -1.08 0.00 0.00 178.44 178.14 1xwo h ARG 217 N -0.02 0.70 0.03 1.13 2.43 0.34 -1.38 114.38 117.62 1xwo h ARG 217 Ca 0.03 -0.06 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 1xwo h ARG 217 Cb 0.56 -0.15 0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1xwo h ARG 217 CO 0.02 0.49 -0.88 1.03 -1.51 0.00 0.00 179.97 179.13 1xwo h SER 218 N 0.71 0.71 -0.38 -3.80 0.87 -1.05 0.13 113.55 110.74 1xwo h SER 218 Ca 0.19 -0.78 -0.07 0.00 -1.23 0.00 0.00 61.79 59.89 1xwo h SER 218 Cb -0.03 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.69 1xwo h SER 218 CO -0.04 1.41 -0.02 -0.08 -0.53 0.00 0.00 176.83 177.57 1xwo h GLU 219 N 0.10 0.77 -0.01 2.24 4.57 -0.47 -2.88 114.58 118.89 1xwo h GLU 219 Ca -0.12 -0.21 0.00 0.00 -1.18 0.00 0.00 59.36 57.85 1xwo h GLU 219 Cb 1.57 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 30.08 1xwo h GLU 219 CO 0.17 0.79 -0.13 1.28 -1.18 0.00 0.00 179.01 179.94 1xwo n LEU 220 N -4.21 1.49 -2.69 1.64 4.77 -0.56 -4.96 117.00 112.49 1xwo n LEU 220 Ca 0.02 -0.47 -0.14 0.00 -0.03 0.00 0.00 56.01 55.39 1xwo n LEU 220 Cb 0.31 -0.05 0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1xwo n LEU 220 CO 0.42 0.26 0.12 0.47 -1.33 0.00 0.00 177.39 177.32 1xwo n ASP 221 N -0.05 -3.32 -4.90 -1.43 8.00 -1.02 -5.04 116.55 108.80 1xwo n ASP 221 Ca 0.15 -0.41 -0.29 0.00 0.71 0.00 0.00 54.79 54.95 1xwo n ASP 221 Cb 0.38 -3.71 -0.04 0.00 -0.02 0.00 0.00 41.12 37.73 1xwo n ASP 221 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1xwo s PHE 222 N -3.24 3.47 0.17 1.24 0.40 0.42 -5.01 117.98 115.43 1xwo s PHE 222 Ca 0.17 0.59 -0.10 0.00 -0.60 0.00 0.00 56.93 57.00 1xwo s PHE 222 Cb -0.08 -2.05 0.02 0.00 0.51 0.00 0.00 43.02 41.42 1xwo s PHE 222 CO 0.51 0.27 1.58 0.00 0.70 0.00 0.00 175.22 178.28 1xwo h ALA 223 N 2.04 0.73 -2.09 5.36 0.00 -1.34 -3.43 119.26 120.53 1xwo h ALA 223 Ca -0.47 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1xwo h ALA 223 Cb 1.18 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1xwo h ALA 223 CO 0.68 0.67 0.06 -1.13 0.00 0.00 0.00 179.25 179.53 1xwo n SER 224 N -4.14 -0.39 -4.60 0.00 3.41 -1.19 -5.05 113.62 101.66 1xwo n SER 224 Ca 0.01 -1.26 -0.24 0.00 -0.26 0.00 0.00 58.87 57.12 1xwo n SER 224 Cb 0.42 0.64 -0.08 0.00 -0.26 0.00 0.00 64.21 64.93 1xwo n SER 224 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1xwo s ILE 225 N -2.77 3.23 0.49 -1.33 -4.36 -1.26 -0.17 121.20 115.02 1xwo s ILE 225 Ca 0.03 -1.92 -0.22 0.00 -0.26 0.00 0.00 60.65 58.28 1xwo s ILE 225 Cb -0.01 -2.69 -0.07 0.00 1.25 0.00 0.00 42.46 40.95 1xwo s ILE 225 CO 0.02 -0.31 1.19 -0.94 0.24 0.00 0.00 174.94 175.14 1xwo s SER 226 N -3.42 5.96 -0.05 4.36 1.04 -0.96 -4.78 113.70 115.84 1xwo s SER 226 Ca 0.29 2.35 -0.05 0.00 0.48 0.00 0.00 55.95 59.02 1xwo s SER 226 Cb -0.07 -2.60 -0.28 0.00 0.10 0.00 0.00 66.02 63.17 1xwo s SER 226 CO 0.18 -1.07 0.63 -0.07 0.98 0.00 0.00 173.24 173.90 1xwo h LEU 227 N 1.82 0.44 -7.73 2.42 3.38 -2.00 -3.46 115.31 110.19 1xwo h LEU 227 Ca -0.50 -0.75 -0.56 0.00 0.09 0.00 0.00 57.88 56.16 1xwo h LEU 227 Cb 1.26 -0.14 -0.37 0.00 0.09 0.00 0.00 40.66 41.49 1xwo h LEU 227 CO 0.59 1.64 -0.81 0.21 0.09 0.00 0.00 178.44 180.17 1xwo s ASN 228 N -7.02 2.64 0.24 -0.43 2.47 -1.26 -5.03 114.94 106.55 1xwo s ASN 228 Ca -0.15 -0.53 -0.05 0.00 0.42 0.00 0.00 52.86 52.56 1xwo s ASN 228 Cb 0.06 -0.99 0.42 0.00 -1.45 0.00 0.00 41.25 39.30 1xwo s ASN 228 CO 0.83 -0.13 1.76 0.77 -3.72 0.00 0.00 177.10 176.61 1xwo h SER 229 N 8.11 0.43 0.32 -4.21 4.64 -1.89 0.23 113.55 121.18 1xwo h SER 229 Ca -0.30 0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.09 1xwo h SER 229 Cb 1.12 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1xwo h SER 229 CO 0.44 0.21 -0.15 0.24 -0.87 0.00 0.00 176.83 176.70 1xwo h MET 230 N 0.57 -0.41 -0.84 4.77 2.86 -1.78 -0.96 114.93 119.14 1xwo h MET 230 Ca 0.40 0.03 0.04 0.00 -2.06 0.00 0.00 59.70 58.11 1xwo h MET 230 Cb 0.51 0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.21 1xwo h MET 230 CO -0.33 -0.23 0.53 0.22 1.06 0.00 0.00 176.91 178.16 1xwo h ASP 231 N -0.49 0.87 -0.49 1.22 3.58 -1.75 -2.30 116.42 117.07 1xwo h ASP 231 Ca -0.04 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.35 1xwo h ASP 231 Cb 0.37 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.21 1xwo h ASP 231 CO 0.07 0.59 0.10 0.00 -2.88 0.00 0.00 179.24 177.12 1xwo h ALA 232 N 1.36 1.15 0.00 -0.78 0.00 -0.33 -1.61 119.26 119.05 1xwo h ALA 232 Ca 0.34 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1xwo h ALA 232 Cb 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1xwo h ALA 232 CO -0.13 0.57 -0.37 0.97 0.00 0.00 0.00 179.25 180.29 1xwo h ILE 233 N 0.82 0.65 -0.00 0.00 6.09 -0.83 -3.38 117.51 120.85 1xwo h ILE 233 Ca 0.17 -1.84 0.00 0.00 -1.37 0.00 0.00 64.86 61.82 1xwo h ILE 233 Cb 0.35 2.26 0.00 0.00 0.47 0.00 0.00 36.82 39.90 1xwo h ILE 233 CO 0.00 0.36 -0.01 -1.54 -3.07 0.00 0.00 178.15 173.89 1xwo n SER 234 N -3.22 1.08 -4.88 2.19 3.41 -0.89 -4.50 113.62 106.80 1xwo n SER 234 Ca 0.02 -1.04 -0.33 0.00 -0.26 0.00 0.00 58.87 57.26 1xwo n SER 234 Cb 0.66 0.12 -0.05 0.00 -0.26 0.00 0.00 64.21 64.68 1xwo n SER 234 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1xwo s GLU 235 N -0.33 3.73 -0.28 4.33 4.04 -0.62 -4.87 118.70 124.70 1xwo s GLU 235 Ca 0.03 0.12 0.18 0.00 0.04 0.00 0.00 54.97 55.34 1xwo s GLU 235 Cb 0.02 -2.89 0.49 0.00 0.02 0.00 0.00 34.13 31.77 1xwo s GLU 235 CO 0.04 0.49 1.11 0.54 -1.84 0.00 0.00 175.26 175.60 1xwo n ARG 236 N 0.49 2.10 0.13 -4.83 5.12 -1.26 -4.85 116.66 113.56 1xwo n ARG 236 Ca -0.05 -3.65 -0.01 0.00 -1.93 0.00 0.00 57.85 52.21 1xwo n ARG 236 Cb 0.52 -1.72 0.24 0.00 -1.16 0.00 0.00 32.46 30.34 1xwo n ARG 236 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1xwo h ASP 237 N 2.57 0.11 0.65 0.55 3.32 -1.98 -1.82 116.42 119.82 1xwo h ASP 237 Ca -0.01 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 1xwo h ASP 237 Cb 1.30 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.81 1xwo h ASP 237 CO 0.37 0.57 -0.22 2.19 -1.72 0.00 0.00 179.24 180.42 1xwo h PHE 238 N 0.09 0.00 0.09 4.55 -5.15 -1.93 0.48 116.94 115.06 1xwo h PHE 238 Ca 0.00 0.00 -0.17 0.00 -0.20 0.00 0.00 57.97 57.60 1xwo h PHE 238 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.04 1xwo h PHE 238 CO 0.01 0.22 -0.82 0.28 -2.00 0.00 0.00 178.31 176.00 1xwo h VAL 239 N 0.00 1.40 -0.32 0.88 2.07 -1.84 -2.87 116.25 115.57 1xwo h VAL 239 Ca -0.00 -2.43 -0.05 0.00 0.82 0.00 0.00 66.70 65.04 1xwo h VAL 239 Cb 0.60 3.03 -0.01 0.00 -1.52 0.00 0.00 31.29 33.40 1xwo h VAL 239 CO 0.03 0.65 0.00 0.58 0.02 0.00 0.00 177.57 178.85 1xwo h VAL 240 N -0.56 1.26 -0.11 2.57 2.07 -1.12 -1.73 116.25 118.63 1xwo h VAL 240 Ca -0.17 -0.95 0.03 0.00 0.82 0.00 0.00 66.70 66.43 1xwo h VAL 240 Cb 1.49 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 32.47 1xwo h VAL 240 CO 0.06 0.31 -0.06 -0.08 0.02 0.00 0.00 177.57 177.81 1xwo h GLU 241 N 0.37 -0.06 -0.81 1.57 4.81 -0.19 0.22 114.58 120.50 1xwo h GLU 241 Ca 0.09 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.42 1xwo h GLU 241 Cb 0.44 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.78 1xwo h GLU 241 CO 0.02 -0.04 0.53 0.35 -0.73 0.00 0.00 179.01 179.13 1xwo h PHE 242 N -0.06 0.82 -0.27 0.92 3.57 -1.36 -1.70 116.94 118.85 1xwo h PHE 242 Ca 0.07 0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.40 1xwo h PHE 242 Cb 0.16 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.64 1xwo h PHE 242 CO -0.19 0.39 -0.57 -0.07 -2.23 0.00 0.00 178.31 175.64 1xwo h LEU 243 N 0.77 0.97 -0.27 0.59 4.07 -0.31 -0.83 115.31 120.30 1xwo h LEU 243 Ca 0.37 -0.53 -0.01 0.00 0.08 0.00 0.00 57.88 57.78 1xwo h LEU 243 Cb 0.40 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 1xwo h LEU 243 CO -0.14 1.33 0.12 0.28 -1.08 0.00 0.00 178.44 178.95 1xwo h SER 244 N 0.65 0.37 0.27 -0.43 0.02 0.19 -0.97 113.55 113.65 1xwo h SER 244 Ca 0.01 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1xwo h SER 244 Cb 1.18 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 1xwo h SER 244 CO 0.13 0.42 -0.15 0.58 -1.14 0.00 0.00 176.83 176.66 1xwo h VAL 245 N 0.30 0.68 -0.67 2.27 2.07 -1.34 -1.35 116.25 118.20 1xwo h VAL 245 Ca 0.09 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.72 1xwo h VAL 245 Cb 0.16 0.68 -0.08 0.00 -1.52 0.00 0.00 31.29 30.52 1xwo h VAL 245 CO -0.01 0.00 0.26 0.00 0.02 0.00 0.00 177.57 177.84 1xwo h ALA 246 N 0.32 0.89 -0.02 1.67 0.00 -0.96 -0.45 119.26 120.70 1xwo h ALA 246 Ca -0.03 0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xwo h ALA 246 Cb 0.33 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1xwo h ALA 246 CO 0.04 -0.19 -0.03 1.15 0.00 0.00 0.00 179.25 180.22 1xwo h THR 247 N 0.43 0.90 0.00 0.00 2.02 -0.86 0.39 112.91 115.79 1xwo h THR 247 Ca 0.35 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.51 1xwo h THR 247 Cb 0.46 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1xwo h THR 247 CO -0.34 0.00 -0.10 0.25 0.37 0.00 0.00 175.52 175.71 1xwo h LEU 248 N -0.05 0.00 0.01 2.58 5.85 -0.62 0.55 115.31 123.63 1xwo h LEU 248 Ca 0.02 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.47 1xwo h LEU 248 Cb 0.08 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.13 1xwo h LEU 248 CO -0.05 0.10 -1.10 0.25 -0.34 0.00 0.00 178.44 177.29 1xwo h LEU 249 N 0.00 0.79 -0.87 2.25 5.85 -0.03 -2.74 115.31 120.55 1xwo h LEU 249 Ca -0.00 -0.67 -0.10 0.00 0.84 0.00 0.00 57.88 57.94 1xwo h LEU 249 Cb 0.27 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1xwo h LEU 249 CO 0.01 1.48 -0.28 0.24 -0.34 0.00 0.00 178.44 179.56 1xwo h MET 250 N 0.30 0.52 -0.91 1.25 2.86 -0.11 -1.61 114.93 117.23 1xwo h MET 250 Ca -0.14 -0.21 0.02 0.00 -2.06 0.00 0.00 59.70 57.31 1xwo h MET 250 Cb 1.76 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 33.35 1xwo h MET 250 CO 0.21 0.74 0.60 0.82 1.06 0.00 0.00 176.91 180.34 1xwo h ILE 251 N 0.45 1.20 -0.58 -1.22 2.04 -0.86 0.82 117.51 119.35 1xwo h ILE 251 Ca 0.06 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 1xwo h ILE 251 Cb 0.71 -0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 1xwo h ILE 251 CO 0.05 0.22 0.15 0.45 0.00 0.00 0.00 178.15 179.02 1xwo h HIS 252 N 1.20 0.97 0.00 1.37 3.86 -1.05 -0.31 115.15 121.18 1xwo h HIS 252 Ca 0.34 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.43 1xwo h HIS 252 Cb -0.08 -0.28 -0.00 0.00 1.06 0.00 0.00 27.41 28.11 1xwo h HIS 252 CO -0.00 0.82 -0.05 -0.07 0.86 0.00 0.00 177.93 179.50 1xwo h LEU 253 N 0.84 0.00 0.14 2.43 3.38 -0.35 -2.01 115.31 119.73 1xwo h LEU 253 Ca 0.18 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.87 1xwo h LEU 253 Cb 0.34 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.09 1xwo h LEU 253 CO 0.00 0.05 -1.29 0.77 0.09 0.00 0.00 178.44 178.06 1xwo h SER 254 N 0.00 0.45 -0.23 -0.43 4.64 0.14 -0.96 113.55 117.16 1xwo h SER 254 Ca -0.00 -0.49 -0.18 0.00 -0.47 0.00 0.00 61.79 60.65 1xwo h SER 254 Cb 0.74 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1xwo h SER 254 CO 0.01 1.39 -0.54 0.11 -0.87 0.00 0.00 176.83 176.92 1xwo h LYS 255 N 0.08 0.78 -0.42 4.77 1.57 -0.96 -2.24 116.57 120.15 1xwo h LYS 255 Ca -0.15 -0.52 -0.02 0.00 -1.87 0.00 0.00 60.65 58.08 1xwo h LYS 255 Cb 1.99 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 34.36 1xwo h LYS 255 CO 0.20 1.15 0.17 1.98 -0.57 0.00 0.00 179.45 182.39 1xwo h MET 256 N 0.52 0.62 -0.60 3.15 4.05 -1.43 -2.09 114.93 119.15 1xwo h MET 256 Ca -0.00 -0.11 0.07 0.00 -0.28 0.00 0.00 59.70 59.38 1xwo h MET 256 Cb 1.15 -0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 31.79 1xwo h MET 256 CO 0.12 0.57 0.28 0.00 0.23 0.00 0.00 176.91 178.11 1xwo h ALA 257 N 1.02 0.79 -0.05 0.39 0.00 -1.12 0.62 119.26 120.91 1xwo h ALA 257 Ca 0.14 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1xwo h ALA 257 Cb 0.18 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1xwo h ALA 257 CO -0.01 -0.09 -0.24 1.49 0.00 0.00 0.00 179.25 180.39 1xwo h GLU 258 N 0.52 -0.34 -0.33 0.00 4.57 -1.12 0.40 114.58 118.29 1xwo h GLU 258 Ca 0.28 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.55 1xwo h GLU 258 Cb 0.26 0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 28.87 1xwo h GLU 258 CO -0.23 -0.23 -0.05 -0.44 -1.18 0.00 0.00 179.01 176.89 1xwo h ASP 259 N -0.35 -0.23 0.30 1.04 3.32 -0.64 -1.48 116.42 118.38 1xwo h ASP 259 Ca 0.08 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1xwo h ASP 259 Cb 0.46 0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1xwo h ASP 259 CO -0.25 -0.08 -0.15 -0.07 -1.72 0.00 0.00 179.24 176.97 1xwo h LEU 260 N 0.04 -0.35 -0.11 1.55 -0.00 -0.18 -1.83 115.31 114.43 1xwo h LEU 260 Ca 0.16 0.01 0.02 0.00 -0.00 0.00 0.00 57.88 58.07 1xwo h LEU 260 Cb 0.23 0.09 -0.05 0.00 -0.00 0.00 0.00 40.66 40.94 1xwo h LEU 260 CO -0.31 -0.25 -0.41 0.40 -0.00 0.00 0.00 178.44 177.87 1xwo h ILE 261 N -0.41 0.00 -1.03 1.22 2.04 -0.59 0.18 117.51 118.92 1xwo h ILE 261 Ca -0.04 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.08 1xwo h ILE 261 Cb 0.32 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.31 1xwo h ILE 261 CO 0.07 0.00 0.67 0.40 0.00 0.00 0.00 178.15 179.29 1xwo h ILE 262 N -0.44 0.54 0.00 -0.67 2.04 -1.27 0.36 117.51 118.07 1xwo h ILE 262 Ca 0.02 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 65.68 1xwo h ILE 262 Cb 0.52 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1xwo h ILE 262 CO -0.34 0.07 -0.38 1.88 0.00 0.00 0.00 178.15 179.38 1xwo h TYR 263 N 0.36 0.00 -0.37 1.37 -1.99 -0.04 -3.09 116.97 113.21 1xwo h TYR 263 Ca 0.57 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.30 1xwo h TYR 263 Cb 1.52 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.25 1xwo h TYR 263 CO -0.00 0.38 0.00 -1.13 -0.00 0.00 0.00 178.16 177.40 1xwo n SER 264 N -3.39 1.99 -4.87 3.88 3.41 0.12 -1.97 113.62 112.79 1xwo n SER 264 Ca 0.01 -2.00 -0.31 0.00 -0.26 0.00 0.00 58.87 56.31 1xwo n SER 264 Cb 0.56 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1xwo n SER 264 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xwo s THR 265 N -1.50 4.68 0.11 6.66 -4.23 -1.09 -4.86 115.64 115.41 1xwo s THR 265 Ca 0.25 0.94 0.26 0.00 -1.18 0.00 0.00 61.69 61.96 1xwo s THR 265 Cb 0.13 -3.84 0.27 0.00 1.34 0.00 0.00 72.50 70.40 1xwo s THR 265 CO 0.17 -1.07 1.86 0.77 -0.54 0.00 0.00 174.62 175.81 1xwo h SER 266 N -0.10 0.00 0.27 3.99 4.64 -1.90 0.18 113.55 120.63 1xwo h SER 266 Ca -0.44 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 1xwo h SER 266 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1xwo h SER 266 CO 0.62 0.17 -0.13 -0.33 -0.87 0.00 0.00 176.83 176.29 1xwo h GLU 267 N 0.00 -0.35 -0.06 4.77 3.07 -1.92 -3.31 114.58 116.78 1xwo h GLU 267 Ca -0.00 0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.86 1xwo h GLU 267 Cb 0.70 0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.69 1xwo h GLU 267 CO 0.02 0.00 -0.06 0.74 -1.40 0.00 0.00 179.01 178.32 1xwo h PHE 268 N -0.81 0.18 0.00 4.33 -1.00 -1.76 -3.46 116.94 114.41 1xwo h PHE 268 Ca -0.04 -0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1xwo h PHE 268 Cb 0.51 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.03 1xwo h PHE 268 CO 0.04 0.59 0.00 0.41 -1.61 0.00 0.00 178.31 177.74 1xwo n GLY 269 N 0.19 0.13 0.27 -1.45 0.00 0.63 -4.88 105.19 100.08 1xwo n GLY 269 Ca -0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.05 1xwo n GLY 269 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xwo h PHE 270 N 0.00 0.00 -1.35 1.61 0.04 -1.63 -3.43 116.94 112.18 1xwo h PHE 270 Ca 0.00 0.00 0.33 0.00 2.80 0.00 0.00 57.97 61.10 1xwo h PHE 270 Cb 0.72 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 38.73 1xwo h PHE 270 CO 0.45 0.00 0.87 -0.48 -0.60 0.00 0.00 178.31 178.55 1xwo s LEU 271 N -8.67 -0.06 0.07 1.54 0.05 -1.11 -2.18 118.68 108.31 1xwo s LEU 271 Ca -0.05 -0.08 0.00 0.00 0.05 0.00 0.00 54.13 54.05 1xwo s LEU 271 Cb 0.16 1.30 -0.04 0.00 -2.05 0.00 0.00 46.19 45.56 1xwo s LEU 271 CO 0.64 -0.22 -0.04 0.42 -0.55 0.00 0.00 176.35 176.59 1xwo s THR 272 N -2.33 0.40 0.39 5.48 -4.23 -0.41 -3.79 115.64 111.16 1xwo s THR 272 Ca 0.13 -1.84 -0.03 0.00 -1.18 0.00 0.00 61.69 58.77 1xwo s THR 272 Cb 0.04 -1.56 -0.04 0.00 1.34 0.00 0.00 72.50 72.28 1xwo s THR 272 CO -0.04 -0.94 0.66 -0.76 -0.54 0.00 0.00 174.62 172.99 1xwo s LEU 273 N -2.94 3.86 0.68 4.79 1.02 -1.26 -1.93 118.68 122.90 1xwo s LEU 273 Ca 0.08 0.73 -0.14 0.00 0.02 0.00 0.00 54.13 54.82 1xwo s LEU 273 Cb 0.07 -3.62 0.01 0.00 0.02 0.00 0.00 46.19 42.67 1xwo s LEU 273 CO -0.08 -0.39 1.10 -0.94 0.02 0.00 0.00 176.35 176.06 1xwo s SER 274 N -3.85 4.99 0.45 2.29 1.04 -1.26 -4.82 113.70 112.54 1xwo s SER 274 Ca 0.44 1.95 0.16 0.00 0.48 0.00 0.00 55.95 58.98 1xwo s SER 274 Cb -0.10 -2.54 1.10 0.00 0.10 0.00 0.00 66.02 64.58 1xwo s SER 274 CO 0.38 -1.71 1.99 0.44 0.98 0.00 0.00 173.24 175.32 1xwo h ASP 275 N -0.24 0.29 -0.71 7.02 3.32 -1.93 -2.60 116.42 121.56 1xwo h ASP 275 Ca -0.46 0.01 0.13 0.00 0.02 0.00 0.00 57.03 56.72 1xwo h ASP 275 Cb 1.24 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.69 1xwo h ASP 275 CO 0.54 0.17 0.48 0.00 -1.72 0.00 0.00 179.24 178.71 1xwo h ALA 276 N 1.72 2.03 -0.75 3.45 0.00 -2.00 -2.66 119.26 121.05 1xwo h ALA 276 Ca 0.26 -0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.63 1xwo h ALA 276 Cb 0.59 -0.08 -0.37 0.00 0.00 0.00 0.00 17.79 17.93 1xwo h ALA 276 CO -0.06 -0.21 -0.42 1.19 0.00 0.00 0.00 179.25 179.74 1xwo n PHE 277 N -4.48 2.65 -3.97 0.00 3.01 -0.98 -5.02 117.46 108.67 1xwo n PHE 277 Ca 0.13 -2.32 -0.12 0.00 1.01 0.00 0.00 57.45 56.14 1xwo n PHE 277 Cb 0.45 -0.57 -0.01 0.00 -0.01 0.00 0.00 39.48 39.34 1xwo n PHE 277 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1xwo s SER 278 N -3.17 0.53 0.05 4.37 1.04 -1.00 -3.54 113.70 111.98 1xwo s SER 278 Ca 0.53 -1.33 -0.02 0.00 0.48 0.00 0.00 55.95 55.61 1xwo s SER 278 Cb 0.43 0.74 -0.03 0.00 0.10 0.00 0.00 66.02 67.26 1xwo s SER 278 CO 0.02 -1.47 0.00 0.42 0.98 0.00 0.00 173.24 173.20 1xwo s THR 279 N -2.75 0.21 -0.02 2.02 -4.23 -0.70 -4.89 115.64 105.28 1xwo s THR 279 Ca 0.24 -1.70 -0.29 0.00 -1.18 0.00 0.00 61.69 58.75 1xwo s THR 279 Cb -0.02 -1.47 0.11 0.00 1.34 0.00 0.00 72.50 72.45 1xwo s THR 279 CO 0.16 -0.94 1.30 -0.83 -0.54 0.00 0.00 174.62 173.77 1xwo s GLY 280 N -2.88 -0.22 0.11 3.99 0.00 -1.26 -0.65 107.32 106.41 1xwo s GLY 280 Ca 0.06 0.26 0.09 0.00 0.00 0.00 0.00 44.72 45.13 1xwo s GLY 280 CO -0.10 3.98 -0.23 -1.35 0.00 0.00 0.00 173.10 175.40 1xwo s SER 281 N -3.56 2.86 0.00 1.64 1.04 -1.26 -5.02 113.70 109.40 1xwo s SER 281 Ca 0.25 -0.71 0.12 0.00 0.48 0.00 0.00 55.95 56.09 1xwo s SER 281 Cb 0.01 -0.17 0.72 0.00 0.10 0.00 0.00 66.02 66.68 1xwo s SER 281 CO -0.02 0.11 1.14 -1.54 0.98 0.00 0.00 173.24 173.91 1xwo n SER 282 N 1.03 0.00 -0.03 7.02 3.41 -1.26 -2.47 113.62 121.32 1xwo n SER 282 Ca -0.19 -0.43 -0.09 0.00 -0.26 0.00 0.00 58.87 57.90 1xwo n SER 282 Cb 0.53 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.34 1xwo n SER 282 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xwo n LEU 283 N -0.97 0.88 -3.22 1.04 7.99 -1.26 -4.50 117.00 116.96 1xwo n LEU 283 Ca 0.09 0.36 -0.24 0.00 -0.01 0.00 0.00 56.01 56.21 1xwo n LEU 283 Cb 0.04 0.14 -0.06 0.00 -0.11 0.00 0.00 43.42 43.43 1xwo n LEU 283 CO 0.07 0.42 -0.13 0.23 -1.51 0.00 0.00 177.39 176.47 1xwo n MET 284 N -3.04 1.56 -0.33 3.23 2.81 -1.03 -4.97 117.12 115.34 1xwo n MET 284 Ca -0.19 -3.84 0.22 0.00 -1.81 0.00 0.00 57.70 52.07 1xwo n MET 284 Cb 1.06 -1.71 0.47 0.00 -0.71 0.00 0.00 33.22 32.33 1xwo n MET 284 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1xwo h PRO 285 N 3.72 0.43 -0.71 0.03 0.11 -1.78 0.18 132.00 133.98 1xwo h PRO 285 Ca 0.12 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1xwo h PRO 285 Cb 0.79 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1xwo h PRO 285 CO 0.61 0.28 0.00 1.04 -0.21 0.00 0.00 178.00 179.73 1xwo n GLN 286 N -4.71 0.87 -3.87 1.05 6.02 -1.26 -4.61 117.38 110.88 1xwo n GLN 286 Ca 0.26 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.96 1xwo n GLN 286 Cb 0.85 -1.36 -0.16 0.00 1.02 0.00 0.00 30.24 30.60 1xwo n GLN 286 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1xwo s LYS 287 N -1.18 1.28 0.08 -1.09 -0.14 0.05 -5.01 119.74 113.73 1xwo s LYS 287 Ca 0.00 -0.80 0.08 0.00 -1.36 0.00 0.00 55.97 53.89 1xwo s LYS 287 Cb 0.00 -2.42 -0.04 0.00 -1.68 0.00 0.00 37.83 33.69 1xwo s LYS 287 CO 0.00 -0.62 -0.16 0.15 -0.76 0.00 0.00 175.35 173.96 1xwo s LYS 288 N 1.56 1.97 -0.21 1.68 1.02 -1.26 -4.56 119.74 119.94 1xwo s LYS 288 Ca -0.04 -1.07 -0.02 0.00 0.02 0.00 0.00 55.97 54.86 1xwo s LYS 288 Cb -0.18 -2.19 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 1xwo s LYS 288 CO -0.07 0.51 -0.10 -0.80 -0.92 0.00 0.00 175.35 173.97 1xwo s ASN 289 N -1.89 3.87 -0.69 2.83 0.02 0.18 -4.94 114.94 114.33 1xwo s ASN 289 Ca 0.17 -0.51 -0.04 0.00 -1.02 0.00 0.00 52.86 51.46 1xwo s ASN 289 Cb -0.11 -1.64 -0.04 0.00 0.02 0.00 0.00 41.25 39.48 1xwo s ASN 289 CO 0.09 -0.02 1.87 -0.81 0.02 0.00 0.00 177.10 178.25 1xwo n PRO 290 N 4.73 1.60 -0.24 -0.60 -0.04 -1.26 -1.72 135.00 137.46 1xwo n PRO 290 Ca -0.19 -1.21 0.05 0.00 -0.04 0.00 0.00 63.50 62.11 1xwo n PRO 290 Cb 0.50 -2.32 0.17 0.00 -0.04 0.00 0.00 33.50 31.81 1xwo n PRO 290 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xwo h ASP 291 N 6.59 0.11 -0.28 3.54 3.45 -1.91 -0.57 116.42 127.35 1xwo h ASP 291 Ca 0.37 0.13 0.07 0.00 0.43 0.00 0.00 57.03 58.03 1xwo h ASP 291 Cb 0.15 0.15 -0.07 0.00 -0.56 0.00 0.00 39.33 38.99 1xwo h ASP 291 CO 1.30 0.02 -0.21 0.77 -1.57 0.00 0.00 179.24 179.55 1xwo h SER 292 N 0.33 -0.70 -0.54 6.45 4.64 -1.83 0.65 113.55 122.55 1xwo h SER 292 Ca 0.40 0.14 -0.10 0.00 -0.47 0.00 0.00 61.79 61.76 1xwo h SER 292 Cb 0.65 0.35 -0.02 0.00 -0.31 0.00 0.00 62.40 63.07 1xwo h SER 292 CO -0.46 -0.25 -0.07 -0.07 -0.87 0.00 0.00 176.83 175.12 1xwo h LEU 293 N -0.20 0.99 -0.14 5.97 3.38 -1.65 -2.02 115.31 121.65 1xwo h LEU 293 Ca 0.15 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1xwo h LEU 293 Cb 0.43 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1xwo h LEU 293 CO -0.40 1.09 0.03 -0.33 0.09 0.00 0.00 178.44 178.92 1xwo h GLU 294 N 0.87 0.22 -0.55 1.13 5.08 -0.42 -1.06 114.58 119.85 1xwo h GLU 294 Ca 0.14 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.51 1xwo h GLU 294 Cb 0.63 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.79 1xwo h GLU 294 CO 0.04 0.40 0.26 -0.07 -1.00 0.00 0.00 179.01 178.64 1xwo h LEU 295 N 0.01 0.34 -0.86 1.33 3.38 0.32 -1.88 115.31 117.95 1xwo h LEU 295 Ca 0.04 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1xwo h LEU 295 Cb 0.29 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 1xwo h LEU 295 CO 0.00 0.23 0.55 0.40 0.09 0.00 0.00 178.44 179.71 1xwo h ILE 296 N 0.49 1.14 -0.54 1.22 2.04 -1.00 -2.18 117.51 118.67 1xwo h ILE 296 Ca 0.26 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 1xwo h ILE 296 Cb 0.21 -0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.24 1xwo h ILE 296 CO -0.21 0.20 0.16 -0.09 0.00 0.00 0.00 178.15 178.21 1xwo h ARG 297 N 1.07 0.82 -0.09 2.37 2.43 -0.64 -2.59 114.38 117.76 1xwo h ARG 297 Ca 0.34 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 59.23 1xwo h ARG 297 Cb 0.01 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1xwo h ARG 297 CO -0.12 0.72 -0.52 0.66 -1.51 0.00 0.00 179.97 179.20 1xwo h SER 298 N 0.80 0.27 0.20 -3.80 4.64 -0.78 -2.95 113.55 111.93 1xwo h SER 298 Ca 0.18 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1xwo h SER 298 Cb 0.25 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1xwo h SER 298 CO -0.01 0.75 0.00 0.11 -0.87 0.00 0.00 176.83 176.81 1xwo h LYS 299 N 0.20 0.00 -0.29 4.77 1.79 -0.99 -1.83 116.57 120.21 1xwo h LYS 299 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 1xwo h LYS 299 Cb 0.99 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.63 1xwo h LYS 299 CO 0.08 0.00 0.12 0.00 -1.08 0.00 0.00 179.45 178.57 1xwo h ALA 300 N 2.04 0.38 -0.32 3.86 0.00 -1.56 -0.97 119.26 122.69 1xwo h ALA 300 Ca 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 1xwo h ALA 300 Cb 0.10 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1xwo h ALA 300 CO 0.00 -0.02 -0.35 0.78 0.00 0.00 0.00 179.25 179.65 1xwo h GLY 301 N 0.32 0.88 -0.01 0.00 0.00 -1.53 -0.73 103.07 102.00 1xwo h GLY 301 Ca 0.10 -0.92 0.09 0.00 0.00 0.00 0.00 47.33 46.60 1xwo h GLY 301 CO -0.01 0.83 -0.18 -0.09 0.00 0.00 0.00 176.54 177.09 1xwo h ARG 302 N 0.58 -0.08 -0.42 4.80 2.43 -1.13 -0.32 114.38 120.24 1xwo h ARG 302 Ca 0.05 0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.08 1xwo h ARG 302 Cb 0.94 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1xwo h ARG 302 CO 0.09 -0.06 -0.30 0.28 -1.51 0.00 0.00 179.97 178.47 1xwo h VAL 303 N -0.09 1.27 -0.60 0.20 2.07 -1.11 -2.92 116.25 115.06 1xwo h VAL 303 Ca 0.21 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.25 1xwo h VAL 303 Cb 0.42 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1xwo h VAL 303 CO -0.50 0.50 0.32 0.15 0.02 0.00 0.00 177.57 178.06 1xwo h PHE 304 N 0.79 0.82 -0.93 1.57 3.57 -0.53 -0.71 116.94 121.51 1xwo h PHE 304 Ca 0.08 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.61 1xwo h PHE 304 Cb 0.88 -0.26 -0.05 0.00 2.79 0.00 0.00 35.95 39.30 1xwo h PHE 304 CO 0.06 0.58 0.61 0.78 -2.23 0.00 0.00 178.31 178.11 1xwo h GLY 305 N 0.91 1.35 1.43 2.40 0.00 -0.88 0.14 103.07 108.42 1xwo h GLY 305 Ca 0.21 -0.46 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 1xwo h GLY 305 CO -0.03 0.40 -0.20 3.21 0.00 0.00 0.00 176.54 179.92 1xwo h ARG 306 N 1.17 0.66 0.51 4.80 2.47 -1.10 -1.12 114.38 121.77 1xwo h ARG 306 Ca 0.37 -0.24 -0.02 0.00 -1.26 0.00 0.00 59.98 58.82 1xwo h ARG 306 Cb 0.02 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 1xwo h ARG 306 CO -0.11 0.82 -0.24 1.25 0.56 0.00 0.00 179.97 182.24 1xwo h LEU 307 N 0.59 -0.57 -0.83 3.04 5.85 -0.14 -3.05 115.31 120.20 1xwo h LEU 307 Ca 0.09 -0.06 0.18 0.00 0.84 0.00 0.00 57.88 58.93 1xwo h LEU 307 Cb 0.66 0.15 -0.11 0.00 0.37 0.00 0.00 40.66 41.73 1xwo h LEU 307 CO 0.05 -0.25 0.33 0.00 -0.34 0.00 0.00 178.44 178.23 1xwo h ALA 308 N -0.57 1.23 0.07 1.25 0.00 -0.93 -1.86 119.26 118.45 1xwo h ALA 308 Ca -0.07 0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1xwo h ALA 308 Cb 0.60 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1xwo h ALA 308 CO 0.11 -0.28 -0.12 0.66 0.00 0.00 0.00 179.25 179.63 1xwo h SER 309 N 0.41 -0.32 -0.27 0.00 4.64 -1.17 -1.57 113.55 115.27 1xwo h SER 309 Ca 0.48 0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 61.78 1xwo h SER 309 Cb 0.84 0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 1xwo h SER 309 CO -0.48 -0.18 -0.02 0.40 -0.87 0.00 0.00 176.83 175.68 1xwo h ILE 310 N -0.24 1.22 -0.58 0.95 2.04 -1.32 -0.72 117.51 118.87 1xwo h ILE 310 Ca 0.02 -0.91 0.01 0.00 1.00 0.00 0.00 64.86 64.98 1xwo h ILE 310 Cb 0.25 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 1xwo h ILE 310 CO -0.07 0.31 0.38 -0.07 0.00 0.00 0.00 178.15 178.70 1xwo h LEU 311 N 0.58 0.65 -0.96 1.44 3.38 -1.03 -2.06 115.31 117.30 1xwo h LEU 311 Ca 0.12 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.98 1xwo h LEU 311 Cb 0.40 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1xwo h LEU 311 CO 0.02 0.47 -0.46 -0.03 0.09 0.00 0.00 178.44 178.52 1xwo h MET 312 N 0.77 0.00 -0.53 1.13 4.05 -0.43 -2.62 114.93 117.30 1xwo h MET 312 Ca 0.22 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.55 1xwo h MET 312 Cb -0.07 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 1xwo h MET 312 CO -0.06 0.46 -0.02 0.28 0.23 0.00 0.00 176.91 177.81 1xwo h VAL 313 N 0.00 1.26 0.04 -5.77 2.07 -0.64 -3.19 116.25 110.02 1xwo h VAL 313 Ca -0.00 -1.11 -0.22 0.00 0.82 0.00 0.00 66.70 66.18 1xwo h VAL 313 Cb 0.91 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1xwo h VAL 313 CO 0.06 0.40 -1.03 -0.07 0.02 0.00 0.00 177.57 176.94 1xwo h LEU 314 N 0.84 0.18 -9.31 2.57 3.38 -1.25 -3.44 115.31 108.28 1xwo h LEU 314 Ca 0.15 -0.18 -0.66 0.00 0.09 0.00 0.00 57.88 57.28 1xwo h LEU 314 Cb 0.53 -0.06 0.06 0.00 0.09 0.00 0.00 40.66 41.29 1xwo h LEU 314 CO 0.03 1.09 0.40 1.17 0.09 0.00 0.00 178.44 181.22 1xwo n LYS 315 N -3.49 1.20 -0.94 1.13 0.00 -1.00 -1.87 118.16 113.20 1xwo n LYS 315 Ca -0.03 0.43 0.00 0.00 0.00 0.00 0.00 58.31 58.71 1xwo n LYS 315 Cb 0.93 -2.03 0.00 0.00 0.00 0.00 0.00 35.03 33.93 1xwo n LYS 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1xwo n GLY 316 N 2.36 0.04 3.69 3.14 0.00 -1.26 -4.96 105.19 108.20 1xwo n GLY 316 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1xwo n GLY 316 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xwo s LEU 317 N 0.00 4.29 0.73 0.99 1.43 -0.78 -5.02 118.68 120.32 1xwo s LEU 317 Ca 0.00 1.69 -0.15 0.00 -1.03 0.00 0.00 54.13 54.64 1xwo s LEU 317 Cb 0.00 -3.56 0.04 0.00 0.03 0.00 0.00 46.19 42.70 1xwo s LEU 317 CO 0.00 -0.45 1.21 -2.16 0.23 0.00 0.00 176.35 175.18 1xwo s PRO 318 N 1.76 2.15 0.67 1.29 0.04 -1.26 -4.94 135.00 134.71 1xwo s PRO 318 Ca 0.52 1.78 -0.17 0.00 0.04 0.00 0.00 61.00 63.17 1xwo s PRO 318 Cb -0.22 -1.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.47 1xwo s PRO 318 CO 0.22 -1.83 0.88 0.43 0.04 0.00 0.00 177.00 176.74 1xwo n SER 319 N -2.69 0.25 -0.64 6.66 7.64 -1.26 -4.84 113.62 118.74 1xwo n SER 319 Ca 0.14 0.71 0.04 0.00 1.01 0.00 0.00 58.87 60.76 1xwo n SER 319 Cb 0.50 -1.36 -0.01 0.00 -1.01 0.00 0.00 64.21 62.33 1xwo n SER 319 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1xwo n THR 320 N -2.19 0.00 -1.48 0.44 -2.24 -1.26 -4.92 114.28 102.63 1xwo n THR 320 Ca 0.13 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.52 1xwo n THR 320 Cb 0.49 -0.10 0.03 0.00 -2.10 0.00 0.00 70.33 68.64 1xwo n THR 320 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xwo n TYR 321 N -1.72 -0.45 -3.64 4.78 9.36 -1.26 -4.81 117.16 119.43 1xwo n TYR 321 Ca 0.00 0.49 -0.12 0.00 3.32 0.00 0.00 57.90 61.59 1xwo n TYR 321 Cb 0.14 -1.99 -0.07 0.00 -0.63 0.00 0.00 39.34 36.78 1xwo n TYR 321 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 1xwo s ASN 322 N -1.07 -0.78 0.39 2.98 0.01 -1.26 -5.05 114.94 110.15 1xwo s ASN 322 Ca 0.67 1.43 0.13 0.00 -0.71 0.00 0.00 52.86 54.37 1xwo s ASN 322 Cb -0.50 1.41 0.94 0.00 0.41 0.00 0.00 41.25 43.52 1xwo s ASN 322 CO 0.55 -0.24 1.87 0.50 -1.51 0.00 0.00 177.10 178.27 1xwo h LYS 323 N 5.50 0.54 -1.50 -0.60 1.63 -2.03 -0.71 116.57 119.41 1xwo h LYS 323 Ca -0.29 -0.03 0.43 0.00 -0.85 0.00 0.00 60.65 59.91 1xwo h LYS 323 Cb 1.18 -0.12 -0.06 0.00 -0.60 0.00 0.00 32.23 32.63 1xwo h LYS 323 CO 0.09 0.36 1.13 -0.44 -3.45 0.00 0.00 179.45 177.13 1xwo h ASP 324 N 0.56 0.00 0.27 4.20 5.19 -1.96 0.27 116.42 124.93 1xwo h ASP 324 Ca 0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.86 1xwo h ASP 324 Cb 0.89 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.40 1xwo h ASP 324 CO -0.19 0.00 0.00 -0.07 -3.12 0.00 0.00 179.24 175.86 1xwo h LEU 325 N 0.00 0.00 0.00 1.55 3.38 -1.48 -3.14 115.31 115.62 1xwo h LEU 325 Ca 0.71 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.68 1xwo h LEU 325 Cb 2.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.71 1xwo h LEU 325 CO -0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.52 1xwo n GLN 326 N -2.56 0.68 0.05 1.13 10.64 0.93 -3.11 117.38 125.14 1xwo n GLN 326 Ca -0.01 0.00 0.14 0.00 -1.83 0.00 0.00 57.00 55.30 1xwo n GLN 326 Cb 0.11 -1.47 0.52 0.00 -0.86 0.00 0.00 30.24 28.55 1xwo n GLN 326 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1xwo n GLU 327 N -0.97 0.12 -0.05 2.61 -0.58 -1.19 -3.97 120.64 116.61 1xwo n GLU 327 Ca 0.15 0.10 -0.11 0.00 -0.42 0.00 0.00 57.16 56.88 1xwo n GLU 327 Cb 0.07 -1.64 -0.05 0.00 -0.57 0.00 0.00 31.44 29.25 1xwo n GLU 327 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 1xwo h ASP 328 N 0.00 0.26 0.00 1.62 2.03 -1.84 -3.23 116.42 115.26 1xwo h ASP 328 Ca 0.00 -0.20 0.00 0.00 -0.73 0.00 0.00 57.03 56.10 1xwo h ASP 328 Cb 0.60 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.04 1xwo h ASP 328 CO 0.00 0.39 0.00 0.29 -1.03 0.00 0.00 179.24 178.89 1xwo n LYS 329 N -4.82 0.00 -0.37 4.15 5.02 -1.25 -0.39 118.16 120.49 1xwo n LYS 329 Ca -0.04 0.88 0.29 0.00 -2.02 0.00 0.00 58.31 57.42 1xwo n LYS 329 Cb 0.15 -1.42 0.56 0.00 -0.02 0.00 0.00 35.03 34.30 1xwo n LYS 329 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1xwo h GLU 330 N 0.00 0.25 0.17 1.97 5.08 -1.84 0.32 114.58 120.54 1xwo h GLU 330 Ca 0.00 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1xwo h GLU 330 Cb 0.00 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1xwo h GLU 330 CO 0.00 0.17 -0.08 0.00 -1.00 0.00 0.00 179.01 178.09 1xwo h ALA 331 N 1.64 -0.23 0.02 3.43 0.00 -0.99 -2.07 119.26 121.07 1xwo h ALA 331 Ca 0.70 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.44 1xwo h ALA 331 Cb 1.95 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.83 1xwo h ALA 331 CO -0.39 -0.47 -0.04 0.28 0.00 0.00 0.00 179.25 178.64 1xwo h VAL 332 N -0.55 0.00 -0.93 0.00 2.07 0.24 -2.42 116.25 114.66 1xwo h VAL 332 Ca -0.02 0.00 0.33 0.00 0.82 0.00 0.00 66.70 67.83 1xwo h VAL 332 Cb 0.42 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.02 1xwo h VAL 332 CO 0.04 0.00 0.29 0.49 0.02 0.00 0.00 177.57 178.40 1xwo n PHE 333 N -2.58 0.87 0.00 1.57 0.99 -0.08 -0.51 117.46 117.72 1xwo n PHE 333 Ca -0.01 1.11 -0.12 0.00 -0.00 0.00 0.00 57.45 58.43 1xwo n PHE 333 Cb 0.03 -1.37 -0.08 0.00 -1.00 0.00 0.00 39.48 37.07 1xwo n PHE 333 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.76 176.98 1xwo h ASP 334 N 0.00 0.05 -0.35 4.37 3.58 -1.06 -1.64 116.42 121.37 1xwo h ASP 334 Ca 0.69 -0.24 -0.03 0.00 0.42 0.00 0.00 57.03 57.87 1xwo h ASP 334 Cb 1.68 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 42.70 1xwo h ASP 334 CO -0.79 0.27 0.10 0.58 -2.88 0.00 0.00 179.24 176.53 1xwo h VAL 335 N -0.18 1.21 -0.83 2.25 2.07 -0.32 0.29 116.25 120.75 1xwo h VAL 335 Ca 0.01 -0.69 0.06 0.00 0.82 0.00 0.00 66.70 66.90 1xwo h VAL 335 Cb 0.24 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 1xwo h VAL 335 CO 0.00 0.24 0.54 0.58 0.02 0.00 0.00 177.57 178.95 1xwo h VAL 336 N 0.41 1.07 0.03 2.57 2.07 -1.14 0.44 116.25 121.70 1xwo h VAL 336 Ca 0.11 -0.33 -0.23 0.00 0.82 0.00 0.00 66.70 67.08 1xwo h VAL 336 Cb 0.26 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 1xwo h VAL 336 CO -0.00 0.17 -1.06 0.44 0.02 0.00 0.00 177.57 177.14 1xwo h ASP 337 N 0.95 0.10 -0.14 0.57 3.45 -0.90 -2.46 116.42 117.98 1xwo h ASP 337 Ca 0.35 -0.10 -0.07 0.00 0.43 0.00 0.00 57.03 57.64 1xwo h ASP 337 Cb 0.17 -0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 38.91 1xwo h ASP 337 CO -0.12 1.08 -0.19 0.74 -1.57 0.00 0.00 179.24 179.18 1xwo h THR 338 N 0.02 1.36 -0.49 0.35 2.02 0.12 -2.52 112.91 113.76 1xwo h THR 338 Ca -0.04 -1.40 -0.05 0.00 0.77 0.00 0.00 66.41 65.68 1xwo h THR 338 Cb 1.82 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 70.16 1xwo h THR 338 CO 0.15 0.41 0.10 -0.07 0.37 0.00 0.00 175.52 176.48 1xwo h LEU 339 N -0.01 0.76 -0.64 2.58 3.38 -0.31 -0.63 115.31 120.44 1xwo h LEU 339 Ca 0.02 -0.25 0.12 0.00 0.09 0.00 0.00 57.88 57.85 1xwo h LEU 339 Cb 0.75 -0.20 -0.09 0.00 0.09 0.00 0.00 40.66 41.21 1xwo h LEU 339 CO 0.04 0.81 0.19 0.74 0.09 0.00 0.00 178.44 180.32 1xwo h THR 340 N 0.68 0.67 0.00 0.22 2.02 -1.36 -0.42 112.91 114.73 1xwo h THR 340 Ca 0.15 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.17 1xwo h THR 340 Cb 0.36 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 1xwo h THR 340 CO 0.01 0.06 -0.19 0.00 0.37 0.00 0.00 175.52 175.77 1xwo h ALA 341 N 1.48 0.02 -0.38 6.16 0.00 -1.23 -3.30 119.26 122.01 1xwo h ALA 341 Ca 0.34 -0.46 0.08 0.00 0.00 0.00 0.00 54.91 54.86 1xwo h ALA 341 Cb 0.49 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 1xwo h ALA 341 CO -0.38 0.04 -0.10 0.28 0.00 0.00 0.00 179.25 179.09 1xwo h VAL 342 N -0.61 0.61 -0.32 0.00 2.07 -0.91 -0.56 116.25 116.52 1xwo h VAL 342 Ca -0.03 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.55 1xwo h VAL 342 Cb 0.98 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.30 1xwo h VAL 342 CO 0.04 0.00 0.01 -0.07 0.02 0.00 0.00 177.57 177.56 1xwo h LEU 343 N -0.01 -0.12 -0.03 2.57 3.38 -1.21 -0.04 115.31 119.85 1xwo h LEU 343 Ca 0.18 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 1xwo h LEU 343 Cb 0.29 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1xwo h LEU 343 CO -0.39 -0.02 0.01 1.56 0.09 0.00 0.00 178.44 179.69 1xwo h GLN 344 N 0.10 0.05 -0.53 1.13 4.20 -1.53 0.90 115.11 119.43 1xwo h GLN 344 Ca 0.16 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.92 1xwo h GLN 344 Cb 0.21 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 1xwo h GLN 344 CO -0.26 0.18 0.35 0.28 -0.67 0.00 0.00 178.83 178.72 1xwo h VAL 345 N -0.10 0.98 0.09 -0.54 2.07 -0.93 -0.40 116.25 117.42 1xwo h VAL 345 Ca 0.01 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1xwo h VAL 345 Cb 0.15 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1xwo h VAL 345 CO -0.00 0.09 -0.04 0.00 0.02 0.00 0.00 177.57 177.63 1xwo h ALA 346 N 1.71 -0.12 -0.74 1.67 0.00 -0.56 -2.45 119.26 118.78 1xwo h ALA 346 Ca 0.23 -0.24 0.17 0.00 0.00 0.00 0.00 54.91 55.06 1xwo h ALA 346 Cb 0.30 0.05 -0.13 0.00 0.00 0.00 0.00 17.79 18.01 1xwo h ALA 346 CO -0.06 -0.30 0.02 1.15 0.00 0.00 0.00 179.25 180.06 1xwo h THR 347 N -0.66 0.37 0.93 0.00 2.02 0.01 -1.91 112.91 113.67 1xwo h THR 347 Ca -0.01 -0.04 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 1xwo h THR 347 Cb 0.53 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1xwo h THR 347 CO 0.02 0.02 -0.49 1.23 0.37 0.00 0.00 175.52 176.67 1xwo h GLY 348 N 0.12 -1.40 -0.88 2.16 0.00 -1.05 -2.25 103.07 99.78 1xwo h GLY 348 Ca 0.40 0.54 0.31 0.00 0.00 0.00 0.00 47.33 48.58 1xwo h GLY 348 CO -0.63 -0.49 0.21 -2.08 0.00 0.00 0.00 176.54 173.55 1xwo h VAL 349 N -1.30 0.07 -0.31 4.60 2.07 -0.94 0.01 116.25 120.45 1xwo h VAL 349 Ca -0.13 -0.02 -0.17 0.00 0.82 0.00 0.00 66.70 67.21 1xwo h VAL 349 Cb 1.02 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1xwo h VAL 349 CO 0.18 0.01 -0.46 0.40 0.02 0.00 0.00 177.57 177.71 1xwo h ILE 350 N 0.05 1.28 -0.03 4.57 5.03 -1.18 -2.05 117.51 125.18 1xwo h ILE 350 Ca 0.66 -1.65 0.00 0.00 -0.12 0.00 0.00 64.86 63.75 1xwo h ILE 350 Cb 1.50 1.53 0.00 0.00 -3.03 0.00 0.00 36.82 36.82 1xwo h ILE 350 CO -0.83 0.54 0.00 -1.54 -0.68 0.00 0.00 178.15 175.64 1xwo n SER 351 N -4.02 1.12 0.00 1.72 3.41 -0.12 -4.08 113.62 111.65 1xwo n SER 351 Ca -0.03 -1.42 0.00 0.00 -0.26 0.00 0.00 58.87 57.16 1xwo n SER 351 Cb 0.58 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1xwo n SER 351 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1xwo n THR 352 N -0.11 0.01 -2.66 6.66 -2.24 -0.52 -5.03 114.28 110.40 1xwo n THR 352 Ca 0.19 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 1xwo n THR 352 Cb 0.28 1.39 -0.03 0.00 -2.10 0.00 0.00 70.33 69.87 1xwo n THR 352 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1xwo s LEU 353 N -0.01 4.26 0.02 3.22 0.05 -0.78 -4.00 118.68 121.45 1xwo s LEU 353 Ca 0.00 1.58 -0.30 0.00 0.05 0.00 0.00 54.13 55.46 1xwo s LEU 353 Cb 0.00 -3.56 -0.04 0.00 -2.05 0.00 0.00 46.19 40.54 1xwo s LEU 353 CO 0.00 -0.45 1.10 -1.10 -0.55 0.00 0.00 176.35 175.35 1xwo s GLN 354 N 1.97 4.48 -0.06 1.48 -1.52 -0.81 -4.92 119.66 120.28 1xwo s GLN 354 Ca 0.50 1.61 0.01 0.00 -1.95 0.00 0.00 55.36 55.53 1xwo s GLN 354 Cb -0.19 -3.41 -0.03 0.00 -0.22 0.00 0.00 33.01 29.16 1xwo s GLN 354 CO 0.19 -0.18 -0.08 0.42 -0.25 0.00 0.00 175.29 175.39 1xwo s ILE 355 N 1.13 3.59 -0.56 1.08 1.01 -1.26 -1.28 121.20 124.90 1xwo s ILE 355 Ca 0.55 -0.53 -0.13 0.00 0.00 0.00 0.00 60.65 60.55 1xwo s ILE 355 Cb -0.25 -2.46 0.14 0.00 0.01 0.00 0.00 42.46 39.90 1xwo s ILE 355 CO 0.28 0.60 0.49 -0.55 0.00 0.00 0.00 174.94 175.76 1xwo s SER 356 N -0.80 6.10 0.14 3.58 0.15 -0.93 -4.95 113.70 117.00 1xwo s SER 356 Ca 0.12 -1.98 -0.26 0.00 0.70 0.00 0.00 55.95 54.53 1xwo s SER 356 Cb -0.11 -2.14 -0.01 0.00 -1.71 0.00 0.00 66.02 62.05 1xwo s SER 356 CO 0.01 -0.76 1.59 0.11 1.20 0.00 0.00 173.24 175.39 1xwo h LYS 357 N 8.56 -0.37 -0.52 5.44 6.56 -1.96 -2.02 116.57 132.26 1xwo h LYS 357 Ca -0.21 0.03 0.10 0.00 -1.06 0.00 0.00 60.65 59.50 1xwo h LYS 357 Cb 1.08 0.08 -0.11 0.00 -0.57 0.00 0.00 32.23 32.72 1xwo h LYS 357 CO 0.94 -0.25 -0.28 0.93 -2.06 0.00 0.00 179.45 178.74 1xwo h GLU 358 N -0.38 -0.15 -0.65 3.15 5.08 -1.97 0.62 114.58 120.28 1xwo h GLU 358 Ca 0.12 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.55 1xwo h GLU 358 Cb 0.58 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.81 1xwo h GLU 358 CO -0.45 -0.10 0.35 -0.91 -1.00 0.00 0.00 179.01 176.90 1xwo h ASN 359 N -0.15 0.51 -0.03 1.42 2.35 -1.74 0.79 115.58 118.73 1xwo h ASN 359 Ca 0.23 0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.91 1xwo h ASN 359 Cb 0.52 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 1xwo h ASN 359 CO -0.61 0.33 -0.28 0.24 -1.65 0.00 0.00 177.43 175.46 1xwo h MET 360 N 0.64 0.47 -0.36 0.81 2.86 -0.52 -2.12 114.93 116.70 1xwo h MET 360 Ca 0.30 -0.18 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1xwo h MET 360 Cb 0.21 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1xwo h MET 360 CO -0.19 0.71 -0.05 0.93 1.06 0.00 0.00 176.91 179.36 1xwo h GLU 361 N 0.41 0.68 0.00 1.72 4.39 0.18 -2.96 114.58 119.00 1xwo h GLU 361 Ca 0.06 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.49 1xwo h GLU 361 Cb 0.70 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1xwo h GLU 361 CO 0.05 0.81 -0.14 0.87 -1.16 0.00 0.00 179.01 179.45 1xwo h LYS 362 N 0.48 0.00 0.00 2.33 1.57 0.78 -2.63 116.57 119.10 1xwo h LYS 362 Ca 0.10 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 1xwo h LYS 362 Cb 0.54 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1xwo h LYS 362 CO 0.03 0.14 -0.12 0.00 -0.57 0.00 0.00 179.45 178.92 1xwo h ALA 363 N 1.86 1.22 -2.44 3.86 0.00 -1.21 -3.42 119.26 119.13 1xwo h ALA 363 Ca -0.00 -0.11 -0.54 0.00 0.00 0.00 0.00 54.91 54.26 1xwo h ALA 363 Cb 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1xwo h ALA 363 CO 0.02 0.15 0.72 -0.51 0.00 0.00 0.00 179.25 179.63 1xwo s LEU 364 N -7.10 4.34 0.19 0.00 1.02 -0.99 -4.82 118.68 111.32 1xwo s LEU 364 Ca -0.02 2.10 0.03 0.00 0.02 0.00 0.00 54.13 56.26 1xwo s LEU 364 Cb 0.12 -3.57 -0.05 0.00 0.02 0.00 0.00 46.19 42.72 1xwo s LEU 364 CO 0.58 -0.62 -0.02 0.42 0.02 0.00 0.00 176.35 176.72 1xwo s THR 365 N 1.72 0.93 0.09 5.49 -4.23 -1.26 -5.05 115.64 113.33 1xwo s THR 365 Ca 0.62 -2.02 -0.26 0.00 -1.18 0.00 0.00 61.69 58.85 1xwo s THR 365 Cb -0.31 -2.15 -0.13 0.00 1.34 0.00 0.00 72.50 71.24 1xwo s THR 365 CO 0.28 -0.48 1.69 -0.65 -0.54 0.00 0.00 174.62 174.92 1xwo h PRO 366 N 2.62 -0.32 -1.59 3.99 0.11 -1.99 -2.75 132.00 132.07 1xwo h PRO 366 Ca -0.37 0.02 0.48 0.00 0.11 0.00 0.00 66.00 66.24 1xwo h PRO 366 Cb 1.21 0.07 -0.10 0.00 0.11 0.00 0.00 31.00 32.30 1xwo h PRO 366 CO 0.64 -0.22 1.10 1.05 -0.21 0.00 0.00 178.00 180.36 1xwo h GLU 367 N -0.34 0.04 0.00 1.05 4.11 -1.99 1.32 114.58 118.77 1xwo h GLU 367 Ca -0.01 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1xwo h GLU 367 Cb 0.30 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1xwo h GLU 367 CO -0.01 0.02 0.00 -1.33 0.07 0.00 0.00 179.01 177.76 1xwo n MET 368 N -4.29 0.68 -0.00 1.06 2.81 -1.03 -2.61 117.12 113.73 1xwo n MET 368 Ca 0.39 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 56.30 1xwo n MET 368 Cb 1.66 -1.16 -0.03 0.00 -0.71 0.00 0.00 33.22 32.98 1xwo n MET 368 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1xwo n LEU 369 N -0.66 0.23 -0.46 4.03 4.77 0.45 -4.58 117.00 120.78 1xwo n LEU 369 Ca 0.05 -0.43 0.38 0.00 -0.03 0.00 0.00 56.01 55.99 1xwo n LEU 369 Cb 0.02 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 41.81 1xwo n LEU 369 CO 0.04 0.06 1.31 0.77 -1.33 0.00 0.00 177.39 178.24 1xwo h SER 370 N 0.00 0.16 -0.02 -1.43 4.64 -1.58 0.66 113.55 115.99 1xwo h SER 370 Ca 0.00 0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1xwo h SER 370 Cb 0.15 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1xwo h SER 370 CO 0.00 -0.06 -0.06 0.74 -0.87 0.00 0.00 176.83 176.57 1xwo h THR 371 N 0.09 1.47 -0.61 2.95 2.02 -1.83 -2.53 112.91 114.46 1xwo h THR 371 Ca 0.76 -1.48 0.17 0.00 0.77 0.00 0.00 66.41 66.64 1xwo h THR 371 Cb 2.63 2.41 -0.03 0.00 -1.74 0.00 0.00 68.15 71.42 1xwo h THR 371 CO -0.22 0.40 0.44 0.44 0.37 0.00 0.00 175.52 176.94 1xwo h ASP 372 N -0.50 0.01 0.02 4.18 3.45 -0.03 -1.32 116.42 122.24 1xwo h ASP 372 Ca -0.00 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.46 1xwo h ASP 372 Cb 0.68 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.45 1xwo h ASP 372 CO 0.01 0.01 -0.01 -0.07 -1.57 0.00 0.00 179.24 177.61 1xwo h LEU 373 N 0.01 -0.03 -1.44 1.55 3.38 -0.96 -2.17 115.31 115.66 1xwo h LEU 373 Ca 0.29 -0.53 0.14 0.00 0.09 0.00 0.00 57.88 57.87 1xwo h LEU 373 Cb 1.15 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.85 1xwo h LEU 373 CO -0.01 0.53 0.53 0.00 0.09 0.00 0.00 178.44 179.58 1xwo h ALA 374 N 0.36 1.96 -0.54 1.53 0.00 -0.85 0.60 119.26 122.32 1xwo h ALA 374 Ca -0.00 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1xwo h ALA 374 Cb 0.56 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1xwo h ALA 374 CO 0.01 -0.17 -0.03 -0.07 0.00 0.00 0.00 179.25 178.98 1xwo h LEU 375 N 0.56 0.92 -1.95 0.00 3.38 -1.24 -1.79 115.31 115.19 1xwo h LEU 375 Ca 0.40 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 58.14 1xwo h LEU 375 Cb 0.74 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1xwo h LEU 375 CO -0.15 1.00 0.12 0.22 0.09 0.00 0.00 178.44 179.72 1xwo h TYR 376 N 0.86 0.07 0.06 1.13 5.03 -0.21 -1.17 116.97 122.74 1xwo h TYR 376 Ca 0.15 0.00 -0.20 0.00 2.58 0.00 0.00 58.73 61.27 1xwo h TYR 376 Cb 0.55 -0.02 0.02 0.00 1.55 0.00 0.00 36.73 38.83 1xwo h TYR 376 CO 0.03 0.04 -0.81 -0.07 -1.32 0.00 0.00 178.16 176.03 1xwo h LEU 377 N 0.07 0.61 -0.72 2.82 3.38 -0.95 -3.32 115.31 117.20 1xwo h LEU 377 Ca 0.08 -0.82 0.03 0.00 0.09 0.00 0.00 57.88 57.26 1xwo h LEU 377 Cb 0.23 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 1xwo h LEU 377 CO -0.01 1.36 0.45 0.58 0.09 0.00 0.00 178.44 180.92 1xwo h VAL 378 N -0.07 1.09 0.00 1.22 2.07 -0.67 -1.41 116.25 118.48 1xwo h VAL 378 Ca -0.12 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.10 1xwo h VAL 378 Cb 1.54 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1xwo h VAL 378 CO 0.16 0.16 0.00 0.03 0.02 0.00 0.00 177.57 177.94 1xwo h ARG 379 N 0.88 0.00 -0.84 1.57 3.08 -1.34 -0.42 114.38 117.31 1xwo h ARG 379 Ca 0.29 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.99 1xwo h ARG 379 Cb 0.03 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 29.87 1xwo h ARG 379 CO -0.11 0.00 0.43 1.63 -1.07 0.00 0.00 179.97 180.85 1xwo n LYS 380 N -2.40 3.01 0.00 0.04 5.02 -0.57 -4.87 118.16 118.39 1xwo n LYS 380 Ca -0.01 -3.06 0.00 0.00 -2.02 0.00 0.00 58.31 53.21 1xwo n LYS 380 Cb 0.06 -2.19 0.00 0.00 -0.02 0.00 0.00 35.03 32.88 1xwo n LYS 380 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xwo n GLY 381 N -0.63 2.77 3.75 0.72 0.00 -0.17 -5.00 105.19 106.63 1xwo n GLY 381 Ca 0.49 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.10 1xwo n GLY 381 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xwo s MET 382 N -0.09 4.23 0.97 1.61 0.00 -0.98 -4.97 119.30 120.07 1xwo s MET 382 Ca 0.00 2.38 -0.12 0.00 0.00 0.00 0.00 55.69 57.96 1xwo s MET 382 Cb 0.00 -3.07 0.18 0.00 0.00 0.00 0.00 34.83 31.93 1xwo s MET 382 CO 0.00 -0.46 1.09 -1.25 0.00 0.00 0.00 175.02 174.40 1xwo s PRO 383 N -0.73 0.60 0.01 4.11 0.04 -1.26 -3.86 135.00 133.91 1xwo s PRO 383 Ca 0.58 1.00 -0.05 0.00 0.04 0.00 0.00 61.00 62.58 1xwo s PRO 383 Cb -0.43 -1.72 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 1xwo s PRO 383 CO 0.47 -2.74 1.07 0.35 0.04 0.00 0.00 177.00 176.19 1xwo h PHE 384 N -1.92 -0.17 -0.50 0.56 3.57 -1.96 -1.94 116.94 114.57 1xwo h PHE 384 Ca -0.51 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.06 1xwo h PHE 384 Cb 1.29 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 40.04 1xwo h PHE 384 CO 0.40 -0.09 0.17 -0.09 -2.23 0.00 0.00 178.31 176.47 1xwo h ARG 385 N -0.14 0.33 -0.67 1.11 9.65 -1.99 -1.18 114.38 121.49 1xwo h ARG 385 Ca -0.01 -0.02 0.07 0.00 -1.10 0.00 0.00 59.98 58.92 1xwo h ARG 385 Cb 0.12 -0.07 -0.06 0.00 -1.39 0.00 0.00 29.97 28.56 1xwo h ARG 385 CO 0.00 0.22 0.36 1.96 2.80 0.00 0.00 179.97 185.31 1xwo h GLN 386 N 0.34 0.63 -0.12 0.20 4.20 -1.96 0.24 115.11 118.64 1xwo h GLN 386 Ca 0.24 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.91 1xwo h GLN 386 Cb 0.27 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1xwo h GLN 386 CO -0.26 0.42 0.05 0.00 -0.67 0.00 0.00 178.83 178.37 1xwo h ALA 387 N 1.37 0.15 -0.97 3.87 0.00 -0.85 0.38 119.26 123.21 1xwo h ALA 387 Ca 0.31 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.19 1xwo h ALA 387 Cb 0.24 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1xwo h ALA 387 CO -0.21 -0.27 0.63 1.25 0.00 0.00 0.00 179.25 180.66 1xwo h HIS 388 N 0.04 1.16 -0.29 0.00 -0.00 -0.65 0.92 115.15 116.34 1xwo h HIS 388 Ca 0.04 0.03 -0.11 0.00 -0.00 0.00 0.00 60.37 60.33 1xwo h HIS 388 Cb 0.16 -0.38 -0.01 0.00 -0.00 0.00 0.00 27.41 27.17 1xwo h HIS 388 CO -0.02 0.61 -0.28 1.15 -0.00 0.00 0.00 177.93 179.40 1xwo h THR 389 N 1.15 1.28 0.58 6.26 2.02 -0.23 -2.40 112.91 121.56 1xwo h THR 389 Ca 0.41 -1.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.20 1xwo h THR 389 Cb 0.15 1.36 0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1xwo h THR 389 CO -0.16 0.44 -0.28 0.00 0.37 0.00 0.00 175.52 175.89 1xwo h ALA 390 N 1.20 -0.83 -1.13 6.16 0.00 0.57 -2.94 119.26 122.29 1xwo h ALA 390 Ca 0.07 -0.17 0.33 0.00 0.00 0.00 0.00 54.91 55.14 1xwo h ALA 390 Cb 0.74 0.30 -0.12 0.00 0.00 0.00 0.00 17.79 18.72 1xwo h ALA 390 CO 0.06 -0.77 0.71 1.03 0.00 0.00 0.00 179.25 180.28 1xwo h SER 391 N -1.13 0.39 0.02 0.00 0.87 -0.91 0.13 113.55 112.93 1xwo h SER 391 Ca -0.08 0.12 0.03 0.00 -1.23 0.00 0.00 61.79 60.63 1xwo h SER 391 Cb 0.60 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.60 1xwo h SER 391 CO 0.13 -0.05 -0.20 1.23 -0.53 0.00 0.00 176.83 177.41 1xwo h GLY 392 N 0.28 -0.29 1.83 5.77 0.00 -1.26 0.45 103.07 109.85 1xwo h GLY 392 Ca 0.70 0.24 -0.03 0.00 0.00 0.00 0.00 47.33 48.23 1xwo h GLY 392 CO -0.40 -0.18 -0.06 0.50 0.00 0.00 0.00 176.54 176.40 1xwo h LYS 393 N -0.33 0.22 -0.60 4.80 1.57 -0.66 0.60 116.57 122.17 1xwo h LYS 393 Ca 0.05 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 1xwo h LYS 393 Cb 0.40 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 1xwo h LYS 393 CO -0.17 0.30 0.23 0.00 -0.57 0.00 0.00 179.45 179.24 1xwo h ALA 394 N 1.73 0.78 0.12 3.86 0.00 0.03 -0.65 119.26 125.13 1xwo h ALA 394 Ca 0.05 -0.17 -0.28 0.00 0.00 0.00 0.00 54.91 54.50 1xwo h ALA 394 Cb 0.25 -0.23 0.02 0.00 0.00 0.00 0.00 17.79 17.82 1xwo h ALA 394 CO 0.01 0.40 -1.22 0.28 0.00 0.00 0.00 179.25 178.72 1xwo h VAL 395 N 0.83 1.38 -0.40 0.00 2.07 -0.24 -3.09 116.25 116.81 1xwo h VAL 395 Ca 0.20 -2.72 -0.04 0.00 0.82 0.00 0.00 66.70 64.97 1xwo h VAL 395 Cb 0.22 2.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 1xwo h VAL 395 CO -0.01 0.81 0.11 -0.74 0.02 0.00 0.00 177.57 177.75 1xwo h HIS 396 N 0.17 0.66 -0.06 1.57 6.17 -0.83 -2.14 115.15 120.69 1xwo h HIS 396 Ca -0.16 -0.07 -0.00 0.00 0.71 0.00 0.00 60.37 60.84 1xwo h HIS 396 Cb 1.91 -0.19 -0.00 0.00 2.52 0.00 0.00 27.41 31.65 1xwo h HIS 396 CO 0.09 0.63 0.02 1.25 0.71 0.00 0.00 177.93 180.62 1xwo h LEU 397 N 0.50 0.09 -1.27 0.26 6.46 -1.22 -1.06 115.31 119.08 1xwo h LEU 397 Ca 0.13 -0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 1xwo h LEU 397 Cb 0.29 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1xwo h LEU 397 CO -0.00 0.27 0.00 0.00 -0.62 0.00 0.00 178.44 178.09 1xwo h ALA 398 N 0.82 1.00 0.00 1.25 0.00 -1.54 -0.68 119.26 120.11 1xwo h ALA 398 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1xwo h ALA 398 Cb 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1xwo h ALA 398 CO -0.00 0.00 -0.65 1.49 0.00 0.00 0.00 179.25 180.09 1xwo h GLU 399 N 0.00 0.00 0.00 0.00 4.81 -0.54 -0.81 114.58 118.04 1xwo h GLU 399 Ca 0.00 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 58.99 1xwo h GLU 399 Cb 0.23 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 1xwo h GLU 399 CO 0.00 0.37 -1.47 1.79 -0.73 0.00 0.00 179.01 178.97 1xwo h THR 400 N 0.00 0.88 0.00 0.32 1.35 0.00 -3.34 112.91 112.13 1xwo h THR 400 Ca -0.03 -2.60 0.00 0.00 -0.55 0.00 0.00 66.41 63.22 1xwo h THR 400 Cb 1.35 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 70.16 1xwo h THR 400 CO 0.05 0.50 -0.30 0.11 -0.25 0.00 0.00 175.52 175.64 1xwo h LYS 401 N 0.00 0.00 0.00 4.72 1.57 -1.47 -3.48 116.57 117.91 1xwo h LYS 401 Ca -0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1xwo h LYS 401 Cb 1.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.15 1xwo h LYS 401 CO 0.08 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.37 1xwo n GLY 402 N 1.18 0.98 3.34 3.86 0.00 -1.09 -5.09 105.19 108.38 1xwo n GLY 402 Ca 0.03 -0.55 -0.18 0.00 0.00 0.00 0.00 46.02 45.32 1xwo n GLY 402 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xwo s ILE 403 N -2.00 1.07 0.13 -0.61 -4.36 -0.33 -5.05 121.20 110.04 1xwo s ILE 403 Ca 0.00 -2.04 -0.17 0.00 -0.26 0.00 0.00 60.65 58.18 1xwo s ILE 403 Cb 0.00 -2.38 -0.07 0.00 1.25 0.00 0.00 42.46 41.26 1xwo s ILE 403 CO 0.00 -0.30 0.58 0.42 0.24 0.00 0.00 174.94 175.88 1xwo s THR 404 N -3.40 4.76 0.30 8.37 -4.23 -1.26 -4.23 115.64 115.96 1xwo s THR 404 Ca 0.29 1.06 0.18 0.00 -1.18 0.00 0.00 61.69 62.03 1xwo s THR 404 Cb 0.06 -3.82 0.29 0.00 1.34 0.00 0.00 72.50 70.37 1xwo s THR 404 CO 0.09 0.37 1.23 -0.38 -0.54 0.00 0.00 174.62 175.39 1xwo n ILE 405 N 1.16 -0.31 1.83 2.99 5.41 -1.26 0.15 119.36 129.34 1xwo n ILE 405 Ca -0.07 1.55 0.15 0.00 1.00 0.00 0.00 62.75 65.38 1xwo n ILE 405 Cb 0.51 -2.53 0.88 0.00 -0.71 0.00 0.00 39.64 37.79 1xwo n ILE 405 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1xwo n ASN 406 N -4.68 0.00 -0.22 4.38 6.94 -1.26 -3.34 115.26 117.08 1xwo n ASN 406 Ca 0.30 -0.88 0.02 0.00 -0.02 0.00 0.00 54.58 54.00 1xwo n ASN 406 Cb 1.04 -0.02 0.04 0.00 -2.36 0.00 0.00 39.78 38.49 1xwo n ASN 406 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1xwo n ASN 407 N -1.02 1.95 -4.73 0.53 3.02 0.39 -5.01 115.26 110.39 1xwo n ASN 407 Ca 0.22 -1.66 -0.40 0.00 -0.03 0.00 0.00 54.58 52.71 1xwo n ASN 407 Cb 0.11 -0.05 -0.05 0.00 -0.61 0.00 0.00 39.78 39.18 1xwo n ASN 407 CO 0.00 0.00 0.00 -1.48 -2.62 0.00 0.00 177.26 173.16 1xwo s LEU 408 N -0.74 4.40 0.76 3.41 0.05 -1.21 -4.94 118.68 120.41 1xwo s LEU 408 Ca 0.07 1.37 -0.17 0.00 0.05 0.00 0.00 54.13 55.46 1xwo s LEU 408 Cb 0.04 -3.20 -0.09 0.00 -2.05 0.00 0.00 46.19 40.89 1xwo s LEU 408 CO 0.06 -0.04 -0.02 0.35 -0.55 0.00 0.00 176.35 176.14 1xwo n THR 409 N 3.20 0.65 -0.12 5.48 -2.24 -1.26 -4.74 114.28 115.24 1xwo n THR 409 Ca -0.02 -0.43 -0.04 0.00 -2.27 0.00 0.00 64.05 61.29 1xwo n THR 409 Cb 0.51 -0.33 0.16 0.00 -2.10 0.00 0.00 70.33 68.56 1xwo n THR 409 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1xwo h LEU 410 N -0.57 0.78 -1.27 3.22 5.85 -1.96 -1.01 115.31 120.36 1xwo h LEU 410 Ca -0.44 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.03 1xwo h LEU 410 Cb 1.35 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 1xwo h LEU 410 CO 0.36 0.83 -0.35 1.05 -0.34 0.00 0.00 178.44 179.99 1xwo h GLU 411 N 0.77 0.00 0.22 1.25 4.11 -1.96 -2.07 114.58 116.91 1xwo h GLU 411 Ca 0.15 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.57 1xwo h GLU 411 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1xwo h GLU 411 CO 0.01 0.35 -0.12 -0.44 0.07 0.00 0.00 179.01 178.89 1xwo h ASP 412 N 0.00 -0.28 0.25 3.06 3.45 -1.54 -2.70 116.42 118.66 1xwo h ASP 412 Ca -0.00 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.46 1xwo h ASP 412 Cb 0.68 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 39.52 1xwo h ASP 412 CO 0.05 -0.19 -0.27 -0.07 -1.57 0.00 0.00 179.24 177.19 1xwo h LEU 413 N -0.31 -0.73 -1.49 1.55 3.38 -1.09 -2.52 115.31 114.10 1xwo h LEU 413 Ca -0.03 0.06 0.43 0.00 0.09 0.00 0.00 57.88 58.43 1xwo h LEU 413 Cb 0.25 0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.18 1xwo h LEU 413 CO 0.04 -0.34 1.32 0.29 0.09 0.00 0.00 178.44 179.84 1xwo n LYS 414 N -3.96 0.01 0.19 1.13 4.76 -0.80 0.15 118.16 119.63 1xwo n LYS 414 Ca -0.06 1.05 0.05 0.00 -2.87 0.00 0.00 58.31 56.48 1xwo n LYS 414 Cb 0.24 -2.52 0.38 0.00 -1.84 0.00 0.00 35.03 31.29 1xwo n LYS 414 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1xwo h SER 415 N 0.00 0.00 0.19 4.39 4.64 -1.11 -2.98 113.55 118.68 1xwo h SER 415 Ca 0.71 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.67 1xwo h SER 415 Cb 3.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 65.43 1xwo h SER 415 CO -0.01 0.36 -1.81 0.40 -0.87 0.00 0.00 176.83 174.90 1xwo h ILE 416 N 0.00 0.86 -2.35 0.95 2.04 0.13 -3.47 117.51 115.66 1xwo h ILE 416 Ca -0.00 -2.48 -0.05 0.00 1.00 0.00 0.00 64.86 63.33 1xwo h ILE 416 Cb 0.77 2.69 -0.24 0.00 -0.74 0.00 0.00 36.82 39.30 1xwo h ILE 416 CO 0.05 0.87 -0.18 -0.55 0.00 0.00 0.00 178.15 178.33 1xwo s SER 417 N -7.20 -0.69 0.00 1.72 0.15 -0.96 -5.01 113.70 101.71 1xwo s SER 417 Ca -0.17 1.18 0.16 0.00 0.70 0.00 0.00 55.95 57.81 1xwo s SER 417 Cb 0.06 1.17 0.86 0.00 -1.71 0.00 0.00 66.02 66.40 1xwo s SER 417 CO 0.83 -0.22 1.39 -0.81 1.20 0.00 0.00 173.24 175.63 1xwo n PRO 418 N 4.50 0.37 0.00 5.44 -0.04 -1.22 -2.43 135.00 141.62 1xwo n PRO 418 Ca -0.20 0.07 0.14 0.00 -0.04 0.00 0.00 63.50 63.47 1xwo n PRO 418 Cb 0.55 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 33.06 1xwo n PRO 418 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xwo n LEU 419 N -1.13 0.24 -4.56 1.53 4.32 -1.26 -4.68 117.00 111.45 1xwo n LEU 419 Ca 0.10 0.23 -0.33 0.00 -0.02 0.00 0.00 56.01 56.00 1xwo n LEU 419 Cb 0.08 -0.34 -0.04 0.00 -1.62 0.00 0.00 43.42 41.51 1xwo n LEU 419 CO 0.10 0.05 1.43 -0.36 -1.22 0.00 0.00 177.39 177.39 1xwo s PHE 420 N -2.82 2.12 0.00 -1.77 2.99 -1.02 -4.95 117.98 112.53 1xwo s PHE 420 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 56.93 57.11 1xwo s PHE 420 Cb 0.19 -4.31 0.00 0.00 0.00 0.00 0.00 43.02 38.90 1xwo s PHE 420 CO 0.55 -1.78 0.00 0.43 -0.00 0.00 0.00 175.22 174.42 1xwo n SER 421 N 11.93 0.00 -0.57 1.36 7.64 -1.26 -4.64 113.62 128.08 1xwo n SER 421 Ca 0.38 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.34 1xwo n SER 421 Cb 0.48 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.73 1xwo n SER 421 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1xwo n SER 422 N 0.00 2.15 -0.32 6.43 3.41 -1.26 -4.18 113.62 119.84 1xwo n SER 422 Ca 0.00 -1.57 0.15 0.00 -0.26 0.00 0.00 58.87 57.18 1xwo n SER 422 Cb 0.00 0.13 0.66 0.00 -0.26 0.00 0.00 64.21 64.74 1xwo n SER 422 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1xwo n ASP 423 N 0.63 1.00 0.26 4.04 5.75 -1.26 -3.57 116.55 123.40 1xwo n ASP 423 Ca 0.09 -1.33 0.11 0.00 -0.01 0.00 0.00 54.79 53.64 1xwo n ASP 423 Cb 0.39 0.00 0.71 0.00 -1.03 0.00 0.00 41.12 41.18 1xwo n ASP 423 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1xwo h VAL 424 N 1.57 0.79 0.00 2.12 2.07 -1.94 -0.39 116.25 120.48 1xwo h VAL 424 Ca 0.00 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1xwo h VAL 424 Cb 0.34 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1xwo h VAL 424 CO 0.00 0.08 0.00 -1.54 0.02 0.00 0.00 177.57 176.13 1xwo n SER 425 N -4.06 0.52 0.11 0.57 3.41 -1.23 -0.88 113.62 112.06 1xwo n SER 425 Ca -0.03 0.74 -0.23 0.00 -0.26 0.00 0.00 58.87 59.10 1xwo n SER 425 Cb 0.16 -0.81 -0.14 0.00 -0.26 0.00 0.00 64.21 63.16 1xwo n SER 425 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1xwo h GLN 426 N 0.00 0.54 -1.00 4.33 1.08 -1.34 -3.26 115.11 115.46 1xwo h GLN 426 Ca 0.00 -0.82 0.21 0.00 -1.45 0.00 0.00 58.65 56.60 1xwo h GLN 426 Cb 0.01 0.29 -0.11 0.00 -0.05 0.00 0.00 27.48 27.61 1xwo h GLN 426 CO 0.00 1.38 0.61 0.28 -0.95 0.00 0.00 178.83 180.15 1xwo h VAL 427 N 0.11 0.63 -0.29 -0.54 2.07 -1.12 -2.59 116.25 114.53 1xwo h VAL 427 Ca -0.21 -0.24 -0.50 0.00 0.82 0.00 0.00 66.70 66.58 1xwo h VAL 427 Cb 1.96 -0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 1xwo h VAL 427 CO 0.24 0.13 1.82 0.49 0.02 0.00 0.00 177.57 180.26 1xwo n PHE 428 N -4.81 1.53 -3.39 1.57 3.01 -1.21 -4.66 117.46 109.49 1xwo n PHE 428 Ca 0.25 -2.38 -0.16 0.00 1.01 0.00 0.00 57.45 56.17 1xwo n PHE 428 Cb 0.65 -1.97 -0.09 0.00 -0.01 0.00 0.00 39.48 38.05 1xwo n PHE 428 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1xwo s ASN 429 N 1.65 1.45 0.32 4.37 3.84 -0.98 -5.04 114.94 120.55 1xwo s ASN 429 Ca 0.65 -0.65 0.11 0.00 0.21 0.00 0.00 52.86 53.18 1xwo s ASN 429 Cb 0.25 0.60 0.99 0.00 -0.55 0.00 0.00 41.25 42.54 1xwo s ASN 429 CO -0.06 -0.38 1.47 0.49 -2.79 0.00 0.00 177.10 175.83 1xwo n PHE 430 N 5.32 0.85 -0.22 0.43 0.99 -1.26 0.52 117.46 124.08 1xwo n PHE 430 Ca -0.02 1.12 -0.07 0.00 -0.00 0.00 0.00 57.45 58.48 1xwo n PHE 430 Cb 0.47 -1.36 0.04 0.00 -1.00 0.00 0.00 39.48 37.63 1xwo n PHE 430 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1xwo h VAL 431 N 0.00 1.22 -0.72 -4.37 2.07 -1.96 -1.77 116.25 110.72 1xwo h VAL 431 Ca 0.68 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.62 1xwo h VAL 431 Cb 1.64 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.83 1xwo h VAL 431 CO -0.80 0.25 0.46 0.78 0.02 0.00 0.00 177.57 178.28 1xwo h ASN 432 N 0.86 0.78 -0.31 0.57 2.35 -0.24 -2.32 115.58 117.26 1xwo h ASN 432 Ca 0.21 -0.01 0.07 0.00 -0.55 0.00 0.00 56.30 56.03 1xwo h ASN 432 Cb 0.11 -0.18 -0.08 0.00 0.05 0.00 0.00 38.32 38.22 1xwo h ASN 432 CO -0.03 0.55 -0.22 -1.28 -1.65 0.00 0.00 177.43 174.80 1xwo h SER 433 N 0.92 -0.73 0.07 5.81 0.87 -0.55 -2.30 113.55 117.66 1xwo h SER 433 Ca 0.28 0.15 -0.00 0.00 -1.23 0.00 0.00 61.79 60.98 1xwo h SER 433 Cb -0.04 0.36 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1xwo h SER 433 CO -0.09 -0.25 -0.03 -0.37 -0.53 0.00 0.00 176.83 175.56 1xwo h VAL 434 N -0.19 1.07 0.00 2.23 -1.51 -1.27 -2.73 116.25 113.85 1xwo h VAL 434 Ca 0.16 -0.51 0.00 0.00 -1.23 0.00 0.00 66.70 65.12 1xwo h VAL 434 Cb 0.44 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 1xwo h VAL 434 CO -0.43 0.13 0.33 -0.33 -1.23 0.00 0.00 177.57 176.04 1xwo h GLU 435 N -0.32 0.00 -0.90 5.19 4.39 -1.20 0.20 114.58 121.94 1xwo h GLU 435 Ca -0.01 0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.80 1xwo h GLU 435 Cb 0.28 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.85 1xwo h GLU 435 CO 0.02 0.00 0.53 1.96 -1.16 0.00 0.00 179.01 180.36 1xwo h GLN 436 N 0.00 0.83 -4.73 2.33 4.20 -1.09 -3.32 115.11 113.33 1xwo h GLN 436 Ca 0.00 -0.05 -0.73 0.00 0.06 0.00 0.00 58.65 57.93 1xwo h GLN 436 Cb 0.66 -0.19 -0.14 0.00 0.30 0.00 0.00 27.48 28.12 1xwo h GLN 436 CO 0.00 0.55 1.82 0.66 -0.67 0.00 0.00 178.83 181.19 1xwo n TYR 437 N -4.71 4.42 1.02 2.96 4.02 0.70 -4.67 117.16 120.91 1xwo n TYR 437 Ca 0.16 -3.11 0.11 0.00 -0.01 0.00 0.00 57.90 55.05 1xwo n TYR 437 Cb 0.32 -2.28 0.01 0.00 -0.02 0.00 0.00 39.34 37.38 1xwo n TYR 437 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1xwo n THR 438 N 4.83 0.00 -2.02 -0.72 -2.24 -1.25 -1.02 114.28 111.86 1xwo n THR 438 Ca 0.41 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.71 1xwo n THR 438 Cb 0.42 0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 69.49 1xwo n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xwo s ALA 439 N -2.85 3.68 -0.07 6.98 0.00 -1.26 -4.80 121.76 123.44 1xwo s ALA 439 Ca 0.12 1.29 -0.17 0.00 0.00 0.00 0.00 51.96 53.20 1xwo s ALA 439 Cb 0.17 -3.58 -0.08 0.00 0.00 0.00 0.00 23.12 19.63 1xwo s ALA 439 CO 0.75 -0.72 0.51 -1.33 0.00 0.00 0.00 175.76 174.97 1xwo n MET 440 N 3.50 0.00 -0.79 0.00 2.81 -1.26 -0.88 117.12 120.50 1xwo n MET 440 Ca 0.11 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.00 1xwo n MET 440 Cb 0.40 -0.60 0.00 0.00 -0.71 0.00 0.00 33.22 32.31 1xwo n MET 440 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xwo n GLY 441 N 0.97 0.97 0.22 3.03 0.00 -1.26 -5.04 105.19 104.08 1xwo n GLY 441 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 1xwo n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xwo n GLY 442 N -2.00 -1.91 0.89 -0.02 0.00 -0.05 -5.00 105.19 97.10 1xwo n GLY 442 Ca 0.00 -1.54 0.12 0.00 0.00 0.00 0.00 46.02 44.60 1xwo n GLY 442 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1xwo n THR 443 N -2.42 0.01 -1.92 2.61 5.66 -1.12 -4.41 114.28 112.70 1xwo n THR 443 Ca 0.01 -0.47 -0.39 0.00 -3.05 0.00 0.00 64.05 60.15 1xwo n THR 443 Cb 0.03 1.34 0.01 0.00 -1.55 0.00 0.00 70.33 70.16 1xwo n THR 443 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xwo s ALA 444 N -1.99 3.15 0.22 1.79 0.00 -0.19 -4.54 121.76 120.19 1xwo s ALA 444 Ca 0.30 1.32 -0.05 0.00 0.00 0.00 0.00 51.96 53.52 1xwo s ALA 444 Cb 0.20 -3.53 0.37 0.00 0.00 0.00 0.00 23.12 20.16 1xwo s ALA 444 CO 0.31 -1.06 1.20 1.17 0.00 0.00 0.00 175.76 177.37 1xwo n LYS 445 N -0.26 -0.07 -0.01 0.00 3.00 -1.26 -0.26 118.16 119.30 1xwo n LYS 445 Ca 0.06 1.19 -0.11 0.00 -0.00 0.00 0.00 58.31 59.45 1xwo n LYS 445 Cb 0.43 -1.79 -0.05 0.00 0.00 0.00 0.00 35.03 33.62 1xwo n LYS 445 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1xwo h SER 446 N 0.00 0.13 -0.60 3.14 4.64 -1.95 -1.97 113.55 116.95 1xwo h SER 446 Ca 0.38 -0.06 0.09 0.00 -0.47 0.00 0.00 61.79 61.72 1xwo h SER 446 Cb 0.60 -0.03 -0.07 0.00 -0.31 0.00 0.00 62.40 62.58 1xwo h SER 446 CO -0.78 0.16 0.23 -1.28 -0.87 0.00 0.00 176.83 174.28 1xwo h SER 447 N 0.10 0.24 -0.86 4.97 0.87 -0.92 0.17 113.55 118.12 1xwo h SER 447 Ca 0.04 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1xwo h SER 447 Cb 0.05 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.02 1xwo h SER 447 CO -0.01 0.15 0.46 0.58 -0.53 0.00 0.00 176.83 177.48 1xwo h VAL 448 N 0.42 1.25 -0.06 2.23 2.07 -1.08 0.72 116.25 121.80 1xwo h VAL 448 Ca 0.30 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1xwo h VAL 448 Cb 0.36 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1xwo h VAL 448 CO -0.29 0.29 0.03 0.74 0.02 0.00 0.00 177.57 178.35 1xwo h THR 449 N 1.20 1.11 -0.08 2.57 2.02 -0.42 -1.80 112.91 117.51 1xwo h THR 449 Ca 0.30 -0.31 0.04 0.00 0.77 0.00 0.00 66.41 67.21 1xwo h THR 449 Cb 0.04 1.21 -0.05 0.00 -1.74 0.00 0.00 68.15 67.61 1xwo h THR 449 CO -0.05 0.09 -0.27 0.74 0.37 0.00 0.00 175.52 176.41 1xwo h THR 450 N -0.03 0.38 -0.38 3.16 2.02 -0.22 -2.01 112.91 115.84 1xwo h THR 450 Ca 0.02 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.28 1xwo h THR 450 Cb 0.12 0.38 -0.09 0.00 -1.74 0.00 0.00 68.15 66.83 1xwo h THR 450 CO -0.00 0.00 -0.25 1.56 0.37 0.00 0.00 175.52 177.20 1xwo h GLN 451 N -0.36 -0.19 -0.52 6.66 4.20 -0.69 -1.16 115.11 123.06 1xwo h GLN 451 Ca 0.08 0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.90 1xwo h GLN 451 Cb 0.49 0.04 -0.10 0.00 0.30 0.00 0.00 27.48 28.21 1xwo h GLN 451 CO -0.29 -0.12 -0.36 0.82 -0.67 0.00 0.00 178.83 178.21 1xwo h ILE 452 N -0.19 0.16 -0.21 2.54 2.04 -0.68 -1.34 117.51 119.82 1xwo h ILE 452 Ca 0.18 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.09 1xwo h ILE 452 Cb 0.48 0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.67 1xwo h ILE 452 CO -0.49 0.00 -0.14 -0.33 0.00 0.00 0.00 178.15 177.19 1xwo h GLU 453 N -0.22 -0.13 -0.45 2.37 5.08 -0.56 -0.50 114.58 120.18 1xwo h GLU 453 Ca 0.20 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.65 1xwo h GLU 453 Cb 0.55 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.76 1xwo h GLU 453 CO -0.64 -0.08 0.01 0.45 -1.00 0.00 0.00 179.01 177.75 1xwo h HIS 454 N -0.13 -0.00 -0.22 4.33 3.86 -0.30 0.05 115.15 122.74 1xwo h HIS 454 Ca 0.12 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.28 1xwo h HIS 454 Cb 0.31 0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 1xwo h HIS 454 CO -0.30 -0.08 -0.24 -0.07 0.86 0.00 0.00 177.93 178.10 1xwo h LEU 455 N 0.13 0.41 -1.09 2.43 3.38 -1.00 -0.77 115.31 118.80 1xwo h LEU 455 Ca 0.22 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1xwo h LEU 455 Cb 0.32 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1xwo h LEU 455 CO -0.36 0.65 -0.37 0.03 0.09 0.00 0.00 178.44 178.48 1xwo h ARG 456 N 0.36 0.15 -0.01 1.13 2.47 -0.03 -2.33 114.38 116.13 1xwo h ARG 456 Ca 0.06 -0.06 -0.12 0.00 -1.26 0.00 0.00 59.98 58.59 1xwo h ARG 456 Cb 0.63 -0.01 0.01 0.00 -1.65 0.00 0.00 29.97 28.95 1xwo h ARG 456 CO 0.04 0.51 -0.47 0.93 0.56 0.00 0.00 179.97 181.55 1xwo h GLU 457 N 0.13 0.34 -0.78 0.04 4.39 -0.54 -2.72 114.58 115.43 1xwo h GLU 457 Ca 0.01 -0.35 0.13 0.00 0.34 0.00 0.00 59.36 59.50 1xwo h GLU 457 Cb 0.73 0.10 -0.09 0.00 -0.10 0.00 0.00 28.75 29.38 1xwo h GLU 457 CO 0.05 1.03 0.37 -0.07 -1.16 0.00 0.00 179.01 179.23 1xwo h LEU 458 N -0.22 0.43 -1.00 1.33 3.38 -1.04 0.19 115.31 118.39 1xwo h LEU 458 Ca -0.06 0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1xwo h LEU 458 Cb 1.19 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1xwo h LEU 458 CO 0.09 0.20 -0.48 0.24 0.09 0.00 0.00 178.44 178.58 1xwo h MET 459 N 0.56 0.05 0.17 1.13 2.86 -1.46 -1.77 114.93 116.46 1xwo h MET 459 Ca 0.41 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 58.02 1xwo h MET 459 Cb 0.56 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1xwo h MET 459 CO -0.35 0.52 -0.08 -0.22 1.06 0.00 0.00 176.91 177.84 1xwo h LYS 460 N 0.04 -0.22 0.63 1.72 3.64 -0.40 -3.25 116.57 118.72 1xwo h LYS 460 Ca -0.00 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 1xwo h LYS 460 Cb 0.87 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 1xwo h LYS 460 CO 0.06 0.08 -0.42 0.87 -2.27 0.00 0.00 179.45 177.78 1xwo h LYS 461 N -0.52 -0.95 -2.71 1.90 1.57 -0.91 -3.12 116.57 111.84 1xwo h LYS 461 Ca -0.02 0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1xwo h LYS 461 Cb 0.40 0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1xwo h LYS 461 CO 0.04 -0.63 0.30 1.04 -0.57 0.00 0.00 179.45 179.63 1xwo n GLN 462 N -5.02 0.29 0.00 3.15 6.02 -0.67 -3.58 117.38 117.56 1xwo n GLN 462 Ca -0.12 -0.13 0.07 0.00 -0.01 0.00 0.00 57.00 56.80 1xwo n GLN 462 Cb 0.42 -1.55 -0.02 0.00 1.02 0.00 0.00 30.24 30.10 1xwo n GLN 462 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1xwo n LYS 463 N 2.76 2.01 0.00 -1.09 4.76 -1.18 -4.93 118.16 120.49 1xwo n LYS 463 Ca 0.06 -0.54 0.00 0.00 -2.87 0.00 0.00 58.31 54.96 1xwo n LYS 463 Cb 0.13 -1.19 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 1xwo n LYS 463 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42